From efda3b91592abd5f46db041dfc48ee2b2ff5d75b Mon Sep 17 00:00:00 2001 From: Liza Kozlova Date: Tue, 11 Jul 2023 14:43:15 +0000 Subject: [PATCH 1/7] fix: skip files larger than 10 MB --- proteinflow/processing/__init__.py | 2 ++ 1 file changed, 2 insertions(+) diff --git a/proteinflow/processing/__init__.py b/proteinflow/processing/__init__.py index 81d29c8..956cc40 100644 --- a/proteinflow/processing/__init__.py +++ b/proteinflow/processing/__init__.py @@ -144,6 +144,8 @@ def process_f( sabdab=False, ): pdb_path, fasta_path = local_paths + if os.path.getsize(pdb_path) > 1e7: + raise PDBError("PDB / mmCIF file is too large") chain_id = None if sabdab: pdb_path, chain_id = pdb_path From 931cdabab00c733e57104e79c7e378744da16a7b Mon Sep 17 00:00:00 2001 From: Liza Kozlova Date: Wed, 12 Jul 2023 09:26:06 +0000 Subject: [PATCH 2/7] fix: log large file exception and add a max_chains argument --- proteinflow/__init__.py | 4 ++++ proteinflow/cli.py | 3 +++ proteinflow/download/__init__.py | 11 +++++++++++ proteinflow/processing/__init__.py | 14 ++++++++++++-- 4 files changed, 30 insertions(+), 2 deletions(-) diff --git a/proteinflow/__init__.py b/proteinflow/__init__.py index f5e9e9a..23410ea 100644 --- a/proteinflow/__init__.py +++ b/proteinflow/__init__.py @@ -243,6 +243,7 @@ def generate_data( exclude_clusters=False, exclude_based_on_cdr=None, random_seed=42, + max_chains=5, ): """Download and parse PDB files that meet filtering criteria. @@ -321,6 +322,8 @@ def generate_data( if given and `exclude_clusters` is `True` + the dataset is SAbDab, exclude files based on only the given CDR clusters random_seed : int, default 42 the random seed to use for splitting + max_chains : int, default 5 + the maximum number of chains per biounit Returns ------- @@ -359,6 +362,7 @@ def generate_data( sabdab=sabdab, sabdab_data_path=sabdab_data_path, require_antigen=require_antigen, + max_chains=max_chains, ) if not skip_splitting: split_data( diff --git a/proteinflow/cli.py b/proteinflow/cli.py index e37dd0a..aba0fbe 100644 --- a/proteinflow/cli.py +++ b/proteinflow/cli.py @@ -169,6 +169,9 @@ def download(**kwargs): type=int, help="The random seed to use for splitting", ) +@click.option( + "--max_chains", default=5, type=int, help="The maximum number of chains per biounit" +) @cli.command("generate", help="Generate a new ProteinFlow dataset") def generate(**kwargs): """Generate a new ProteinFlow dataset.""" diff --git a/proteinflow/download/__init__.py b/proteinflow/download/__init__.py index 48cd86e..d630c8f 100644 --- a/proteinflow/download/__init__.py +++ b/proteinflow/download/__init__.py @@ -120,6 +120,7 @@ def get_pdb_ids( resolution_thr=3.5, pdb_snapshot=None, filter_methods=True, + max_chains=5, ): """Get PDB ids from PDB API.""" # get filtered PDB ids from PDB API @@ -132,6 +133,10 @@ def get_pdb_ids( # if include_na: # pdb_ids = pdb_ids.or_('rcsb_entry_info.polymer_composition').in_(["protein/NA", "protein/NA/oligosaccharide"]) + if max_chains is not None: + pdb_ids = pdb_ids.and_( + "rcsb_assembly_info.polymer_entity_instance_count_protein" + ).__le__(max_chains) if resolution_thr is not None: pdb_ids = pdb_ids.and_("rcsb_entry_info.resolution_combined").__le__( resolution_thr @@ -189,6 +194,7 @@ def download_filtered_pdb_files( n=None, local_folder=".", load_live=False, + max_chains=5, ): """Download filtered PDB files and return a list of local file paths. @@ -207,6 +213,8 @@ def download_filtered_pdb_files( load_live : bool, default False Whether to load the PDB files from the RCSB PDB database directly instead of downloading them from the PDB snapshots + max_chains : int, default 5 + Maximum number of chains per biounit Returns ------- @@ -220,6 +228,7 @@ def download_filtered_pdb_files( resolution_thr=resolution_thr, pdb_snapshot=pdb_snapshot, filter_methods=filter_methods, + max_chains=max_chains, ) with ThreadPoolExecutor(max_workers=8) as executor: print("Getting a file list...") @@ -532,6 +541,7 @@ def _load_files( sabdab=False, sabdab_data_path=None, require_antigen=False, + max_chains=5, ): """Download filtered structure files and return a list of local file paths.""" if sabdab: @@ -552,6 +562,7 @@ def _load_files( local_folder=local_folder, load_live=load_live, n=n, + max_chains=max_chains, ) paths = [(x, _get_fasta_path(x)) for x in paths] return paths, error_ids diff --git a/proteinflow/processing/__init__.py b/proteinflow/processing/__init__.py index 956cc40..8243b9e 100644 --- a/proteinflow/processing/__init__.py +++ b/proteinflow/processing/__init__.py @@ -35,6 +35,7 @@ def run_processing( sabdab=False, sabdab_data_path=None, require_antigen=False, + max_chains=5, ): """Download and parse PDB files that meet filtering criteria. @@ -91,6 +92,8 @@ def run_processing( path to a zip file or a directory containing SAbDab files (only used if `sabdab` is `True`) require_antigen : bool, default False if `True`, only keep files with antigen chains (only used if `sabdab` is `True`) + max_chains : int, default 5 + the maximum number of chains per biounit Returns ------- @@ -144,8 +147,6 @@ def process_f( sabdab=False, ): pdb_path, fasta_path = local_paths - if os.path.getsize(pdb_path) > 1e7: - raise PDBError("PDB / mmCIF file is too large") chain_id = None if sabdab: pdb_path, chain_id = pdb_path @@ -160,6 +161,14 @@ def process_f( antigen = antigen.split(" | ") fn = os.path.basename(pdb_path) pdb_id = fn.split(".")[0] + if os.path.getsize(pdb_path) > 1e7: + _log_exception( + PDBError("PDB / mmCIF file is too large"), + LOG_FILE, + pdb_id, + TMP_FOLDER, + chain_id=chain_id, + ) try: # local_path = download_f(pdb_id, s3_client=s3_client, load_live=load_live) name = pdb_id if not sabdab else pdb_id + "-" + chain_id @@ -204,6 +213,7 @@ def process_f( sabdab=sabdab, sabdab_data_path=sabdab_data_path, require_antigen=require_antigen, + max_chains=max_chains, ) for id in error_ids: with open(LOG_FILE, "a") as f: From 42e0314c1cb6618d4f5052bbcd8edcf896ebe95b Mon Sep 17 00:00:00 2001 From: Liza Kozlova Date: Wed, 12 Jul 2023 10:15:11 +0000 Subject: [PATCH 3/7] refactor: rename parameters, change default max_chains + minor changes --- proteinflow/__init__.py | 6 +++--- proteinflow/cli.py | 5 ++++- proteinflow/processing/__init__.py | 9 +++++---- 3 files changed, 12 insertions(+), 8 deletions(-) diff --git a/proteinflow/__init__.py b/proteinflow/__init__.py index 23410ea..da7a172 100644 --- a/proteinflow/__init__.py +++ b/proteinflow/__init__.py @@ -243,7 +243,7 @@ def generate_data( exclude_clusters=False, exclude_based_on_cdr=None, random_seed=42, - max_chains=5, + max_chains=10, ): """Download and parse PDB files that meet filtering criteria. @@ -322,7 +322,7 @@ def generate_data( if given and `exclude_clusters` is `True` + the dataset is SAbDab, exclude files based on only the given CDR clusters random_seed : int, default 42 the random seed to use for splitting - max_chains : int, default 5 + max_chains : int, default 10 the maximum number of chains per biounit Returns @@ -353,7 +353,7 @@ def generate_data( missing_middle_thr=missing_middle_thr, filter_methods=filter_methods, remove_redundancies=remove_redundancies, - seq_identity_threshold=redundancy_thr, + redundancy_thr=redundancy_thr, n=n, force=force, tag=tag, diff --git a/proteinflow/cli.py b/proteinflow/cli.py index aba0fbe..f8c5a5f 100644 --- a/proteinflow/cli.py +++ b/proteinflow/cli.py @@ -170,7 +170,10 @@ def download(**kwargs): help="The random seed to use for splitting", ) @click.option( - "--max_chains", default=5, type=int, help="The maximum number of chains per biounit" + "--max_chains", + default=10, + type=int, + help="The maximum number of chains per biounit", ) @cli.command("generate", help="Generate a new ProteinFlow dataset") def generate(**kwargs): diff --git a/proteinflow/processing/__init__.py b/proteinflow/processing/__init__.py index 8243b9e..7a55d6e 100644 --- a/proteinflow/processing/__init__.py +++ b/proteinflow/processing/__init__.py @@ -26,7 +26,7 @@ def run_processing( missing_middle_thr=0.1, filter_methods=True, remove_redundancies=False, - seq_identity_threshold=0.9, + redundancy_thr=0.9, n=None, force=False, tag=None, @@ -74,7 +74,7 @@ def run_processing( If `True`, only files obtained with X-ray or EM will be processed remove_redundancies : bool, default False If `True`, removes biounits that are doubles of others sequence wise - seq_identity_threshold : float, default 0.9 + redundancy_thr : float, default 0.9 The threshold upon which sequences are considered as one and the same (default: 90%) n : int, default None The number of files to process (for debugging purposes) @@ -131,8 +131,9 @@ def run_processing( f.write(f" remove_redundancies: {remove_redundancies} \n") f.write(f" sabdab: {sabdab} \n") f.write(f" pdb_snapshot: {pdb_snapshot} \n") + f.write(f" max_chains: {max_chains} \n") if remove_redundancies: - f.write(f" seq_identity_threshold: {seq_identity_threshold} \n") + f.write(f" redundancy_threshold: {redundancy_thr} \n") if sabdab: f.write(f" require_antigen: {require_antigen} \n") f.write(f" sabdab_data_path: {sabdab_data_path} \n") @@ -258,7 +259,7 @@ def process_f( if remove_redundancies: removed = _remove_database_redundancies( - OUTPUT_FOLDER, seq_identity_threshold=seq_identity_threshold + OUTPUT_FOLDER, seq_identity_threshold=redundancy_thr ) _log_removed(removed, LOG_FILE) From 6146d1804cb6661967082ae0bded41a81043ffa4 Mon Sep 17 00:00:00 2001 From: Liza Kozlova Date: Wed, 12 Jul 2023 15:47:27 +0000 Subject: [PATCH 4/7] fix: mmcif processing bug --- log_Tmp.txt | 14878 +++++++++++++++++++++++++++ proteinflow/data/utils.py | 18 +- proteinflow/processing/__init__.py | 7 +- 3 files changed, 14900 insertions(+), 3 deletions(-) create mode 100644 log_Tmp.txt diff --git a/log_Tmp.txt b/log_Tmp.txt new file mode 100644 index 0000000..754361b --- /dev/null +++ b/log_Tmp.txt @@ -0,0 +1,14878 @@ +07/12/2023, 10:11:42 + +tag: 20230102_v141 + min_length: 30 + max_length: 10000 + resolution_thr: 3.5 + missing_ends_thr: 0.3 + missing_middle_thr: 0.1 + filter_methods: True + remove_redundancies: False + sabdab: False + pdb_snapshot: 20230102 + load_live: False + +07/12/2023, 10:12:45 + +tag: 20230102_v141 + min_length: 30 + max_length: 10000 + resolution_thr: 3.5 + missing_ends_thr: 0.3 + missing_middle_thr: 0.1 + filter_methods: True + remove_redundancies: False + sabdab: False + pdb_snapshot: 20230102 + max_chains: 10 + load_live: False + +<<< Could not download PDB/mmCIF file: 7QCN-1 +<<< Could not download PDB/mmCIF file: 7TRO-1 +<<< Could not download PDB/mmCIF file: 7VWB-1 +<<< Could not download PDB/mmCIF file: 7X36-1 +<<< Could not download PDB/mmCIF file: 7XSW-1 +<<< Could not download PDB/mmCIF file: 7YCL-2 +<<< Could not download PDB/mmCIF file: 8A17-1 +<<< Could not download PDB/mmCIF file: 8CEM-2 +<<< Could not download PDB/mmCIF file: 8DL2-4 +<<< Could not download PDB/mmCIF file: 8EDK-1 +<<< Could not download PDB/mmCIF file: 8FHD-1 +<<< Could not download PDB/mmCIF file: 8G3T-1 +<<< Could not download PDB/mmCIF file: 8IDP-1 +<<< Could not download PDB/mmCIF file: 7E4A-1 +<<< Could not download PDB/mmCIF file: 7FRX-2 +<<< Could not download PDB/mmCIF file: 7FSJ-4 +<<< Could not download PDB/mmCIF file: 7FSW-2 +<<< Could not download PDB/mmCIF file: 7FT8-4 +<<< Could not download PDB/mmCIF file: 7FVL-1 +<<< Could not download PDB/mmCIF file: 7FWY-1 +<<< Could not download PDB/mmCIF file: 7FY8-4 +<<< Could not download PDB/mmCIF file: 7FZD-1 +<<< Could not download PDB/mmCIF file: 7G09-1 +<<< Could not download PDB/mmCIF file: 7G1L-1 +<<< Could not download PDB/mmCIF file: 7G8W-1 +<<< Could not download PDB/mmCIF file: 7Q4X-1 +<<< Could not download PDB/mmCIF file: 7QLI-1 +<<< Could not download PDB/mmCIF file: 7QO2-1 +<<< Could not download PDB/mmCIF file: 7QUI-1 +<<< Could not download PDB/mmCIF file: 7QW4-5 +<<< Could not download PDB/mmCIF file: 7QXF-1 +<<< Could not download PDB/mmCIF file: 7R2Y-1 +<<< Could not download PDB/mmCIF file: 7RYK-2 +<<< Could not download PDB/mmCIF file: 7SCV-1 +<<< Could not download PDB/mmCIF file: 7SVI-1 +<<< Could not download PDB/mmCIF file: 7T4U-1 +<<< Could not download PDB/mmCIF file: 7T8S-3 +<<< Could not download PDB/mmCIF file: 7TL6-1 +<<< Could not download PDB/mmCIF file: 7TSW-5 +<<< Could not download PDB/mmCIF file: 7TUN-2 +<<< Could not download PDB/mmCIF file: 7TZY-1 +<<< Could not download PDB/mmCIF file: 7U6H-3 +<<< Could not download PDB/mmCIF file: 7ULQ-4 +<<< Could not download PDB/mmCIF file: 7UR2-6 +<<< Could not download PDB/mmCIF file: 7UVD-1 +<<< Could not download PDB/mmCIF file: 7VA1-4 +<<< Could not download PDB/mmCIF file: 7WNJ-1 +<<< Could not download PDB/mmCIF file: 7WU1-1 +<<< Could not download PDB/mmCIF file: 7WW0-1 +<<< Could not download PDB/mmCIF file: 7X4J-1 +<<< Could not download PDB/mmCIF file: 7XBN-1 +<<< Could not download PDB/mmCIF file: 7XHW-2 +<<< Could not download PDB/mmCIF file: 7XJB-4 +<<< Could not download PDB/mmCIF file: 7XMK-1 +<<< Could not download PDB/mmCIF file: 7XR1-1 +<<< Could not download PDB/mmCIF file: 7XUK-1 +<<< Could not download PDB/mmCIF file: 7XXT-1 +<<< Could not download PDB/mmCIF file: 7Y0X-2 +<<< Could not download PDB/mmCIF file: 7Y3V-1 +<<< Could not download PDB/mmCIF file: 7Y5M-1 +<<< Could not download PDB/mmCIF file: 7Y8B-1 +<<< Could not download PDB/mmCIF file: 7Y9M-1 +<<< Could not download PDB/mmCIF file: 7YC4-4 +<<< Could not download PDB/mmCIF file: 7YE6-1 +<<< Could not download PDB/mmCIF file: 7YHC-3 +<<< Could not download PDB/mmCIF file: 7YJI-1 +<<< Could not download PDB/mmCIF file: 7YME-2 +<<< Could not download PDB/mmCIF file: 7YOU-1 +<<< Could not download PDB/mmCIF file: 7YYF-2 +<<< Could not download PDB/mmCIF file: 7YZW-2 +<<< Could not download PDB/mmCIF file: 7Z1F-1 +<<< Could not download PDB/mmCIF file: 7ZAC-1 +<<< Could not download PDB/mmCIF file: 7ZBH-1 +<<< Could not download PDB/mmCIF file: 7ZDN-2 +<<< Could not download PDB/mmCIF file: 7ZK7-1 +<<< Could not download PDB/mmCIF file: 7ZLT-1 +<<< Could not download PDB/mmCIF file: 7ZOB-1 +<<< Could not download PDB/mmCIF file: 7ZTL-1 +<<< Could not download PDB/mmCIF file: 7ZV6-2 +<<< Could not download PDB/mmCIF file: 7ZX4-1 +<<< Could not download PDB/mmCIF file: 8A3X-2 +<<< Could not download PDB/mmCIF file: 8A70-1 +<<< Could not download PDB/mmCIF file: 8A8Z-2 +<<< Could not download PDB/mmCIF file: 8AAP-1 +<<< Could not download PDB/mmCIF file: 8AD5-1 +<<< Could not download PDB/mmCIF file: 8AET-1 +<<< Could not download PDB/mmCIF file: 8AFU-2 +<<< Could not download PDB/mmCIF file: 8AHT-4 +<<< Could not download PDB/mmCIF file: 8AQ8-3 +<<< Could not download PDB/mmCIF file: 8AST-1 +<<< Could not download PDB/mmCIF file: 8AUZ-1 +<<< Could not download PDB/mmCIF file: 8AWY-1 +<<< Could not download PDB/mmCIF file: 8AZB-1 +<<< Could not download PDB/mmCIF file: 8B2C-1 +<<< Could not download PDB/mmCIF file: 8B5Y-1 +<<< Could not download PDB/mmCIF file: 8B8U-2 +<<< Could not download PDB/mmCIF file: 8BAU-1 +<<< Could not download PDB/mmCIF file: 8BC9-1 +<<< Could not download PDB/mmCIF file: 8BDM-2 +<<< Could not download PDB/mmCIF file: 8BHD-4 +<<< Could not download PDB/mmCIF file: 8BJ4-1 +<<< Could not download PDB/mmCIF file: 8BNS-1 +<<< Could not download PDB/mmCIF file: 8BQR-1 +<<< Could not download PDB/mmCIF file: 8BYK-1 +<<< Could not download PDB/mmCIF file: 8C3E-1 +<<< Could not download PDB/mmCIF file: 8C77-2 +<<< Could not download PDB/mmCIF file: 8CC0-1 +<<< Could not download PDB/mmCIF file: 8CEV-1 +<<< Could not download PDB/mmCIF file: 8CJH-1 +<<< Could not download PDB/mmCIF file: 8CTX-1 +<<< Could not download PDB/mmCIF file: 8D34-1 +<<< Could not download PDB/mmCIF file: 8DBO-1 +<<< Could not download PDB/mmCIF file: 8DF0-1 +<<< Could not download PDB/mmCIF file: 8DGX-2 +<<< Could not download PDB/mmCIF file: 8DJ1-1 +<<< Could not download PDB/mmCIF file: 8DKG-1 +<<< Could not download PDB/mmCIF file: 8DMN-1 +<<< Could not download PDB/mmCIF file: 8DSF-2 +<<< Could not download PDB/mmCIF file: 8DWL-1 +<<< Could not download PDB/mmCIF file: 8E5M-1 +<<< Could not download PDB/mmCIF file: 8E7Y-1 +<<< Could not download PDB/mmCIF file: 8EAA-1 +<<< Could not download PDB/mmCIF file: 8ECW-1 +<<< Could not download PDB/mmCIF file: 8EIN-2 +<<< Could not download PDB/mmCIF file: 8EM1-2 +<<< Could not download PDB/mmCIF file: 8EPJ-2 +<<< Could not download PDB/mmCIF file: 8EUT-1 +<<< Could not download PDB/mmCIF file: 8EZW-4 +<<< Could not download PDB/mmCIF file: 8F2P-1 +<<< Could not download PDB/mmCIF file: 8F8P-1 +<<< Could not download PDB/mmCIF file: 8FBT-1 +<<< Could not download PDB/mmCIF file: 8FF6-2 +<<< Could not download PDB/mmCIF file: 8FIC-1 +<<< Could not download PDB/mmCIF file: 8FM2-4 +<<< Could not download PDB/mmCIF file: 8FO4-2 +<<< Could not download PDB/mmCIF file: 8FTG-1 +<<< Could not download PDB/mmCIF file: 8FX7-2 +<<< Could not download PDB/mmCIF file: 8G1N-2 +<<< Could not download PDB/mmCIF file: 8G62-2 +<<< Could not download PDB/mmCIF file: 8GBZ-1 +<<< Could not download PDB/mmCIF file: 8GHG-1 +<<< Could not download PDB/mmCIF file: 8GMI-4 +<<< Could not download PDB/mmCIF file: 8GQW-1 +<<< Could not download PDB/mmCIF file: 8GSX-1 +<<< Could not download PDB/mmCIF file: 8GVC-1 +<<< Could not download PDB/mmCIF file: 8H0T-1 +<<< Could not download PDB/mmCIF file: 8H9E-1 +<<< Could not download PDB/mmCIF file: 8HE1-1 +<<< Could not download PDB/mmCIF file: 8HJ3-1 +<<< Could not download PDB/mmCIF file: 8HN7-2 +<<< Could not download PDB/mmCIF file: 8HY5-1 +<<< Could not download PDB/mmCIF file: 8I2E-1 +<<< Could not download PDB/mmCIF file: 8I71-1 +<<< Could not download PDB/mmCIF file: 8IIT-1 +<<< Could not download PDB/mmCIF file: 8IUL-1 +<<< Could not download PDB/mmCIF file: 8JCU-1 +<<< Could not download PDB/mmCIF file: 8OG7-1 +<<< Could not download PDB/mmCIF file: 8OQD-1 +<<< Could not download PDB/mmCIF file: 8OWL-1 +<<< Could not download PDB/mmCIF file: 8PA9-1 +<<< Could not download PDB/mmCIF file: 8SBX-1 +<<< Could not download PDB/mmCIF file: 8SKK-1 +<<< Could not download PDB/mmCIF file: 8T1D-1 +<<< Could not download PDB/mmCIF file: 7QCU-1 +<<< Could not download PDB/mmCIF file: 7QVK-1 +<<< Could not download PDB/mmCIF file: 7UED-1 +<<< Could not download PDB/mmCIF file: 7VZT-1 +<<< Could not download PDB/mmCIF file: 7XSW-2 +<<< Could not download PDB/mmCIF file: 7YFH-1 +<<< Could not download PDB/mmCIF file: 8A17-2 +<<< Could not download PDB/mmCIF file: 8CGO-1 +<<< Could not download PDB/mmCIF file: 8EGW-1 +<<< Could not download PDB/mmCIF file: 8FIA-1 +<<< Could not download PDB/mmCIF file: 8G3U-1 +<<< Could not download PDB/mmCIF file: 8IDP-2 +<<< Could not download PDB/mmCIF file: 7E4B-1 +<<< Could not download PDB/mmCIF file: 7FRY-1 +<<< Could not download PDB/mmCIF file: 7FSK-1 +<<< Could not download PDB/mmCIF file: 7FSW-3 +<<< Could not download PDB/mmCIF file: 7FT9-1 +<<< Could not download PDB/mmCIF file: 7FVM-1 +<<< Could not download PDB/mmCIF file: 7FWZ-1 +<<< Could not download PDB/mmCIF file: 7FY8-5 +<<< Could not download PDB/mmCIF file: 7FZE-1 +<<< Could not download PDB/mmCIF file: 7G0A-1 +<<< Could not download PDB/mmCIF file: 7G1M-1 +<<< Could not download PDB/mmCIF file: 7G8X-1 +<<< Could not download PDB/mmCIF file: 7PVP-1 +<<< Could not download PDB/mmCIF file: 7QO2-2 +<<< Could not download PDB/mmCIF file: 7QPK-1 +<<< Could not download PDB/mmCIF file: 7QW4-6 +<<< Could not download PDB/mmCIF file: 7QXF-2 +<<< Could not download PDB/mmCIF file: 7R0F-1 +<<< Could not download PDB/mmCIF file: 7R2Z-1 +<<< Could not download PDB/mmCIF file: 7R4A-1 +<<< Could not download PDB/mmCIF file: 7SVJ-1 +<<< Could not download PDB/mmCIF file: 7T4U-2 +<<< Could not download PDB/mmCIF file: 7T7U-1 +<<< Could not download PDB/mmCIF file: 7T8S-4 +<<< Could not download PDB/mmCIF file: 7TAZ-1 +<<< Could not download PDB/mmCIF file: 7TC7-1 +<<< Could not download PDB/mmCIF file: 7TL6-2 +<<< Could not download PDB/mmCIF file: 7TSW-6 +<<< Could not download PDB/mmCIF file: 7TUO-1 +<<< Could not download PDB/mmCIF file: 7U1R-1 +<<< Could not download PDB/mmCIF file: 7U6H-4 +<<< Could not download PDB/mmCIF file: 7UCW-1 +<<< Could not download PDB/mmCIF file: 7ULQ-5 +<<< Could not download PDB/mmCIF file: 7UR2-7 +<<< Could not download PDB/mmCIF file: 7UXB-1 +<<< Could not download PDB/mmCIF file: 7WNK-1 +<<< Could not download PDB/mmCIF file: 7WW2-1 +<<< Could not download PDB/mmCIF file: 7WY1-1 +<<< Could not download PDB/mmCIF file: 7X4L-1 +<<< Could not download PDB/mmCIF file: 7XBN-2 +<<< Could not download PDB/mmCIF file: 7XDU-1 +<<< Could not download PDB/mmCIF file: 7XGL-1 +<<< Could not download PDB/mmCIF file: 7XHW-3 +<<< Could not download PDB/mmCIF file: 7XJC-1 +<<< Could not download PDB/mmCIF file: 7XP0-1 +<<< Could not download PDB/mmCIF file: 7XUL-1 +<<< Could not download PDB/mmCIF file: 7XXU-1 +<<< Could not download PDB/mmCIF file: 7Y0Y-1 +<<< Could not download PDB/mmCIF file: 7Y3V-2 +<<< Could 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+<<< Could not download PDB/mmCIF file: 8DWL-2 +<<< Could not download PDB/mmCIF file: 8E27-1 +<<< Could not download PDB/mmCIF file: 8E5M-2 +<<< Could not download PDB/mmCIF file: 8E7Z-1 +<<< Could not download PDB/mmCIF file: 8EAB-1 +<<< Could not download PDB/mmCIF file: 8ECW-2 +<<< Could not download PDB/mmCIF file: 8EM2-1 +<<< Could not download PDB/mmCIF file: 8EPO-1 +<<< Could not download PDB/mmCIF file: 8EUT-2 +<<< Could not download PDB/mmCIF file: 8EXM-1 +<<< Could not download PDB/mmCIF file: 8EZW-5 +<<< Could not download PDB/mmCIF file: 8F2Q-1 +<<< Could not download PDB/mmCIF file: 8F8Q-1 +<<< Could not download PDB/mmCIF file: 8FBT-2 +<<< Could not download PDB/mmCIF file: 8FF6-3 +<<< Could not download PDB/mmCIF file: 8FID-1 +<<< Could not download PDB/mmCIF file: 8FM3-1 +<<< Could not download PDB/mmCIF file: 8FO5-1 +<<< Could not download PDB/mmCIF file: 8FTG-2 +<<< Could not download PDB/mmCIF file: 8FX9-1 +<<< Could not download PDB/mmCIF file: 8G1Y-1 +<<< Could 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+<<< Could not download PDB/mmCIF file: 7X25-1 +<<< Could not download PDB/mmCIF file: 7XBO-1 +<<< Could not download PDB/mmCIF file: 7XDV-1 +<<< Could not download PDB/mmCIF file: 7XGM-1 +<<< Could not download PDB/mmCIF file: 7XHW-4 +<<< Could not download PDB/mmCIF file: 7XJD-1 +<<< Could not download PDB/mmCIF file: 7XMP-1 +<<< Could not download PDB/mmCIF file: 7XP1-1 +<<< Could not download PDB/mmCIF file: 7XSY-1 +<<< Could not download PDB/mmCIF file: 7XUN-1 +<<< Could not download PDB/mmCIF file: 7XXW-1 +<<< Could not download PDB/mmCIF file: 7Y0Z-1 +<<< Could not download PDB/mmCIF file: 7Y3V-3 +<<< Could not download PDB/mmCIF file: 7Y5R-1 +<<< Could not download PDB/mmCIF file: 7Y8C-1 +<<< Could not download PDB/mmCIF file: 7YC6-1 +<<< Could not download PDB/mmCIF file: 7YHC-5 +<<< Could not download PDB/mmCIF file: 7YJM-1 +<<< Could not download PDB/mmCIF file: 7YMG-2 +<<< Could not download PDB/mmCIF file: 7YOW-1 +<<< Could not download PDB/mmCIF file: 7YYF-4 +<<< Could 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+<<< Could not download PDB/mmCIF file: 8FF6-4 +<<< Could not download PDB/mmCIF file: 8FIE-1 +<<< Could not download PDB/mmCIF file: 8FM3-2 +<<< Could not download PDB/mmCIF file: 8FO5-2 +<<< Could not download PDB/mmCIF file: 8FTG-3 +<<< Could not download PDB/mmCIF file: 8FXF-1 +<<< Could not download PDB/mmCIF file: 8G1Y-2 +<<< Could not download PDB/mmCIF file: 8G65-1 +<<< Could not download PDB/mmCIF file: 8GC1-1 +<<< Could not download PDB/mmCIF file: 8GHV-1 +<<< Could not download PDB/mmCIF file: 8GMN-1 +<<< Could not download PDB/mmCIF file: 8GSY-2 +<<< Could not download PDB/mmCIF file: 8GVF-1 +<<< Could not download PDB/mmCIF file: 8H56-1 +<<< Could not download PDB/mmCIF file: 8H9I-1 +<<< Could not download PDB/mmCIF file: 8HE3-1 +<<< Could not download PDB/mmCIF file: 8HJ9-1 +<<< Could not download PDB/mmCIF file: 8HNY-1 +<<< Could not download PDB/mmCIF file: 8HYG-1 +<<< Could not download PDB/mmCIF file: 8I2F-1 +<<< Could not download PDB/mmCIF file: 8I8I-1 +<<< Could 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+<<< Could not download PDB/mmCIF file: 7Y3V-4 +<<< Could not download PDB/mmCIF file: 7Y5S-1 +<<< Could not download PDB/mmCIF file: 7Y8C-2 +<<< Could not download PDB/mmCIF file: 7Y9O-1 +<<< Could not download PDB/mmCIF file: 7YC9-1 +<<< Could not download PDB/mmCIF file: 7YHC-6 +<<< Could not download PDB/mmCIF file: 7YJN-1 +<<< Could not download PDB/mmCIF file: 7YMJ-1 +<<< Could not download PDB/mmCIF file: 7YOW-2 +<<< Could not download PDB/mmCIF file: 7YRU-1 +<<< Could not download PDB/mmCIF file: 7YXF-1 +<<< Could not download PDB/mmCIF file: 7YYG-1 +<<< Could not download PDB/mmCIF file: 7YZW-5 +<<< Could not download PDB/mmCIF file: 7Z6P-2 +<<< Could not download PDB/mmCIF file: 7ZAF-1 +<<< Could not download PDB/mmCIF file: 7ZDS-1 +<<< Could not download PDB/mmCIF file: 7ZH5-1 +<<< Could not download PDB/mmCIF file: 7ZOC-1 +<<< Could not download PDB/mmCIF file: 7ZS2-1 +<<< Could not download PDB/mmCIF file: 7ZX6-1 +<<< Could not download PDB/mmCIF file: 7ZYQ-2 +<<< Could 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+<<< Could not download PDB/mmCIF file: 8I8I-2 +<<< Could not download PDB/mmCIF file: 8ID6-1 +<<< Could not download PDB/mmCIF file: 8IK0-1 +<<< Could not download PDB/mmCIF file: 8IVJ-1 +<<< Could not download PDB/mmCIF file: 8JCX-1 +<<< Could not download PDB/mmCIF file: 8OGA-1 +<<< Could not download PDB/mmCIF file: 8OQG-1 +<<< Could not download PDB/mmCIF file: 8OYF-1 +<<< Could not download PDB/mmCIF file: 8SBY-2 +<<< Could not download PDB/mmCIF file: 8SLD-1 +<<< Could not download PDB/mmCIF file: 8T1O-1 +<<< Could not download PDB/mmCIF file: 7UWW-2 +<<< Could not download PDB/mmCIF file: 7WGV-1 +<<< Could not download PDB/mmCIF file: 7X96-1 +<<< Could not download PDB/mmCIF file: 7ZE9-1 +<<< Could not download PDB/mmCIF file: 8A1F-1 +<<< Could not download PDB/mmCIF file: 8CIM-1 +<<< Could not download PDB/mmCIF file: 8D56-1 +<<< Could not download PDB/mmCIF file: 8EM4-1 +<<< Could not download PDB/mmCIF file: 8FJC-2 +<<< Could not download PDB/mmCIF file: 8G3Y-1 +<<< Could not download PDB/mmCIF file: 8IDS-1 +<<< Could not download PDB/mmCIF file: 4E6D-2 +<<< Could not download PDB/mmCIF file: 7FRZ-2 +<<< Could not download PDB/mmCIF file: 7FSK-4 +<<< Could not download PDB/mmCIF file: 7FSX-2 +<<< Could not download PDB/mmCIF file: 7FT9-4 +<<< Could not download PDB/mmCIF file: 7FVP-1 +<<< Could not download PDB/mmCIF file: 7FX2-1 +<<< Could not download PDB/mmCIF file: 7FY8-8 +<<< Could not download PDB/mmCIF file: 7FZH-1 +<<< Could not download PDB/mmCIF file: 7G0E-1 +<<< Could not download PDB/mmCIF file: 7G1P-1 +<<< Could not download PDB/mmCIF file: 7G90-1 +<<< Could not download PDB/mmCIF file: 7QPM-1 +<<< Could not download PDB/mmCIF file: 7QUM-1 +<<< Could not download PDB/mmCIF file: 7QW4-9 +<<< Could not download PDB/mmCIF file: 7R1X-1 +<<< Could not download PDB/mmCIF file: 7R32-1 +<<< Could not download PDB/mmCIF file: 7S0O-1 +<<< Could not download PDB/mmCIF file: 7T4W-1 +<<< Could not download PDB/mmCIF file: 7T6A-1 +<<< Could not download 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+<<< Could not download PDB/mmCIF file: 8AJX-1 +<<< Could not download PDB/mmCIF file: 8ASY-1 +<<< Could not download PDB/mmCIF file: 8AV2-2 +<<< Could not download PDB/mmCIF file: 8AX2-1 +<<< Could not download PDB/mmCIF file: 8AZV-1 +<<< Could not download PDB/mmCIF file: 8B65-1 +<<< Could not download PDB/mmCIF file: 8BCD-1 +<<< Could not download PDB/mmCIF file: 8BDN-2 +<<< Could not download PDB/mmCIF file: 8BJ9-1 +<<< Could not download PDB/mmCIF file: 8BNW-1 +<<< Could not download PDB/mmCIF file: 8BRA-1 +<<< Could not download PDB/mmCIF file: 8BTS-1 +<<< Could not download PDB/mmCIF file: 8BYU-1 +<<< Could not download PDB/mmCIF file: 8C3H-3 +<<< Could not download PDB/mmCIF file: 8C79-1 +<<< Could not download PDB/mmCIF file: 8CCC-1 +<<< Could not download PDB/mmCIF file: 8CF7-2 +<<< Could not download PDB/mmCIF file: 8CK5-1 +<<< Could not download PDB/mmCIF file: 8CZG-2 +<<< Could not download PDB/mmCIF file: 8D39-1 +<<< Could not download PDB/mmCIF file: 8DAI-1 +<<< Could not download PDB/mmCIF file: 8DC1-1 +<<< Could not download PDB/mmCIF file: 8DFD-1 +<<< Could not download PDB/mmCIF file: 8DJB-1 +<<< Could not download PDB/mmCIF file: 8DKK-1 +<<< Could not download PDB/mmCIF file: 8DMP-4 +<<< Could not download PDB/mmCIF file: 8DOE-1 +<<< Could not download PDB/mmCIF file: 8DRP-1 +<<< Could not download PDB/mmCIF file: 8DSG-2 +<<< Could not download PDB/mmCIF file: 8DX0-1 +<<< Could not download PDB/mmCIF file: 8E0W-2 +<<< Could not download PDB/mmCIF file: 8E2F-1 +<<< Could not download PDB/mmCIF file: 8E5S-1 +<<< Could not download PDB/mmCIF file: 8E81-1 +<<< Could not download PDB/mmCIF file: 8ED4-2 +<<< Could not download PDB/mmCIF file: 8EG6-1 +<<< Could not download PDB/mmCIF file: 8EPR-2 +<<< Could not download PDB/mmCIF file: 8F00-1 +<<< Could not download PDB/mmCIF file: 8F3B-1 +<<< Could not download PDB/mmCIF file: 8F5T-1 +<<< Could not download PDB/mmCIF file: 8F8T-1 +<<< Could not download PDB/mmCIF file: 8FBY-1 +<<< Could not download 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file: 8IVJ-2 +<<< Could not download PDB/mmCIF file: 8JCY-1 +<<< Could not download PDB/mmCIF file: 8OGB-1 +<<< Could not download PDB/mmCIF file: 8OR0-1 +<<< Could not download PDB/mmCIF file: 8OYG-1 +<<< Could not download PDB/mmCIF file: 8PDG-1 +<<< Could not download PDB/mmCIF file: 8SBZ-1 +<<< Could not download PDB/mmCIF file: 8SLF-1 +<<< Could not download PDB/mmCIF file: 8T55-1 +<<< Could not download PDB/mmCIF file: 7WGX-1 +<<< Could not download PDB/mmCIF file: 7YL6-1 +<<< Could not download PDB/mmCIF file: 7ZE9-2 +<<< Could not download PDB/mmCIF file: 8AXI-1 +<<< Could not download PDB/mmCIF file: 8CQF-1 +<<< Could not download PDB/mmCIF file: 8D5A-1 +<<< Could not download PDB/mmCIF file: 8EM7-1 +<<< Could not download PDB/mmCIF file: 8FJP-1 +<<< Could not download PDB/mmCIF file: 8G40-1 +<<< Could not download PDB/mmCIF file: 8IF2-1 +<<< Could not download PDB/mmCIF file: 7FS0-1 +<<< Could not download PDB/mmCIF file: 7FSL-1 +<<< Could not download PDB/mmCIF file: 7FSX-3 +<<< Could not download PDB/mmCIF file: 7FTA-1 +<<< Could not download PDB/mmCIF file: 7FVQ-1 +<<< Could not download PDB/mmCIF file: 7FX3-1 +<<< Could not download PDB/mmCIF file: 7FY9-1 +<<< Could not download PDB/mmCIF file: 7FZI-1 +<<< Could not download PDB/mmCIF file: 7G0F-1 +<<< Could not download PDB/mmCIF file: 7G1Q-1 +<<< Could not download PDB/mmCIF file: 7G91-1 +<<< Could not download PDB/mmCIF file: 7QOB-1 +<<< Could not download PDB/mmCIF file: 7QPM-2 +<<< Could not download PDB/mmCIF file: 7QW8-1 +<<< Could not download PDB/mmCIF file: 7QZ1-1 +<<< Could not download PDB/mmCIF file: 7RYT-1 +<<< Could not download PDB/mmCIF file: 7SS6-1 +<<< Could not download PDB/mmCIF file: 7T4W-2 +<<< Could not download PDB/mmCIF file: 7T6A-2 +<<< Could not download PDB/mmCIF file: 7T8X-1 +<<< Could not download PDB/mmCIF file: 7TNU-1 +<<< Could not download PDB/mmCIF file: 7U01-3 +<<< Could not download PDB/mmCIF file: 7U6J-2 +<<< Could not download PDB/mmCIF file: 7U9B-1 +<<< Could not download PDB/mmCIF file: 7UD6-1 +<<< Could not download PDB/mmCIF file: 7UEH-1 +<<< Could not download PDB/mmCIF file: 7UFW-1 +<<< Could not download PDB/mmCIF file: 7UKY-1 +<<< Could not download PDB/mmCIF file: 7ULQ-9 +<<< Could not download PDB/mmCIF file: 7UPB-1 +<<< Could not download PDB/mmCIF file: 7UR8-1 +<<< Could not download PDB/mmCIF file: 7UVH-2 +<<< Could not download PDB/mmCIF file: 7WFS-1 +<<< Could not download PDB/mmCIF file: 7WM2-1 +<<< Could not download PDB/mmCIF file: 7WY3-1 +<<< Could not download PDB/mmCIF file: 7X4P-1 +<<< Could not download PDB/mmCIF file: 7X6F-1 +<<< Could not download PDB/mmCIF file: 7X8F-1 +<<< Could not download PDB/mmCIF file: 7X9Z-1 +<<< Could not download PDB/mmCIF file: 7XDW-2 +<<< Could not download PDB/mmCIF file: 7XHX-3 +<<< Could not download PDB/mmCIF file: 7XJJ-1 +<<< Could not download PDB/mmCIF file: 7XR7-1 +<<< Could not download PDB/mmCIF file: 7XUT-1 +<<< Could not download PDB/mmCIF file: 7XY0-1 +<<< Could not download 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file: 8AB1-1 +<<< Could not download PDB/mmCIF file: 8AD9-2 +<<< Could not download PDB/mmCIF file: 8AI9-1 +<<< Could not download PDB/mmCIF file: 8AV9-1 +<<< Could not download PDB/mmCIF file: 8AX4-1 +<<< Could not download PDB/mmCIF file: 8AZX-1 +<<< Could not download PDB/mmCIF file: 8B2K-1 +<<< Could not download PDB/mmCIF file: 8B6A-1 +<<< Could not download PDB/mmCIF file: 8BCE-1 +<<< Could not download PDB/mmCIF file: 8BDN-3 +<<< Could not download PDB/mmCIF file: 8BI0-1 +<<< Could not download PDB/mmCIF file: 8BJA-1 +<<< Could not download PDB/mmCIF file: 8BNX-1 +<<< Could not download PDB/mmCIF file: 8BRA-2 +<<< Could not download PDB/mmCIF file: 8BTS-2 +<<< Could not download PDB/mmCIF file: 8BYW-1 +<<< Could not download PDB/mmCIF file: 8C3L-1 +<<< Could not download PDB/mmCIF file: 8C7E-1 +<<< Could not download PDB/mmCIF file: 8CCD-1 +<<< Could not download PDB/mmCIF file: 8CFF-1 +<<< Could not download PDB/mmCIF file: 8CKC-1 +<<< Could not download PDB/mmCIF file: 8CZG-3 +<<< Could not download PDB/mmCIF file: 8DAJ-1 +<<< Could not download PDB/mmCIF file: 8DHE-1 +<<< Could not download PDB/mmCIF file: 8DJC-1 +<<< Could not download PDB/mmCIF file: 8DKL-1 +<<< Could not download PDB/mmCIF file: 8DMP-5 +<<< Could not download PDB/mmCIF file: 8DSG-3 +<<< Could not download PDB/mmCIF file: 8DX0-2 +<<< Could not download PDB/mmCIF file: 8E2G-1 +<<< Could not download PDB/mmCIF file: 8E5U-1 +<<< Could not download PDB/mmCIF file: 8EG6-2 +<<< Could not download PDB/mmCIF file: 8EIR-1 +<<< Could not download PDB/mmCIF file: 8F01-1 +<<< Could not download PDB/mmCIF file: 8F5T-2 +<<< Could not download PDB/mmCIF file: 8FBY-2 +<<< Could not download PDB/mmCIF file: 8FF7-1 +<<< Could not download PDB/mmCIF file: 8FIU-2 +<<< Could not download PDB/mmCIF file: 8FM4-1 +<<< Could not download PDB/mmCIF file: 8FOB-1 +<<< Could not download PDB/mmCIF file: 8FU7-1 +<<< Could not download PDB/mmCIF file: 8FXQ-1 +<<< Could not download PDB/mmCIF file: 8G25-2 +<<< Could not download PDB/mmCIF file: 8G67-2 +<<< Could not download PDB/mmCIF file: 8GI5-1 +<<< Could not download PDB/mmCIF file: 8GMN-4 +<<< Could not download PDB/mmCIF file: 8GR1-2 +<<< Could not download PDB/mmCIF file: 8GT3-1 +<<< Could not download PDB/mmCIF file: 8HEF-1 +<<< Could not download PDB/mmCIF file: 8HJE-1 +<<< Could not download PDB/mmCIF file: 8HO1-1 +<<< Could not download PDB/mmCIF file: 8HZ1-1 +<<< Could not download PDB/mmCIF file: 8I2L-1 +<<< Could not download PDB/mmCIF file: 8I8J-2 +<<< Could not download PDB/mmCIF file: 8ID9-1 +<<< Could not download PDB/mmCIF file: 8IK1-2 +<<< Could not download PDB/mmCIF file: 8IVK-1 +<<< Could not download PDB/mmCIF file: 8JCZ-1 +<<< Could not download PDB/mmCIF file: 8OGC-1 +<<< Could not download PDB/mmCIF file: 8OR2-1 +<<< Could not download PDB/mmCIF file: 8OZA-1 +<<< Could not download PDB/mmCIF file: 8PDH-1 +<<< Could not download PDB/mmCIF file: 8SBZ-2 +<<< Could not download PDB/mmCIF file: 8SLG-1 +<<< Could not download 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file: 7G92-1 +<<< Could not download PDB/mmCIF file: 7Q58-1 +<<< Could not download PDB/mmCIF file: 7QEM-1 +<<< Could not download PDB/mmCIF file: 7QOB-2 +<<< Could not download PDB/mmCIF file: 7QTD-1 +<<< Could not download PDB/mmCIF file: 7QW8-2 +<<< Could not download PDB/mmCIF file: 7QZ1-2 +<<< Could not download PDB/mmCIF file: 7RYT-2 +<<< Could not download PDB/mmCIF file: 7SS7-1 +<<< Could not download PDB/mmCIF file: 7T82-1 +<<< Could not download PDB/mmCIF file: 7TNV-1 +<<< Could not download PDB/mmCIF file: 7TX2-1 +<<< Could not download PDB/mmCIF file: 7TYJ-1 +<<< Could not download PDB/mmCIF file: 7U01-4 +<<< Could not download PDB/mmCIF file: 7U6J-3 +<<< Could not download PDB/mmCIF file: 7UEH-2 +<<< Could not download PDB/mmCIF file: 7UFW-2 +<<< Could not download PDB/mmCIF file: 7ULR-1 +<<< Could not download PDB/mmCIF file: 7UPD-1 +<<< Could not download PDB/mmCIF file: 7UVI-1 +<<< Could not download PDB/mmCIF file: 7WI1-1 +<<< Could not download PDB/mmCIF file: 7WK1-1 +<<< Could not download PDB/mmCIF file: 7WPY-1 +<<< Could not download PDB/mmCIF file: 7WY3-2 +<<< Could not download PDB/mmCIF file: 7X4Q-1 +<<< Could not download PDB/mmCIF file: 7X6F-2 +<<< Could not download PDB/mmCIF file: 7X8F-2 +<<< Could not download PDB/mmCIF file: 7XA0-1 +<<< Could not download PDB/mmCIF file: 7XBR-1 +<<< Could not download PDB/mmCIF file: 7XDX-1 +<<< Could not download PDB/mmCIF file: 7XHX-4 +<<< Could not download PDB/mmCIF file: 7XP7-1 +<<< Could not download PDB/mmCIF file: 7XR8-1 +<<< Could not download PDB/mmCIF file: 7XUV-1 +<<< Could not download PDB/mmCIF file: 7XY1-1 +<<< Could not download PDB/mmCIF file: 7Y11-2 +<<< Could not download PDB/mmCIF file: 7Y64-1 +<<< Could not download PDB/mmCIF file: 7Y8G-1 +<<< Could not download PDB/mmCIF file: 7YEO-1 +<<< Could not download PDB/mmCIF file: 7YHD-1 +<<< Could not download PDB/mmCIF file: 7YJP-2 +<<< Could not download PDB/mmCIF file: 7YSI-1 +<<< Could not download PDB/mmCIF file: 7Z6U-1 +<<< Could not download PDB/mmCIF file: 7Z8T-1 +<<< Could not download PDB/mmCIF file: 7ZBR-1 +<<< Could not download PDB/mmCIF file: 7ZDV-1 +<<< Could not download PDB/mmCIF file: 7ZIU-1 +<<< Could not download PDB/mmCIF file: 7ZQ1-1 +<<< Could not download PDB/mmCIF file: 7ZTW-1 +<<< Could not download PDB/mmCIF file: 7ZXA-2 +<<< Could not download PDB/mmCIF file: 7ZYT-1 +<<< Could not download PDB/mmCIF file: 8A14-2 +<<< Could not download PDB/mmCIF file: 8A2F-1 +<<< Could not download PDB/mmCIF file: 8A7B-1 +<<< Could not download PDB/mmCIF file: 8A97-1 +<<< Could not download PDB/mmCIF file: 8ADA-1 +<<< Could not download PDB/mmCIF file: 8AIB-1 +<<< Could not download PDB/mmCIF file: 8ATD-1 +<<< Could not download PDB/mmCIF file: 8AVA-1 +<<< Could not download PDB/mmCIF file: 8AZY-1 +<<< Could not download PDB/mmCIF file: 8B6A-2 +<<< Could not download PDB/mmCIF file: 8BCF-1 +<<< Could not download PDB/mmCIF file: 8BDN-4 +<<< Could not download PDB/mmCIF file: 8BFF-1 +<<< Could not download PDB/mmCIF file: 8BI2-1 +<<< Could not download PDB/mmCIF file: 8BJG-1 +<<< Could not download PDB/mmCIF file: 8BNX-2 +<<< Could not download PDB/mmCIF file: 8BRB-1 +<<< Could not download PDB/mmCIF file: 8BTU-1 +<<< Could not download PDB/mmCIF file: 8BYW-2 +<<< Could not download PDB/mmCIF file: 8C3L-2 +<<< Could not download PDB/mmCIF file: 8C7E-2 +<<< Could not download PDB/mmCIF file: 8CCE-1 +<<< Could not download PDB/mmCIF file: 8CFF-2 +<<< Could not download PDB/mmCIF file: 8CKS-1 +<<< Could not download PDB/mmCIF file: 8CZG-4 +<<< Could not download PDB/mmCIF file: 8D8A-1 +<<< Could not download PDB/mmCIF file: 8DJC-2 +<<< Could not download PDB/mmCIF file: 8DMP-6 +<<< Could not download PDB/mmCIF file: 8DSG-4 +<<< Could not download PDB/mmCIF file: 8DX2-1 +<<< Could not download PDB/mmCIF file: 8E2H-1 +<<< Could not download PDB/mmCIF file: 8E5U-2 +<<< Could not download PDB/mmCIF file: 8EAZ-1 +<<< Could not download PDB/mmCIF file: 8EGD-1 +<<< Could not download PDB/mmCIF file: 8EIS-1 +<<< Could not download PDB/mmCIF file: 8F03-1 +<<< Could not download PDB/mmCIF file: 8F3F-1 +<<< Could not download PDB/mmCIF file: 8F5U-1 +<<< Could not download PDB/mmCIF file: 8F8V-1 +<<< Could not download PDB/mmCIF file: 8FC0-1 +<<< Could not download PDB/mmCIF file: 8FF7-2 +<<< Could not download PDB/mmCIF file: 8FJ0-1 +<<< Could not download PDB/mmCIF file: 8FM4-2 +<<< Could not download PDB/mmCIF file: 8FOL-1 +<<< Could not download PDB/mmCIF file: 8FU8-1 +<<< Could not download PDB/mmCIF file: 8FXQ-2 +<<< Could not download PDB/mmCIF file: 8G25-3 +<<< Could not download PDB/mmCIF file: 8G68-1 +<<< Could not download PDB/mmCIF file: 8GCI-1 +<<< Could not download PDB/mmCIF file: 8GI7-1 +<<< Could not download PDB/mmCIF file: 8GR1-3 +<<< Could not download PDB/mmCIF file: 8GT4-1 +<<< Could not download PDB/mmCIF file: 8H17-1 +<<< Could not download PDB/mmCIF file: 8HJX-1 +<<< Could not download PDB/mmCIF file: 8HOW-1 +<<< Could not download PDB/mmCIF file: 8HZ2-1 +<<< Could not download PDB/mmCIF file: 8I2M-1 +<<< Could not download PDB/mmCIF file: 8I8J-3 +<<< Could not download PDB/mmCIF file: 8IE5-1 +<<< Could not download PDB/mmCIF file: 8IK3-1 +<<< Could not download PDB/mmCIF file: 8IVR-1 +<<< Could not download PDB/mmCIF file: 8JD0-1 +<<< Could not download PDB/mmCIF file: 8OGH-1 +<<< Could not download PDB/mmCIF file: 8OR3-1 +<<< Could not download PDB/mmCIF file: 8P04-1 +<<< Could not download PDB/mmCIF file: 8PDJ-1 +<<< Could not download PDB/mmCIF file: 8SC0-1 +<<< Could not download PDB/mmCIF file: 8SLH-1 +<<< Could not download PDB/mmCIF file: 8T55-3 +<<< Could not download PDB/mmCIF file: 7UYI-2 +<<< Could not download PDB/mmCIF file: 7WH6-2 +<<< Could not download PDB/mmCIF file: 7WT7-1 +<<< Could not download PDB/mmCIF file: 7YQG-1 +<<< Could not download PDB/mmCIF file: 8B0F-1 +<<< Could not download PDB/mmCIF file: 8D7E-1 +<<< Could not download PDB/mmCIF file: 8ENT-1 +<<< Could not download PDB/mmCIF file: 8FK4-2 +<<< Could not download PDB/mmCIF file: 8GB5-2 +<<< Could not download PDB/mmCIF file: 8IF4-1 +<<< Could not download PDB/mmCIF file: 5SBG-1 +<<< Could not download PDB/mmCIF file: 7FCT-1 +<<< Could not download PDB/mmCIF file: 7FS1-1 +<<< Could not download PDB/mmCIF file: 7FSL-3 +<<< Could not download PDB/mmCIF file: 7FSY-1 +<<< Could not download PDB/mmCIF file: 7FTA-3 +<<< Could not download PDB/mmCIF file: 7FVU-1 +<<< Could not download PDB/mmCIF file: 7FX5-1 +<<< Could not download PDB/mmCIF file: 7FYA-2 +<<< Could not download PDB/mmCIF file: 7FZK-1 +<<< Could not download PDB/mmCIF file: 7G0H-1 +<<< Could not download PDB/mmCIF file: 7G1S-1 +<<< Could not download PDB/mmCIF file: 7G93-1 +<<< Could not download PDB/mmCIF file: 7QEM-2 +<<< Could not download PDB/mmCIF file: 7QR9-1 +<<< Could not download PDB/mmCIF file: 7QTE-1 +<<< Could not download PDB/mmCIF file: 7QWA-1 +<<< Could not download PDB/mmCIF file: 7RYT-3 +<<< Could not download PDB/mmCIF file: 7ST5-1 +<<< Could not download PDB/mmCIF file: 7T82-2 +<<< Could not download PDB/mmCIF file: 7TCD-1 +<<< Could not download PDB/mmCIF file: 7TO3-1 +<<< Could not download PDB/mmCIF file: 7TTD-1 +<<< Could not download PDB/mmCIF file: 7TYK-1 +<<< Could not download PDB/mmCIF file: 7U6J-4 +<<< Could not download PDB/mmCIF file: 7U9D-1 +<<< Could not download PDB/mmCIF file: 7UEH-3 +<<< Could not download PDB/mmCIF file: 7UFY-1 +<<< Could not download PDB/mmCIF file: 7ULS-1 +<<< Could not download PDB/mmCIF file: 7UNH-1 +<<< Could not download PDB/mmCIF file: 7UVI-2 +<<< Could not download PDB/mmCIF file: 7V2T-1 +<<< Could not download PDB/mmCIF file: 7WI1-2 +<<< Could not download PDB/mmCIF file: 7WPY-2 +<<< Could not download PDB/mmCIF file: 7WY4-1 +<<< Could not download PDB/mmCIF file: 7X2B-1 +<<< Could not download PDB/mmCIF file: 7X4Q-2 +<<< Could not download PDB/mmCIF file: 7X6F-3 +<<< Could not download PDB/mmCIF file: 7X8G-1 +<<< Could not download PDB/mmCIF file: 7XA1-1 +<<< Could not download PDB/mmCIF file: 7XBR-2 +<<< Could not download PDB/mmCIF file: 7XDX-2 +<<< Could not download PDB/mmCIF file: 7XFK-1 +<<< Could not download PDB/mmCIF file: 7XKS-1 +<<< Could not download PDB/mmCIF file: 7XP7-2 +<<< Could not download PDB/mmCIF file: 7XR8-2 +<<< Could not download PDB/mmCIF file: 7XUW-1 +<<< Could not download PDB/mmCIF file: 7XY5-1 +<<< Could not download PDB/mmCIF file: 7Y65-1 +<<< Could not download PDB/mmCIF file: 7Y8G-2 +<<< Could not download PDB/mmCIF file: 7YJQ-1 +<<< Could not download PDB/mmCIF file: 7Z3P-1 +<<< Could not download PDB/mmCIF file: 7ZDW-1 +<<< Could not download PDB/mmCIF file: 7ZIU-2 +<<< Could not download PDB/mmCIF file: 7ZQ2-1 +<<< Could not download PDB/mmCIF file: 7ZS7-1 +<<< Could not download PDB/mmCIF file: 7ZTW-2 +<<< Could not download PDB/mmCIF file: 7ZXA-3 +<<< Could not download PDB/mmCIF file: 7ZZX-1 +<<< Could not download PDB/mmCIF file: 8A14-3 +<<< Could not download PDB/mmCIF file: 8A2G-1 +<<< Could not download PDB/mmCIF file: 8A5E-1 +<<< Could not download PDB/mmCIF file: 8A7C-1 +<<< Could not download PDB/mmCIF file: 8A97-2 +<<< Could not download PDB/mmCIF file: 8ADB-1 +<<< Could not download PDB/mmCIF file: 8AG8-1 +<<< Could not download PDB/mmCIF file: 8AK1-1 +<<< Could not download PDB/mmCIF file: 8ATH-1 +<<< Could not download PDB/mmCIF file: 8AVH-1 +<<< Could not download PDB/mmCIF file: 8AZZ-1 +<<< Could not download PDB/mmCIF file: 8B6E-1 +<<< Could not download PDB/mmCIF file: 8BCG-1 +<<< Could not download PDB/mmCIF file: 8BDO-1 +<<< Could not download PDB/mmCIF file: 8BFF-2 +<<< Could not download PDB/mmCIF file: 8BI3-1 +<<< Could not download PDB/mmCIF file: 8BJN-1 +<<< Could not download PDB/mmCIF file: 8BNY-1 +<<< Could not download PDB/mmCIF file: 8BRB-2 +<<< Could not download PDB/mmCIF file: 8BTV-1 +<<< Could not download PDB/mmCIF file: 8BYW-3 +<<< Could not download PDB/mmCIF file: 8C3M-1 +<<< Could not download PDB/mmCIF file: 8C7G-1 +<<< Could not download PDB/mmCIF file: 8CCF-1 +<<< Could not download PDB/mmCIF file: 8CFF-3 +<<< Could not download PDB/mmCIF file: 8CKV-1 +<<< Could not download PDB/mmCIF file: 8CZH-1 +<<< Could not download PDB/mmCIF file: 8D19-1 +<<< Could not download PDB/mmCIF file: 8D3S-1 +<<< Could not download PDB/mmCIF file: 8D8B-1 +<<< Could not download PDB/mmCIF file: 8DJD-1 +<<< Could not download PDB/mmCIF file: 8DMP-7 +<<< Could not download PDB/mmCIF file: 8DPK-1 +<<< Could not download PDB/mmCIF file: 8DSH-1 +<<< Could not download PDB/mmCIF file: 8DX3-1 +<<< Could not download PDB/mmCIF file: 8DZ8-1 +<<< Could not download PDB/mmCIF file: 8E2I-1 +<<< Could not download PDB/mmCIF file: 8E5V-1 +<<< Could not download PDB/mmCIF file: 8E84-1 +<<< Could not download PDB/mmCIF file: 8EAZ-2 +<<< Could not download PDB/mmCIF file: 8EDH-1 +<<< Could not download PDB/mmCIF file: 8EGF-1 +<<< Could not download PDB/mmCIF file: 8EIT-1 +<<< Could not download PDB/mmCIF file: 8ERM-1 +<<< Could not download PDB/mmCIF file: 8F05-1 +<<< Could not download PDB/mmCIF file: 8F3H-1 +<<< Could not download PDB/mmCIF file: 8F5V-1 +<<< Could not download PDB/mmCIF file: 8F8V-2 +<<< Could not download PDB/mmCIF file: 8FC0-2 +<<< Could not download PDB/mmCIF file: 8FF7-3 +<<< Could not download PDB/mmCIF file: 8FJ2-1 +<<< Could not download PDB/mmCIF file: 8FM4-3 +<<< Could not download PDB/mmCIF file: 8FOW-1 +<<< Could not download PDB/mmCIF file: 8FUA-1 +<<< Could not download PDB/mmCIF file: 8FXS-1 +<<< Could not download PDB/mmCIF file: 8G28-1 +<<< Could not download PDB/mmCIF file: 8G68-2 +<<< Could not download PDB/mmCIF file: 8GCL-1 +<<< Could not download PDB/mmCIF file: 8GI7-2 +<<< Could not download PDB/mmCIF file: 8GR1-4 +<<< Could not download PDB/mmCIF file: 8GT5-1 +<<< Could not download PDB/mmCIF file: 8H1A-1 +<<< Could not download PDB/mmCIF file: 8HAP-1 +<<< Could not download PDB/mmCIF file: 8HF9-1 +<<< Could not download PDB/mmCIF file: 8HJY-1 +<<< Could not download PDB/mmCIF file: 8HP5-1 +<<< Could not download PDB/mmCIF file: 8I02-1 +<<< Could not download PDB/mmCIF file: 8I2Q-1 +<<< Could not download PDB/mmCIF file: 8I8K-1 +<<< Could not download PDB/mmCIF file: 8IE6-1 +<<< Could not download PDB/mmCIF file: 8ILC-1 +<<< Could not download PDB/mmCIF file: 8IVW-1 +<<< Could not download PDB/mmCIF file: 8JD2-1 +<<< Could not download PDB/mmCIF file: 8ORE-1 +<<< Could not download PDB/mmCIF file: 8P05-1 +<<< Could not download PDB/mmCIF file: 8PFC-1 +<<< Could not download PDB/mmCIF file: 8SC0-2 +<<< Could not download PDB/mmCIF file: 8SLS-1 +<<< Could not download PDB/mmCIF file: 8T5J-1 +<<< Could not download PDB/mmCIF file: 7WH7-1 +<<< Could not download PDB/mmCIF file: 7ZFR-1 +<<< Could not download PDB/mmCIF file: 8A6C-1 +<<< Could not download PDB/mmCIF file: 8B0G-1 +<<< Could not download PDB/mmCIF file: 8D7H-1 +<<< Could not download PDB/mmCIF file: 8ENT-2 +<<< Could not download PDB/mmCIF file: 8FK4-3 +<<< Could not download PDB/mmCIF file: 8GB5-3 +<<< Could not download PDB/mmCIF file: 8ING-1 +<<< Could not download PDB/mmCIF file: 5SBI-1 +<<< Could not download PDB/mmCIF file: 7FS1-2 +<<< Could not download PDB/mmCIF file: 7FSL-4 +<<< Could not download PDB/mmCIF file: 7FSY-2 +<<< Could not download PDB/mmCIF file: 7FTA-4 +<<< Could not download PDB/mmCIF file: 7FVV-1 +<<< Could not download PDB/mmCIF file: 7FX6-1 +<<< Could not download PDB/mmCIF file: 7FYB-1 +<<< Could not download PDB/mmCIF file: 7FZL-1 +<<< Could not download PDB/mmCIF file: 7G0I-1 +<<< Could not download PDB/mmCIF file: 7G1T-1 +<<< Could not download PDB/mmCIF file: 7G94-1 +<<< Could not download PDB/mmCIF file: 7QR9-2 +<<< Could not download PDB/mmCIF file: 7QTF-1 +<<< Could not download PDB/mmCIF file: 7QUV-1 +<<< Could not download PDB/mmCIF file: 7QWB-1 +<<< Could not download PDB/mmCIF file: 7ST5-2 +<<< Could not download PDB/mmCIF file: 7T90-1 +<<< Could not download PDB/mmCIF file: 7TTE-1 +<<< Could not download PDB/mmCIF file: 7U6J-5 +<<< Could not download PDB/mmCIF file: 7U9E-1 +<<< Could not download PDB/mmCIF file: 7UDA-1 +<<< Could not download PDB/mmCIF file: 7UEH-4 +<<< Could not download PDB/mmCIF file: 7UFY-2 +<<< Could not download PDB/mmCIF file: 7UJH-1 +<<< Could not download PDB/mmCIF file: 7UNI-1 +<<< Could not download PDB/mmCIF file: 7V2U-1 +<<< Could not download PDB/mmCIF file: 7VF6-1 +<<< Could not download PDB/mmCIF file: 7WY4-2 +<<< Could not download PDB/mmCIF file: 7X4S-1 +<<< Could not download PDB/mmCIF file: 7X6G-1 +<<< Could not download PDB/mmCIF file: 7X8G-2 +<<< Could not download PDB/mmCIF file: 7XA2-1 +<<< Could not download PDB/mmCIF file: 7XBS-1 +<<< Could not download PDB/mmCIF file: 7XDY-1 +<<< Could not download PDB/mmCIF file: 7XFK-2 +<<< Could not download PDB/mmCIF file: 7XHZ-1 +<<< Could not download PDB/mmCIF file: 7XJM-1 +<<< Could not download PDB/mmCIF file: 7XKX-1 +<<< Could not download PDB/mmCIF file: 7XMW-1 +<<< Could not download PDB/mmCIF file: 7XP9-1 +<<< Could not download PDB/mmCIF file: 7XR9-1 +<<< Could not download 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file: 8ADC-1 +<<< Could not download PDB/mmCIF file: 8AK2-1 +<<< Could not download PDB/mmCIF file: 8ATH-2 +<<< Could not download PDB/mmCIF file: 8AVI-1 +<<< Could not download PDB/mmCIF file: 8B00-1 +<<< Could not download PDB/mmCIF file: 8B6E-2 +<<< Could not download PDB/mmCIF file: 8BCH-1 +<<< Could not download PDB/mmCIF file: 8BDO-2 +<<< Could not download PDB/mmCIF file: 8BFF-3 +<<< Could not download PDB/mmCIF file: 8BI7-1 +<<< Could not download PDB/mmCIF file: 8BJT-1 +<<< Could not download PDB/mmCIF file: 8BNZ-1 +<<< Could not download PDB/mmCIF file: 8BRC-1 +<<< Could not download PDB/mmCIF file: 8BTW-1 +<<< Could not download PDB/mmCIF file: 8BYW-4 +<<< Could not download PDB/mmCIF file: 8C3N-1 +<<< Could not download PDB/mmCIF file: 8C7J-1 +<<< Could not download PDB/mmCIF file: 8CCG-1 +<<< Could not download PDB/mmCIF file: 8CFF-4 +<<< Could not download PDB/mmCIF file: 8CKX-1 +<<< Could not download PDB/mmCIF file: 8CUA-1 +<<< Could not download PDB/mmCIF file: 8CWK-1 +<<< Could not download PDB/mmCIF file: 8D19-2 +<<< Could not download PDB/mmCIF file: 8D8C-1 +<<< Could not download PDB/mmCIF file: 8DDY-1 +<<< Could not download PDB/mmCIF file: 8DJD-2 +<<< Could not download PDB/mmCIF file: 8DMP-8 +<<< Could not download PDB/mmCIF file: 8DPK-2 +<<< Could not download PDB/mmCIF file: 8DSI-1 +<<< Could not download PDB/mmCIF file: 8DZ8-2 +<<< Could not download PDB/mmCIF file: 8E10-1 +<<< Could not download PDB/mmCIF file: 8E2J-1 +<<< Could not download PDB/mmCIF file: 8E84-2 +<<< Could not download PDB/mmCIF file: 8EB0-1 +<<< Could not download PDB/mmCIF file: 8EDH-2 +<<< Could not download PDB/mmCIF file: 8EIW-1 +<<< Could not download PDB/mmCIF file: 8EPU-1 +<<< Could not download PDB/mmCIF file: 8ERM-2 +<<< Could not download PDB/mmCIF file: 8EVK-1 +<<< Could not download PDB/mmCIF file: 8EYA-1 +<<< Could not download PDB/mmCIF file: 8F06-1 +<<< Could not download PDB/mmCIF file: 8F3I-1 +<<< Could not download PDB/mmCIF file: 8F5W-1 +<<< Could not download PDB/mmCIF file: 8F8Y-1 +<<< Could not download PDB/mmCIF file: 8FC0-3 +<<< Could not download PDB/mmCIF file: 8FF7-4 +<<< Could not download PDB/mmCIF file: 8FJ2-2 +<<< Could not download PDB/mmCIF file: 8FM4-4 +<<< Could not download PDB/mmCIF file: 8FOZ-1 +<<< Could not download PDB/mmCIF file: 8FUB-1 +<<< Could not download PDB/mmCIF file: 8FXV-1 +<<< Could not download PDB/mmCIF file: 8G2E-1 +<<< Could not download PDB/mmCIF file: 8G69-1 +<<< Could not download PDB/mmCIF file: 8GCY-1 +<<< Could not download PDB/mmCIF file: 8GIA-1 +<<< Could not download PDB/mmCIF file: 8GN6-1 +<<< Could not download PDB/mmCIF file: 8GW8-1 +<<< Could not download PDB/mmCIF file: 8H1K-1 +<<< Could not download PDB/mmCIF file: 8HAV-1 +<<< Could not download PDB/mmCIF file: 8HFA-1 +<<< Could not download PDB/mmCIF file: 8HJZ-1 +<<< Could not download PDB/mmCIF file: 8HP5-2 +<<< Could not download PDB/mmCIF file: 8I0N-1 +<<< Could not download PDB/mmCIF file: 8I2R-1 +<<< Could not download 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file: 5SBJ-1 +<<< Could not download PDB/mmCIF file: 7FS2-1 +<<< Could not download PDB/mmCIF file: 7FSM-1 +<<< Could not download PDB/mmCIF file: 7FSY-3 +<<< Could not download PDB/mmCIF file: 7FTB-1 +<<< Could not download PDB/mmCIF file: 7FVW-1 +<<< Could not download PDB/mmCIF file: 7FX7-1 +<<< Could not download PDB/mmCIF file: 7FYC-1 +<<< Could not download PDB/mmCIF file: 7FZM-1 +<<< Could not download PDB/mmCIF file: 7G0J-1 +<<< Could not download PDB/mmCIF file: 7G1U-1 +<<< Could not download PDB/mmCIF file: 7G95-1 +<<< Could not download PDB/mmCIF file: 7PVU-1 +<<< Could not download PDB/mmCIF file: 7QR9-3 +<<< Could not download PDB/mmCIF file: 7QTG-1 +<<< Could not download PDB/mmCIF file: 7QWC-1 +<<< Could not download PDB/mmCIF file: 7RKZ-1 +<<< Could not download PDB/mmCIF file: 7TH4-1 +<<< Could not download PDB/mmCIF file: 7TTF-1 +<<< Could not download PDB/mmCIF file: 7TYM-1 +<<< Could not download PDB/mmCIF file: 7U6J-6 +<<< Could not download PDB/mmCIF file: 7UBA-1 +<<< Could not download PDB/mmCIF file: 7UFZ-1 +<<< Could not download PDB/mmCIF file: 7UJI-1 +<<< Could not download PDB/mmCIF file: 7UNI-2 +<<< Could not download PDB/mmCIF file: 7WD4-1 +<<< Could not download PDB/mmCIF file: 7WG0-1 +<<< Could not download PDB/mmCIF file: 7WK7-1 +<<< Could not download PDB/mmCIF file: 7WNS-1 +<<< Could not download PDB/mmCIF file: 7X4T-1 +<<< Could not download PDB/mmCIF file: 7X6G-2 +<<< Could not download PDB/mmCIF file: 7XBT-1 +<<< Could not download PDB/mmCIF file: 7XDY-2 +<<< Could not download PDB/mmCIF file: 7XFK-3 +<<< Could not download PDB/mmCIF file: 7XJM-2 +<<< Could not download PDB/mmCIF file: 7XKX-2 +<<< Could not download PDB/mmCIF file: 7XPC-1 +<<< Could not download PDB/mmCIF file: 7XRA-1 +<<< Could not download PDB/mmCIF file: 7XUY-1 +<<< Could not download PDB/mmCIF file: 7XWM-2 +<<< Could not download PDB/mmCIF file: 7XY7-1 +<<< Could not download PDB/mmCIF file: 7Y67-1 +<<< Could not download PDB/mmCIF file: 7Y8H-2 +<<< Could not download PDB/mmCIF file: 7YA3-1 +<<< Could not download PDB/mmCIF file: 7YCN-1 +<<< Could not download PDB/mmCIF file: 7YHL-1 +<<< Could not download PDB/mmCIF file: 7YJR-1 +<<< Could not download PDB/mmCIF file: 7YMP-2 +<<< Could not download PDB/mmCIF file: 7YSX-1 +<<< Could not download PDB/mmCIF file: 7Z3R-1 +<<< Could not download PDB/mmCIF file: 7Z5N-2 +<<< Could not download PDB/mmCIF file: 7ZAM-1 +<<< Could not download PDB/mmCIF file: 7ZBZ-1 +<<< Could not download PDB/mmCIF file: 7ZIW-1 +<<< Could not download PDB/mmCIF file: 7ZOH-2 +<<< Could not download PDB/mmCIF file: 7ZS7-3 +<<< Could not download PDB/mmCIF file: 7ZVO-1 +<<< Could not download PDB/mmCIF file: 7ZXC-1 +<<< Could not download PDB/mmCIF file: 8A18-1 +<<< Could not download PDB/mmCIF file: 8A97-4 +<<< Could not download PDB/mmCIF file: 8ABO-1 +<<< Could not download PDB/mmCIF file: 8ADC-2 +<<< Could not download PDB/mmCIF file: 8AF9-1 +<<< Could not download PDB/mmCIF file: 8AGD-1 +<<< Could not download 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file: 8DHI-1 +<<< Could not download PDB/mmCIF file: 8DJE-1 +<<< Could not download PDB/mmCIF file: 8DMQ-1 +<<< Could not download PDB/mmCIF file: 8DSJ-1 +<<< Could not download PDB/mmCIF file: 8DZ8-3 +<<< Could not download PDB/mmCIF file: 8E10-2 +<<< Could not download PDB/mmCIF file: 8E2K-1 +<<< Could not download PDB/mmCIF file: 8E84-3 +<<< Could not download PDB/mmCIF file: 8EGK-1 +<<< Could not download PDB/mmCIF file: 8EIX-1 +<<< Could not download PDB/mmCIF file: 8EMS-1 +<<< Could not download PDB/mmCIF file: 8EPV-1 +<<< Could not download PDB/mmCIF file: 8ERO-1 +<<< Could not download PDB/mmCIF file: 8EYA-2 +<<< Could not download PDB/mmCIF file: 8F07-1 +<<< Could not download PDB/mmCIF file: 8F3J-1 +<<< Could not download PDB/mmCIF file: 8F5W-2 +<<< Could not download PDB/mmCIF file: 8F8Y-2 +<<< Could not download PDB/mmCIF file: 8FC0-4 +<<< Could not download PDB/mmCIF file: 8FF7-5 +<<< Could not download PDB/mmCIF file: 8FJ3-1 +<<< Could not download PDB/mmCIF file: 8FM5-1 +<<< Could not download PDB/mmCIF file: 8FP0-1 +<<< Could not download PDB/mmCIF file: 8FUC-1 +<<< Could not download PDB/mmCIF file: 8FY5-1 +<<< Could not download PDB/mmCIF file: 8G2F-1 +<<< Could not download PDB/mmCIF file: 8G69-2 +<<< Could not download PDB/mmCIF file: 8GCZ-1 +<<< Could not download PDB/mmCIF file: 8GIA-2 +<<< Could not download PDB/mmCIF file: 8GN6-2 +<<< Could not download PDB/mmCIF file: 8GR3-1 +<<< Could not download PDB/mmCIF file: 8GTJ-1 +<<< Could not download PDB/mmCIF file: 8H1L-1 +<<< Could not download PDB/mmCIF file: 8H65-1 +<<< Could not download PDB/mmCIF file: 8HAW-1 +<<< Could not download PDB/mmCIF file: 8HFA-2 +<<< Could not download PDB/mmCIF file: 8HK0-1 +<<< Could not download PDB/mmCIF file: 8HP5-3 +<<< Could not download PDB/mmCIF file: 8I17-1 +<<< Could not download PDB/mmCIF file: 8I2Z-1 +<<< Could not download PDB/mmCIF file: 8I8K-3 +<<< Could not download PDB/mmCIF file: 8IE8-1 +<<< Could not download PDB/mmCIF file: 8ILX-2 +<<< Could not download PDB/mmCIF file: 8IVW-3 +<<< Could not download PDB/mmCIF file: 8JD4-1 +<<< Could not download PDB/mmCIF file: 8OIG-1 +<<< Could not download PDB/mmCIF file: 8ORG-1 +<<< Could not download PDB/mmCIF file: 8P06-1 +<<< Could not download PDB/mmCIF file: 8PFC-3 +<<< Could not download PDB/mmCIF file: 8SC0-4 +<<< Could not download PDB/mmCIF file: 8SLU-1 +<<< Could not download PDB/mmCIF file: 8T5L-1 +<<< Could not download PDB/mmCIF file: 7R29-1 +<<< Could not download PDB/mmCIF file: 7W4B-1 +<<< Could not download PDB/mmCIF file: 7WHB-1 +<<< Could not download PDB/mmCIF file: 7ZH1-1 +<<< Could not download PDB/mmCIF file: 8A6E-1 +<<< Could not download PDB/mmCIF file: 8B3B-2 +<<< Could not download PDB/mmCIF file: 8ENT-4 +<<< Could not download PDB/mmCIF file: 8FK4-5 +<<< Could not download PDB/mmCIF file: 8GB6-1 +<<< Could not download PDB/mmCIF file: 8IOT-1 +<<< Could not download PDB/mmCIF file: 6GPN-2 +<<< Could not download PDB/mmCIF file: 6HL8-2 +<<< Could not download 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file: 7U08-1 +<<< Could not download PDB/mmCIF file: 7U6J-7 +<<< Could not download PDB/mmCIF file: 7UFZ-2 +<<< Could not download PDB/mmCIF file: 7UNJ-1 +<<< Could not download PDB/mmCIF file: 7WG0-2 +<<< Could not download PDB/mmCIF file: 7WMB-1 +<<< Could not download PDB/mmCIF file: 7WNT-1 +<<< Could not download PDB/mmCIF file: 7X4T-2 +<<< Could not download PDB/mmCIF file: 7X6G-3 +<<< Could not download PDB/mmCIF file: 7XA4-1 +<<< Could not download PDB/mmCIF file: 7XBU-1 +<<< Could not download PDB/mmCIF file: 7XFK-4 +<<< Could not download PDB/mmCIF file: 7XJM-3 +<<< Could not download PDB/mmCIF file: 7XKY-1 +<<< Could not download PDB/mmCIF file: 7XN2-1 +<<< Could not download PDB/mmCIF file: 7XPC-2 +<<< Could not download PDB/mmCIF file: 7XRB-1 +<<< Could not download PDB/mmCIF file: 7XV0-1 +<<< Could not download PDB/mmCIF file: 7Y6A-1 +<<< Could not download PDB/mmCIF file: 7Y8I-1 +<<< Could not download PDB/mmCIF file: 7YA4-1 +<<< Could not download PDB/mmCIF file: 7YCN-2 +<<< Could not download PDB/mmCIF file: 7YHR-1 +<<< Could not download PDB/mmCIF file: 7YJR-2 +<<< Could not download PDB/mmCIF file: 7YMP-3 +<<< Could not download PDB/mmCIF file: 7Z3S-1 +<<< Could not download PDB/mmCIF file: 7Z5N-3 +<<< Could not download PDB/mmCIF file: 7ZE5-1 +<<< Could not download PDB/mmCIF file: 7ZHC-1 +<<< Could not download PDB/mmCIF file: 7ZIW-2 +<<< Could not download PDB/mmCIF file: 7ZKS-1 +<<< Could not download PDB/mmCIF file: 7ZOH-3 +<<< Could not download PDB/mmCIF file: 7ZQ7-1 +<<< Could not download PDB/mmCIF file: 7ZS7-4 +<<< Could not download PDB/mmCIF file: 7ZTZ-1 +<<< Could not download PDB/mmCIF file: 7ZXD-1 +<<< Could not download PDB/mmCIF file: 8A4D-1 +<<< Could not download PDB/mmCIF file: 8A9A-1 +<<< Could not download PDB/mmCIF file: 8ADD-1 +<<< Could not download PDB/mmCIF file: 8AF9-2 +<<< Could not download PDB/mmCIF file: 8AIF-1 +<<< Could not download PDB/mmCIF file: 8AKH-1 +<<< Could not download PDB/mmCIF file: 8ATM-1 +<<< Could not download PDB/mmCIF file: 8AVK-1 +<<< Could not download PDB/mmCIF file: 8B6I-2 +<<< Could not download PDB/mmCIF file: 8BB6-1 +<<< Could not download PDB/mmCIF file: 8BDS-1 +<<< Could not download PDB/mmCIF file: 8BOD-1 +<<< Could not download PDB/mmCIF file: 8BRK-1 +<<< Could not download PDB/mmCIF file: 8BV1-2 +<<< Could not download PDB/mmCIF file: 8BYW-6 +<<< Could not download PDB/mmCIF file: 8C3X-1 +<<< Could not download PDB/mmCIF file: 8C7O-2 +<<< Could not download PDB/mmCIF file: 8CCN-1 +<<< Could not download PDB/mmCIF file: 8CGB-2 +<<< Could not download PDB/mmCIF file: 8CLL-1 +<<< Could not download PDB/mmCIF file: 8CUF-1 +<<< Could not download PDB/mmCIF file: 8CZK-1 +<<< Could not download PDB/mmCIF file: 8D8E-1 +<<< Could not download PDB/mmCIF file: 8DHI-2 +<<< Could not download PDB/mmCIF file: 8DJE-2 +<<< Could not download PDB/mmCIF file: 8DMQ-2 +<<< Could not download PDB/mmCIF file: 8DPQ-1 +<<< Could not download PDB/mmCIF file: 8DSJ-2 +<<< Could not download 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file: 8GIH-1 +<<< Could not download PDB/mmCIF file: 8GN6-3 +<<< Could not download PDB/mmCIF file: 8GR3-2 +<<< Could not download PDB/mmCIF file: 8GTJ-2 +<<< Could not download PDB/mmCIF file: 8GXD-1 +<<< Could not download PDB/mmCIF file: 8H1L-2 +<<< Could not download PDB/mmCIF file: 8H66-1 +<<< Could not download PDB/mmCIF file: 8HB9-1 +<<< Could not download PDB/mmCIF file: 8HFA-3 +<<< Could not download PDB/mmCIF file: 8HK2-1 +<<< Could not download PDB/mmCIF file: 8HP6-1 +<<< Could not download PDB/mmCIF file: 8I17-2 +<<< Could not download PDB/mmCIF file: 8I3F-1 +<<< Could not download PDB/mmCIF file: 8I8L-1 +<<< Could not download PDB/mmCIF file: 8IEU-1 +<<< Could not download PDB/mmCIF file: 8ILY-1 +<<< Could not download PDB/mmCIF file: 8IVW-4 +<<< Could not download PDB/mmCIF file: 8JD6-1 +<<< Could not download PDB/mmCIF file: 8OIG-2 +<<< Could not download PDB/mmCIF file: 8ORN-1 +<<< Could not download PDB/mmCIF file: 8P06-2 +<<< Could not download PDB/mmCIF file: 8PFC-4 +<<< Could not download PDB/mmCIF file: 8SCD-1 +<<< Could not download PDB/mmCIF file: 8SLX-1 +<<< Could not download PDB/mmCIF file: 8T5N-1 +<<< Could not download PDB/mmCIF file: 7R29-2 +<<< Could not download PDB/mmCIF file: 7W4B-2 +<<< Could not download PDB/mmCIF file: 7WHD-1 +<<< Could not download PDB/mmCIF file: 7WVD-1 +<<< Could not download PDB/mmCIF file: 7YSH-1 +<<< Could not download PDB/mmCIF file: 7ZH2-1 +<<< Could not download PDB/mmCIF file: 8A94-1 +<<< Could not download PDB/mmCIF file: 8B3B-3 +<<< Could not download PDB/mmCIF file: 8EOG-1 +<<< Could not download PDB/mmCIF file: 8FK4-6 +<<< Could not download PDB/mmCIF file: 8GB7-1 +<<< Could not download PDB/mmCIF file: 8IOU-1 +<<< Could not download PDB/mmCIF file: 7FS3-1 +<<< Could not download PDB/mmCIF file: 7FSM-3 +<<< Could not download PDB/mmCIF file: 7FSZ-1 +<<< Could not download PDB/mmCIF file: 7FTB-3 +<<< Could not download PDB/mmCIF file: 7FVY-1 +<<< Could not download PDB/mmCIF file: 7FX9-1 +<<< Could 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+<<< Could not download PDB/mmCIF file: 8BB6-2 +<<< Could not download PDB/mmCIF file: 8BDT-1 +<<< Could not download PDB/mmCIF file: 8BKD-1 +<<< Could not download PDB/mmCIF file: 8BOF-1 +<<< Could not download PDB/mmCIF file: 8BRL-1 +<<< Could not download PDB/mmCIF file: 8BV1-3 +<<< Could not download PDB/mmCIF file: 8BYW-7 +<<< Could not download PDB/mmCIF file: 8C4I-1 +<<< Could not download PDB/mmCIF file: 8C7T-1 +<<< Could not download PDB/mmCIF file: 8CCO-1 +<<< Could not download PDB/mmCIF file: 8CGC-1 +<<< Could not download PDB/mmCIF file: 8CM1-1 +<<< Could not download PDB/mmCIF file: 8CUF-2 +<<< Could not download PDB/mmCIF file: 8CWR-1 +<<< Could not download PDB/mmCIF file: 8CZK-2 +<<< Could not download PDB/mmCIF file: 8D8F-1 +<<< Could not download PDB/mmCIF file: 8DHJ-1 +<<< Could not download PDB/mmCIF file: 8DJF-1 +<<< Could not download PDB/mmCIF file: 8DMR-1 +<<< Could not download PDB/mmCIF file: 8DSL-1 +<<< Could not download PDB/mmCIF file: 8DUF-1 +<<< Could not download PDB/mmCIF file: 8DZ8-5 +<<< Could not download PDB/mmCIF file: 8E11-2 +<<< Could not download PDB/mmCIF file: 8E2R-1 +<<< Could not download PDB/mmCIF file: 8E60-1 +<<< Could not download PDB/mmCIF file: 8EJ7-1 +<<< Could not download PDB/mmCIF file: 8EMU-1 +<<< Could not download PDB/mmCIF file: 8EPZ-1 +<<< Could not download PDB/mmCIF file: 8EW2-1 +<<< Could not download PDB/mmCIF file: 8EYB-2 +<<< Could not download PDB/mmCIF file: 8F3L-1 +<<< Could not download PDB/mmCIF file: 8F61-1 +<<< Could not download PDB/mmCIF file: 8F8Z-2 +<<< Could not download PDB/mmCIF file: 8FC0-6 +<<< Could not download PDB/mmCIF file: 8FF8-1 +<<< Could not download PDB/mmCIF file: 8FJ9-2 +<<< Could not download PDB/mmCIF file: 8FM5-3 +<<< Could not download PDB/mmCIF file: 8FP3-1 +<<< Could not download PDB/mmCIF file: 8FUJ-1 +<<< Could not download PDB/mmCIF file: 8FZ3-1 +<<< Could not download PDB/mmCIF file: 8G2G-2 +<<< Could not download PDB/mmCIF file: 8G6A-2 +<<< Could not download 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file: 8SLY-1 +<<< Could not download PDB/mmCIF file: 8T5T-1 +<<< Could not download PDB/mmCIF file: 7R2D-1 +<<< Could not download PDB/mmCIF file: 7W4B-3 +<<< Could not download PDB/mmCIF file: 7WHE-1 +<<< Could not download PDB/mmCIF file: 7YSU-1 +<<< Could not download PDB/mmCIF file: 8A99-1 +<<< Could not download PDB/mmCIF file: 8B3B-4 +<<< Could not download PDB/mmCIF file: 8EOR-1 +<<< Could not download PDB/mmCIF file: 8FK4-7 +<<< Could not download PDB/mmCIF file: 8GCA-1 +<<< Could not download PDB/mmCIF file: 8IOV-1 +<<< Could not download PDB/mmCIF file: 6HL9-2 +<<< Could not download PDB/mmCIF file: 7FS3-2 +<<< Could not download PDB/mmCIF file: 7FSM-4 +<<< Could not download PDB/mmCIF file: 7FSZ-2 +<<< Could not download PDB/mmCIF file: 7FTB-4 +<<< Could not download PDB/mmCIF file: 7FVZ-1 +<<< Could not download PDB/mmCIF file: 7FXA-1 +<<< Could not download PDB/mmCIF file: 7FYF-1 +<<< Could not download PDB/mmCIF file: 7FZP-1 +<<< Could not download PDB/mmCIF file: 7G0M-1 +<<< Could not download PDB/mmCIF file: 7G1X-1 +<<< Could not download PDB/mmCIF file: 7G98-1 +<<< Could not download PDB/mmCIF file: 7QBJ-1 +<<< Could not download PDB/mmCIF file: 7QON-2 +<<< Could not download PDB/mmCIF file: 7QPR-1 +<<< Could not download PDB/mmCIF file: 7QRA-2 +<<< Could not download PDB/mmCIF file: 7QWE-2 +<<< Could not download PDB/mmCIF file: 7QXV-1 +<<< Could not download PDB/mmCIF file: 7SQA-1 +<<< Could not download PDB/mmCIF file: 7SVP-2 +<<< Could not download PDB/mmCIF file: 7T94-1 +<<< Could not download PDB/mmCIF file: 7TO8-1 +<<< Could not download PDB/mmCIF file: 7TQD-1 +<<< Could not download PDB/mmCIF file: 7TTK-1 +<<< Could not download PDB/mmCIF file: 7TYP-1 +<<< Could not download PDB/mmCIF file: 7U4C-1 +<<< Could not download PDB/mmCIF file: 7U9J-1 +<<< Could not download PDB/mmCIF file: 7UDF-1 +<<< Could not download PDB/mmCIF file: 7UG1-1 +<<< Could not download PDB/mmCIF file: 7UL1-1 +<<< Could not download PDB/mmCIF file: 7UM2-1 +<<< Could not download PDB/mmCIF file: 7URL-1 +<<< Could not download PDB/mmCIF file: 7UVQ-1 +<<< Could not download PDB/mmCIF file: 7WNV-2 +<<< Could not download PDB/mmCIF file: 7WQA-1 +<<< Could not download PDB/mmCIF file: 7WYF-1 +<<< Could not download PDB/mmCIF file: 7X2H-1 +<<< Could not download PDB/mmCIF file: 7X4V-1 +<<< Could not download PDB/mmCIF file: 7X6H-2 +<<< Could not download PDB/mmCIF file: 7XGT-1 +<<< Could not download PDB/mmCIF file: 7XI2-1 +<<< Could not download PDB/mmCIF file: 7XJN-1 +<<< Could not download PDB/mmCIF file: 7XPJ-1 +<<< Could not download PDB/mmCIF file: 7XRF-1 +<<< Could not download PDB/mmCIF file: 7XV2-1 +<<< Could not download PDB/mmCIF file: 7XWO-1 +<<< Could not download PDB/mmCIF file: 7XY9-1 +<<< Could not download PDB/mmCIF file: 7XZH-1 +<<< Could not download PDB/mmCIF file: 7Y16-2 +<<< Could not download PDB/mmCIF file: 7Y4A-1 +<<< Could not download PDB/mmCIF file: 7Y8I-3 +<<< Could not download PDB/mmCIF file: 7YA7-1 +<<< Could not download 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file: 8ADF-1 +<<< Could not download PDB/mmCIF file: 8AF9-4 +<<< Could not download PDB/mmCIF file: 8AIF-3 +<<< Could not download PDB/mmCIF file: 8AKI-1 +<<< Could not download PDB/mmCIF file: 8AQS-1 +<<< Could not download PDB/mmCIF file: 8ATU-1 +<<< Could not download PDB/mmCIF file: 8AVL-2 +<<< Could not download PDB/mmCIF file: 8AXS-1 +<<< Could not download PDB/mmCIF file: 8B03-1 +<<< Could not download PDB/mmCIF file: 8B70-1 +<<< Could not download PDB/mmCIF file: 8BB7-1 +<<< Could not download PDB/mmCIF file: 8BDT-2 +<<< Could not download PDB/mmCIF file: 8BKD-2 +<<< Could not download PDB/mmCIF file: 8BOG-1 +<<< Could not download PDB/mmCIF file: 8BRO-1 +<<< Could not download PDB/mmCIF file: 8BV1-4 +<<< Could not download PDB/mmCIF file: 8BYW-8 +<<< Could not download PDB/mmCIF file: 8C4J-1 +<<< Could not download PDB/mmCIF file: 8C7T-2 +<<< Could not download PDB/mmCIF file: 8CCQ-1 +<<< Could not download PDB/mmCIF file: 8CGM-1 +<<< Could not download PDB/mmCIF file: 8CNH-1 +<<< Could not download PDB/mmCIF file: 8CUG-1 +<<< Could not download PDB/mmCIF file: 8CWT-1 +<<< Could not download PDB/mmCIF file: 8CZL-1 +<<< Could not download PDB/mmCIF file: 8D5S-1 +<<< Could not download PDB/mmCIF file: 8D8G-1 +<<< Could not download PDB/mmCIF file: 8DHJ-2 +<<< Could not download PDB/mmCIF file: 8DJG-1 +<<< Could not download PDB/mmCIF file: 8DMS-1 +<<< Could not download PDB/mmCIF file: 8DPY-1 +<<< Could not download PDB/mmCIF file: 8DSL-2 +<<< Could not download PDB/mmCIF file: 8DX8-1 +<<< Could not download PDB/mmCIF file: 8DZ8-6 +<<< Could not download PDB/mmCIF file: 8E12-1 +<<< Could not download PDB/mmCIF file: 8E2S-1 +<<< Could not download PDB/mmCIF file: 8EB9-1 +<<< Could not download PDB/mmCIF file: 8EJ9-1 +<<< Could not download PDB/mmCIF file: 8EMW-1 +<<< Could not download PDB/mmCIF file: 8EQ0-1 +<<< Could not download PDB/mmCIF file: 8EYD-1 +<<< Could not download PDB/mmCIF file: 8F3M-1 +<<< Could not download PDB/mmCIF file: 8F61-2 +<<< Could 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file: 8CT6-1 +<<< Could not download PDB/mmCIF file: 8DM1-1 +<<< Could not download PDB/mmCIF file: 8EPA-1 +<<< Could not download PDB/mmCIF file: 8FK4-8 +<<< Could not download PDB/mmCIF file: 8GCA-2 +<<< Could not download PDB/mmCIF file: 8IUA-1 +<<< Could not download PDB/mmCIF file: 7FS4-1 +<<< Could not download PDB/mmCIF file: 7FSN-1 +<<< Could not download PDB/mmCIF file: 7FSZ-3 +<<< Could not download PDB/mmCIF file: 7FTC-1 +<<< Could not download PDB/mmCIF file: 7FW0-1 +<<< Could not download PDB/mmCIF file: 7FXB-1 +<<< Could not download PDB/mmCIF file: 7FYG-1 +<<< Could not download PDB/mmCIF file: 7FZQ-1 +<<< Could not download PDB/mmCIF file: 7G0N-1 +<<< Could not download PDB/mmCIF file: 7G1X-2 +<<< Could not download PDB/mmCIF file: 7G99-1 +<<< Could not download PDB/mmCIF file: 7QBJ-2 +<<< Could not download PDB/mmCIF file: 7QH9-1 +<<< Could not download PDB/mmCIF file: 7QOP-1 +<<< Could not download PDB/mmCIF file: 7QPR-2 +<<< Could not download PDB/mmCIF file: 7QRA-3 +<<< Could not download PDB/mmCIF file: 7QUZ-1 +<<< Could not download PDB/mmCIF file: 7R37-1 +<<< Could not download PDB/mmCIF file: 7S3P-1 +<<< Could not download PDB/mmCIF file: 7SQA-2 +<<< Could not download PDB/mmCIF file: 7SVP-3 +<<< Could not download PDB/mmCIF file: 7T96-1 +<<< Could not download PDB/mmCIF file: 7THA-1 +<<< Could not download PDB/mmCIF file: 7TO9-1 +<<< Could not download PDB/mmCIF file: 7TTK-2 +<<< Could not download PDB/mmCIF file: 7TYP-2 +<<< Could not download PDB/mmCIF file: 7U4C-2 +<<< Could not download PDB/mmCIF file: 7U9J-2 +<<< Could not download PDB/mmCIF file: 7UDI-1 +<<< Could not download PDB/mmCIF file: 7UEO-1 +<<< Could not download PDB/mmCIF file: 7UG2-1 +<<< Could not download PDB/mmCIF file: 7UPN-1 +<<< Could not download PDB/mmCIF file: 7URL-2 +<<< Could not download PDB/mmCIF file: 7UVS-1 +<<< Could not download PDB/mmCIF file: 7UYX-1 +<<< Could not download PDB/mmCIF file: 7V34-1 +<<< Could not download PDB/mmCIF file: 7WKG-1 +<<< Could not download PDB/mmCIF file: 7X2H-2 +<<< Could not download PDB/mmCIF file: 7X4W-1 +<<< Could not download PDB/mmCIF file: 7XGV-1 +<<< Could not download PDB/mmCIF file: 7XI5-1 +<<< Could not download PDB/mmCIF file: 7XJN-2 +<<< Could not download PDB/mmCIF file: 7XPK-1 +<<< Could not download PDB/mmCIF file: 7XRH-1 +<<< Could not download PDB/mmCIF file: 7XTK-1 +<<< Could not download PDB/mmCIF file: 7XV3-1 +<<< Could not download PDB/mmCIF file: 7XYE-1 +<<< Could not download PDB/mmCIF file: 7XZJ-1 +<<< Could not download PDB/mmCIF file: 7Y17-1 +<<< Could not download PDB/mmCIF file: 7Y4A-2 +<<< Could not download PDB/mmCIF file: 7Y8I-4 +<<< Could not download PDB/mmCIF file: 7YA7-2 +<<< Could not download PDB/mmCIF file: 7YCO-1 +<<< Could not download PDB/mmCIF file: 7YF3-1 +<<< Could not download PDB/mmCIF file: 7YJT-1 +<<< Could not download PDB/mmCIF file: 7YMP-6 +<<< Could not download PDB/mmCIF file: 7YYV-1 +<<< Could not download PDB/mmCIF file: 7Z1Y-1 +<<< Could not download 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+<<< Could not download PDB/mmCIF file: 8D8H-1 +<<< Could not download PDB/mmCIF file: 8DHL-1 +<<< Could not download PDB/mmCIF file: 8DJG-2 +<<< Could not download PDB/mmCIF file: 8DMS-2 +<<< Could not download PDB/mmCIF file: 8DPY-2 +<<< Could not download PDB/mmCIF file: 8DSN-1 +<<< Could not download PDB/mmCIF file: 8DXB-1 +<<< Could not download PDB/mmCIF file: 8DZ8-7 +<<< Could not download PDB/mmCIF file: 8E17-1 +<<< Could not download PDB/mmCIF file: 8E2S-2 +<<< Could not download PDB/mmCIF file: 8EBB-1 +<<< Could not download PDB/mmCIF file: 8EJB-1 +<<< Could not download PDB/mmCIF file: 8EMX-1 +<<< Could not download PDB/mmCIF file: 8EQ1-1 +<<< Could not download PDB/mmCIF file: 8ERX-1 +<<< Could not download PDB/mmCIF file: 8EYE-1 +<<< Could not download PDB/mmCIF file: 8F0B-1 +<<< Could not download PDB/mmCIF file: 8F3N-1 +<<< Could not download PDB/mmCIF file: 8F93-2 +<<< Could not download PDB/mmCIF file: 8FC0-8 +<<< Could not download PDB/mmCIF file: 8FFK-1 +<<< Could not download PDB/mmCIF file: 8FJZ-1 +<<< Could not download PDB/mmCIF file: 8FM7-1 +<<< Could not download PDB/mmCIF file: 8FPE-1 +<<< Could not download PDB/mmCIF file: 8FUL-2 +<<< Could not download PDB/mmCIF file: 8FZ3-3 +<<< Could not download PDB/mmCIF file: 8G2S-1 +<<< Could not download PDB/mmCIF file: 8G6Z-1 +<<< Could not download PDB/mmCIF file: 8GD5-1 +<<< Could not download PDB/mmCIF file: 8GJJ-1 +<<< Could not download PDB/mmCIF file: 8GNG-1 +<<< Could not download PDB/mmCIF file: 8GR6-1 +<<< Could not download PDB/mmCIF file: 8H26-1 +<<< Could not download PDB/mmCIF file: 8H6P-1 +<<< Could not download PDB/mmCIF file: 8HBD-1 +<<< Could not download PDB/mmCIF file: 8HFB-1 +<<< Could not download PDB/mmCIF file: 8HK9-1 +<<< Could not download PDB/mmCIF file: 8HP7-1 +<<< Could not download PDB/mmCIF file: 8I18-2 +<<< Could not download PDB/mmCIF file: 8I4A-1 +<<< Could not download PDB/mmCIF file: 8I8M-1 +<<< Could not download PDB/mmCIF file: 8IEV-3 +<<< Could not download 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file: 7FS4-2 +<<< Could not download PDB/mmCIF file: 7FSN-2 +<<< Could not download PDB/mmCIF file: 7FSZ-4 +<<< Could not download PDB/mmCIF file: 7FTC-2 +<<< Could not download PDB/mmCIF file: 7FW1-1 +<<< Could not download PDB/mmCIF file: 7FXC-1 +<<< Could not download PDB/mmCIF file: 7FYH-1 +<<< Could not download PDB/mmCIF file: 7FZQ-2 +<<< Could not download PDB/mmCIF file: 7G0O-1 +<<< Could not download PDB/mmCIF file: 7G1Y-1 +<<< Could not download PDB/mmCIF file: 7G9A-1 +<<< Could not download PDB/mmCIF file: 7QH9-2 +<<< Could not download PDB/mmCIF file: 7QOQ-1 +<<< Could not download PDB/mmCIF file: 7QPR-3 +<<< Could not download PDB/mmCIF file: 7QRA-4 +<<< Could not download PDB/mmCIF file: 7QUZ-2 +<<< Could not download PDB/mmCIF file: 7R38-1 +<<< Could not download PDB/mmCIF file: 7RZ0-1 +<<< Could not download PDB/mmCIF file: 7S3P-10 +<<< Could not download PDB/mmCIF file: 7SQB-1 +<<< Could not download PDB/mmCIF file: 7SVP-4 +<<< Could not download PDB/mmCIF file: 7TOA-1 +<<< Could not download PDB/mmCIF file: 7TYQ-1 +<<< Could not download PDB/mmCIF file: 7U9K-1 +<<< Could not download PDB/mmCIF file: 7UDJ-1 +<<< Could not download PDB/mmCIF file: 7UEP-1 +<<< Could not download PDB/mmCIF file: 7URP-1 +<<< Could not download PDB/mmCIF file: 7UTW-1 +<<< Could not download PDB/mmCIF file: 7UVS-2 +<<< Could not download PDB/mmCIF file: 7UYX-2 +<<< Could not download PDB/mmCIF file: 7WRW-1 +<<< Could not download PDB/mmCIF file: 7WWK-1 +<<< Could not download PDB/mmCIF file: 7X4W-2 +<<< Could not download PDB/mmCIF file: 7XGV-2 +<<< Could not download PDB/mmCIF file: 7XI5-2 +<<< Could not download PDB/mmCIF file: 7XJN-3 +<<< Could not download PDB/mmCIF file: 7XPK-2 +<<< Could not download PDB/mmCIF file: 7XRI-1 +<<< Could not download PDB/mmCIF file: 7XV4-1 +<<< Could not download PDB/mmCIF file: 7XYE-2 +<<< Could not download PDB/mmCIF file: 7XZK-1 +<<< Could not download PDB/mmCIF file: 7Y17-2 +<<< Could not download PDB/mmCIF file: 7Y4A-3 +<<< Could not download PDB/mmCIF file: 7Y8I-5 +<<< Could not download PDB/mmCIF file: 7YA8-1 +<<< Could not download PDB/mmCIF file: 7YCQ-1 +<<< Could not download PDB/mmCIF file: 7YF4-1 +<<< Could not download PDB/mmCIF file: 7YI8-1 +<<< Could not download PDB/mmCIF file: 7YJT-2 +<<< Could not download PDB/mmCIF file: 7YMP-7 +<<< Could not download PDB/mmCIF file: 7YPC-1 +<<< Could not download PDB/mmCIF file: 7YYW-1 +<<< Could not download PDB/mmCIF file: 7Z3T-4 +<<< Could not download PDB/mmCIF file: 7Z5N-7 +<<< Could not download PDB/mmCIF file: 7ZC7-1 +<<< Could not download PDB/mmCIF file: 7ZEC-1 +<<< Could not download PDB/mmCIF file: 7ZIY-2 +<<< Could not download PDB/mmCIF file: 7ZKT-4 +<<< Could not download PDB/mmCIF file: 7ZON-1 +<<< Could not download PDB/mmCIF file: 7ZQG-1 +<<< Could not download PDB/mmCIF file: 7ZU4-1 +<<< Could not download PDB/mmCIF file: 8A1G-2 +<<< Could not download PDB/mmCIF file: 8A4G-1 +<<< Could not download PDB/mmCIF file: 8A9F-1 +<<< Could not download 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file: 8CGS-1 +<<< Could not download PDB/mmCIF file: 8CNS-1 +<<< Could not download PDB/mmCIF file: 8D5U-1 +<<< Could not download PDB/mmCIF file: 8DMU-1 +<<< Could not download PDB/mmCIF file: 8DOL-1 +<<< Could not download PDB/mmCIF file: 8DQ2-1 +<<< Could not download PDB/mmCIF file: 8DSN-2 +<<< Could not download PDB/mmCIF file: 8DXE-1 +<<< Could not download PDB/mmCIF file: 8DZ8-8 +<<< Could not download PDB/mmCIF file: 8E2S-3 +<<< Could not download PDB/mmCIF file: 8EBB-2 +<<< Could not download PDB/mmCIF file: 8EJC-1 +<<< Could not download PDB/mmCIF file: 8EMZ-1 +<<< Could not download PDB/mmCIF file: 8EQ3-1 +<<< Could not download PDB/mmCIF file: 8ES5-1 +<<< Could not download PDB/mmCIF file: 8EYF-1 +<<< Could not download PDB/mmCIF file: 8F0F-1 +<<< Could not download PDB/mmCIF file: 8F3O-1 +<<< Could not download PDB/mmCIF file: 8F9Y-1 +<<< Could not download PDB/mmCIF file: 8FC7-1 +<<< Could not download PDB/mmCIF file: 8FFS-1 +<<< Could not download PDB/mmCIF file: 8FJZ-2 +<<< Could not download PDB/mmCIF file: 8FM7-2 +<<< Could not download PDB/mmCIF file: 8FPI-1 +<<< Could not download PDB/mmCIF file: 8FUM-1 +<<< Could not download PDB/mmCIF file: 8FZ3-4 +<<< Could not download PDB/mmCIF file: 8G2X-1 +<<< Could not download PDB/mmCIF file: 8G7F-1 +<<< Could not download PDB/mmCIF file: 8GDI-1 +<<< Could not download PDB/mmCIF file: 8GJK-1 +<<< Could not download PDB/mmCIF file: 8GNG-2 +<<< Could not download PDB/mmCIF file: 8GR8-1 +<<< Could not download PDB/mmCIF file: 8GU3-1 +<<< Could not download PDB/mmCIF file: 8H26-2 +<<< Could not download PDB/mmCIF file: 8HBE-1 +<<< Could not download PDB/mmCIF file: 8HFH-1 +<<< Could not download PDB/mmCIF file: 8HK9-2 +<<< Could not download PDB/mmCIF file: 8HP7-2 +<<< Could not download PDB/mmCIF file: 8I19-1 +<<< Could not download PDB/mmCIF file: 8I4B-1 +<<< Could not download PDB/mmCIF file: 8I8M-2 +<<< Could not download PDB/mmCIF file: 8IF8-1 +<<< Could not download PDB/mmCIF file: 8IM1-1 +<<< Could not download PDB/mmCIF file: 8IW7-1 +<<< Could not download PDB/mmCIF file: 8JJ7-1 +<<< Could not download PDB/mmCIF file: 8OIK-2 +<<< Could not download PDB/mmCIF file: 8OSP-1 +<<< Could not download PDB/mmCIF file: 8P0F-2 +<<< Could not download PDB/mmCIF file: 8PFC-8 +<<< Could not download PDB/mmCIF file: 8SEQ-1 +<<< Could not download PDB/mmCIF file: 8SNG-1 +<<< Could not download PDB/mmCIF file: 8TE5-1 +<<< Could not download PDB/mmCIF file: 7U2O-1 +<<< Could not download PDB/mmCIF file: 7UZD-1 +<<< Could not download PDB/mmCIF file: 7W4B-6 +<<< Could not download PDB/mmCIF file: 7XBG-1 +<<< Could not download PDB/mmCIF file: 8AA2-1 +<<< Could not download PDB/mmCIF file: 8B48-1 +<<< Could not download PDB/mmCIF file: 8CTN-2 +<<< Could not download PDB/mmCIF file: 8DM3-1 +<<< Could not download PDB/mmCIF file: 8FMX-1 +<<< Could not download PDB/mmCIF file: 8GHY-2 +<<< Could not download PDB/mmCIF file: 8IUC-1 +<<< Could not download PDB/mmCIF file: 7F6G-1 +<<< Could not download 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file: 7S3P-11 +<<< Could not download PDB/mmCIF file: 7TQG-1 +<<< Could not download PDB/mmCIF file: 7TYQ-2 +<<< Could not download PDB/mmCIF file: 7U6O-1 +<<< Could not download PDB/mmCIF file: 7U9N-1 +<<< Could not download PDB/mmCIF file: 7UDK-1 +<<< Could not download PDB/mmCIF file: 7UEQ-1 +<<< Could not download PDB/mmCIF file: 7UHZ-1 +<<< Could not download PDB/mmCIF file: 7UW2-1 +<<< Could not download PDB/mmCIF file: 7UYY-1 +<<< Could not download PDB/mmCIF file: 7V36-1 +<<< Could not download PDB/mmCIF file: 7VRH-1 +<<< Could not download PDB/mmCIF file: 7WNZ-1 +<<< Could not download PDB/mmCIF file: 7WRX-1 +<<< Could not download PDB/mmCIF file: 7WUK-1 +<<< Could not download PDB/mmCIF file: 7X4W-3 +<<< Could not download PDB/mmCIF file: 7XA9-1 +<<< Could not download PDB/mmCIF file: 7XFR-1 +<<< Could not download PDB/mmCIF file: 7XGW-1 +<<< Could not download PDB/mmCIF file: 7XI5-3 +<<< Could not download PDB/mmCIF file: 7XJN-4 +<<< Could not download PDB/mmCIF file: 7XPO-1 +<<< Could not download PDB/mmCIF file: 7XRI-2 +<<< Could not download PDB/mmCIF file: 7XYH-1 +<<< Could not download PDB/mmCIF file: 7XZK-2 +<<< Could not download PDB/mmCIF file: 7Y19-1 +<<< Could not download PDB/mmCIF file: 7Y4A-4 +<<< Could not download PDB/mmCIF file: 7Y6E-1 +<<< Could not download PDB/mmCIF file: 7Y8I-6 +<<< Could not download PDB/mmCIF file: 7YA8-2 +<<< Could not download PDB/mmCIF file: 7YF5-1 +<<< Could not download PDB/mmCIF file: 7YI9-1 +<<< Could not download PDB/mmCIF file: 7YJW-1 +<<< Could not download PDB/mmCIF file: 7YMP-8 +<<< Could not download PDB/mmCIF file: 7YTB-1 +<<< Could not download PDB/mmCIF file: 7YYX-1 +<<< Could not download PDB/mmCIF file: 7Z3U-1 +<<< Could not download PDB/mmCIF file: 7Z5N-8 +<<< Could not download PDB/mmCIF file: 7ZC7-2 +<<< Could not download PDB/mmCIF file: 7ZIZ-1 +<<< Could not download PDB/mmCIF file: 7ZON-2 +<<< Could not download PDB/mmCIF file: 7ZQI-1 +<<< Could not download PDB/mmCIF file: 7ZU4-2 +<<< Could not download PDB/mmCIF file: 8A1H-1 +<<< Could not download PDB/mmCIF file: 8A4J-1 +<<< Could not download PDB/mmCIF file: 8A7O-1 +<<< Could not download PDB/mmCIF file: 8ABT-1 +<<< Could not download PDB/mmCIF file: 8ADI-1 +<<< Could not download PDB/mmCIF file: 8AF9-7 +<<< Could not download PDB/mmCIF file: 8AIK-2 +<<< Could not download PDB/mmCIF file: 8AKL-1 +<<< Could not download PDB/mmCIF file: 8AR6-3 +<<< Could not download PDB/mmCIF file: 8AU6-1 +<<< Could not download PDB/mmCIF file: 8AVM-1 +<<< Could not download PDB/mmCIF file: 8AXT-2 +<<< Could not download PDB/mmCIF file: 8B07-1 +<<< Could not download PDB/mmCIF file: 8B2V-1 +<<< Could not download PDB/mmCIF file: 8BCQ-1 +<<< Could not download PDB/mmCIF file: 8BFT-1 +<<< Could not download PDB/mmCIF file: 8BIB-1 +<<< Could not download PDB/mmCIF file: 8BKD-5 +<<< Could not download PDB/mmCIF file: 8BOK-1 +<<< Could not download PDB/mmCIF file: 8BRQ-1 +<<< Could not download PDB/mmCIF file: 8BV2-1 +<<< Could not download 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+<<< Could not download PDB/mmCIF file: 8HP7-3 +<<< Could not download PDB/mmCIF file: 8I19-2 +<<< Could not download PDB/mmCIF file: 8I4C-1 +<<< Could not download PDB/mmCIF file: 8I8M-3 +<<< Could not download PDB/mmCIF file: 8IFJ-1 +<<< Could not download PDB/mmCIF file: 8IM8-1 +<<< Could not download PDB/mmCIF file: 8IW9-1 +<<< Could not download PDB/mmCIF file: 8JLZ-1 +<<< Could not download PDB/mmCIF file: 8OJ9-1 +<<< Could not download PDB/mmCIF file: 8OSP-2 +<<< Could not download PDB/mmCIF file: 8P0S-1 +<<< Could not download PDB/mmCIF file: 8PFD-1 +<<< Could not download PDB/mmCIF file: 8SER-1 +<<< Could not download PDB/mmCIF file: 8SNJ-1 +<<< Could not download PDB/mmCIF file: 8TE6-1 +<<< Could not download PDB/mmCIF file: 7W62-1 +<<< Could not download PDB/mmCIF file: 7WWC-1 +<<< Could not download PDB/mmCIF file: 7XBG-2 +<<< Could not download PDB/mmCIF file: 7XXV-1 +<<< Could not download PDB/mmCIF file: 8AA3-1 +<<< Could not download PDB/mmCIF file: 8B48-2 +<<< Could not download PDB/mmCIF file: 8CTS-1 +<<< Could not download PDB/mmCIF file: 8DM4-1 +<<< Could not download PDB/mmCIF file: 8EPN-1 +<<< Could not download PDB/mmCIF file: 8FR9-1 +<<< Could not download PDB/mmCIF file: 8GJM-1 +<<< Could not download PDB/mmCIF file: 8J4F-1 +<<< Could not download PDB/mmCIF file: 7AVW-1 +<<< Could not download PDB/mmCIF file: 7FS5-2 +<<< Could not download PDB/mmCIF file: 7FSN-4 +<<< Could not download PDB/mmCIF file: 7FT0-2 +<<< Could not download PDB/mmCIF file: 7FTC-4 +<<< Could not download PDB/mmCIF file: 7FW3-1 +<<< Could not download PDB/mmCIF file: 7FXE-1 +<<< Could not download PDB/mmCIF file: 7FYJ-1 +<<< Could not download PDB/mmCIF file: 7FZS-1 +<<< Could not download PDB/mmCIF file: 7G0Q-1 +<<< Could not download PDB/mmCIF file: 7G20-1 +<<< Could not download PDB/mmCIF file: 7G9C-1 +<<< Could not download PDB/mmCIF file: 7QH9-4 +<<< Could not download PDB/mmCIF file: 7QPS-1 +<<< Could not download PDB/mmCIF file: 7QRB-2 +<<< Could not download 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file: 7XC1-1 +<<< Could not download PDB/mmCIF file: 7XFS-1 +<<< Could not download PDB/mmCIF file: 7XGW-2 +<<< Could not download PDB/mmCIF file: 7XI5-4 +<<< Could not download PDB/mmCIF file: 7XL5-1 +<<< Could not download PDB/mmCIF file: 7XPP-1 +<<< Could not download PDB/mmCIF file: 7XRJ-1 +<<< Could not download PDB/mmCIF file: 7XWT-1 +<<< Could not download PDB/mmCIF file: 7XYH-2 +<<< Could not download PDB/mmCIF file: 7XZN-1 +<<< Could not download PDB/mmCIF file: 7Y1B-1 +<<< Could not download PDB/mmCIF file: 7Y4B-1 +<<< Could not download PDB/mmCIF file: 7Y6E-2 +<<< Could not download PDB/mmCIF file: 7Y8J-1 +<<< Could not download PDB/mmCIF file: 7YA9-1 +<<< Could not download PDB/mmCIF file: 7YIA-1 +<<< Could not download PDB/mmCIF file: 7YK2-1 +<<< Could not download PDB/mmCIF file: 7YMQ-1 +<<< Could not download PDB/mmCIF file: 7YPM-1 +<<< Could not download PDB/mmCIF file: 7YTE-1 +<<< Could not download PDB/mmCIF file: 7YYY-1 +<<< Could not download PDB/mmCIF file: 7ZC7-3 +<<< Could not download PDB/mmCIF file: 7ZJ0-1 +<<< Could not download PDB/mmCIF file: 7ZMX-1 +<<< Could not download PDB/mmCIF file: 7ZOO-1 +<<< Could not download PDB/mmCIF file: 7ZQJ-1 +<<< Could not download PDB/mmCIF file: 7ZU6-1 +<<< Could not download PDB/mmCIF file: 7ZXL-1 +<<< Could not download PDB/mmCIF file: 8A1I-1 +<<< Could not download PDB/mmCIF file: 8A4K-1 +<<< Could not download PDB/mmCIF file: 8A7P-1 +<<< Could not download PDB/mmCIF file: 8ABT-2 +<<< Could not download PDB/mmCIF file: 8ADJ-1 +<<< Could not download PDB/mmCIF file: 8AFA-1 +<<< Could not download PDB/mmCIF file: 8AIL-1 +<<< Could not download PDB/mmCIF file: 8AKM-1 +<<< Could not download PDB/mmCIF file: 8AU8-1 +<<< Could not download PDB/mmCIF file: 8AVM-2 +<<< Could not download PDB/mmCIF file: 8B07-2 +<<< Could not download PDB/mmCIF file: 8B2W-1 +<<< Could not download PDB/mmCIF file: 8BCQ-2 +<<< Could not download PDB/mmCIF file: 8BFU-1 +<<< Could not download PDB/mmCIF file: 8BIB-2 +<<< Could not download PDB/mmCIF file: 8BKD-6 +<<< Could not download PDB/mmCIF file: 8BOM-1 +<<< Could not download PDB/mmCIF file: 8BRR-1 +<<< Could not download PDB/mmCIF file: 8BV4-1 +<<< Could not download PDB/mmCIF file: 8BZJ-2 +<<< Could not download PDB/mmCIF file: 8C4N-1 +<<< Could not download PDB/mmCIF file: 8C7W-1 +<<< Could not download PDB/mmCIF file: 8CCZ-1 +<<< Could not download PDB/mmCIF file: 8CH4-1 +<<< Could not download PDB/mmCIF file: 8CNY-1 +<<< Could not download PDB/mmCIF file: 8CUI-1 +<<< Could not download PDB/mmCIF file: 8CX9-1 +<<< Could not download PDB/mmCIF file: 8D5V-2 +<<< Could not download PDB/mmCIF file: 8D77-1 +<<< Could not download PDB/mmCIF file: 8D8P-1 +<<< Could not download PDB/mmCIF file: 8DJJ-1 +<<< Could not download PDB/mmCIF file: 8DMU-3 +<<< Could not download PDB/mmCIF file: 8DUK-2 +<<< Could not download PDB/mmCIF file: 8DXH-1 +<<< Could not download PDB/mmCIF file: 8E2W-1 +<<< Could not download PDB/mmCIF file: 8EGU-1 +<<< Could not download 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file: 8HBH-1 +<<< Could not download PDB/mmCIF file: 8HFK-1 +<<< Could not download PDB/mmCIF file: 8HKB-1 +<<< Could not download PDB/mmCIF file: 8HP8-1 +<<< Could not download PDB/mmCIF file: 8I1A-1 +<<< Could not download PDB/mmCIF file: 8I4I-1 +<<< Could not download PDB/mmCIF file: 8I8P-1 +<<< Could not download PDB/mmCIF file: 8IFJ-2 +<<< Could not download PDB/mmCIF file: 8IM8-2 +<<< Could not download PDB/mmCIF file: 8IWE-1 +<<< Could not download PDB/mmCIF file: 8JOJ-1 +<<< Could not download PDB/mmCIF file: 8OJ9-2 +<<< Could not download PDB/mmCIF file: 8OSX-1 +<<< Could not download PDB/mmCIF file: 8P34-1 +<<< Could not download PDB/mmCIF file: 8PI2-1 +<<< Could not download PDB/mmCIF file: 8SET-1 +<<< Could not download PDB/mmCIF file: 8SNJ-2 +<<< Could not download PDB/mmCIF file: 7UIA-1 +<<< Could not download PDB/mmCIF file: 7V0I-1 +<<< Could not download PDB/mmCIF file: 7W62-2 +<<< Could not download PDB/mmCIF file: 7WWI-1 +<<< Could not download PDB/mmCIF file: 7XXY-1 +<<< Could not download PDB/mmCIF file: 8AD2-1 +<<< Could not download PDB/mmCIF file: 8B48-3 +<<< Could not download PDB/mmCIF file: 8CTS-2 +<<< Could not download PDB/mmCIF file: 8DM5-1 +<<< Could not download PDB/mmCIF file: 8EPP-1 +<<< Could not download PDB/mmCIF file: 8FR9-2 +<<< Could not download PDB/mmCIF file: 8JJ5-1 +<<< Could not download PDB/mmCIF file: 7FS6-1 +<<< Could not download PDB/mmCIF file: 7FSO-1 +<<< Could not download PDB/mmCIF file: 7FT0-3 +<<< Could not download PDB/mmCIF file: 7FTD-1 +<<< Could not download PDB/mmCIF file: 7FW4-1 +<<< Could not download PDB/mmCIF file: 7FXF-1 +<<< Could not download PDB/mmCIF file: 7FYJ-2 +<<< Could not download PDB/mmCIF file: 7FZT-1 +<<< Could not download PDB/mmCIF file: 7G0R-1 +<<< Could not download PDB/mmCIF file: 7G21-1 +<<< Could not download PDB/mmCIF file: 7G9D-1 +<<< Could not download PDB/mmCIF file: 7QD7-1 +<<< Could not download PDB/mmCIF file: 7QPS-2 +<<< Could not download PDB/mmCIF file: 7QRB-3 +<<< Could not download PDB/mmCIF file: 7QWJ-1 +<<< Could not download PDB/mmCIF file: 7R2A-1 +<<< Could not download PDB/mmCIF file: 7R3A-1 +<<< Could not download PDB/mmCIF file: 7S3P-3 +<<< Could not download PDB/mmCIF file: 7TCV-1 +<<< Could not download PDB/mmCIF file: 7TEL-1 +<<< Could not download PDB/mmCIF file: 7THG-1 +<<< Could not download PDB/mmCIF file: 7TMC-1 +<<< Could not download PDB/mmCIF file: 7TXA-1 +<<< Could not download PDB/mmCIF file: 7TYU-1 +<<< Could not download PDB/mmCIF file: 7U2F-1 +<<< Could not download PDB/mmCIF file: 7UDM-1 +<<< Could not download PDB/mmCIF file: 7UES-1 +<<< Could not download PDB/mmCIF file: 7UG5-2 +<<< Could not download PDB/mmCIF file: 7UI1-1 +<<< Could not download PDB/mmCIF file: 7URV-1 +<<< Could not download PDB/mmCIF file: 7UU0-1 +<<< Could not download PDB/mmCIF file: 7UW3-2 +<<< Could not download PDB/mmCIF file: 7UZ1-2 +<<< Could not download PDB/mmCIF file: 7V1A-1 +<<< Could not download PDB/mmCIF file: 7VKU-1 +<<< Could not download 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file: 7Y6E-3 +<<< Could not download PDB/mmCIF file: 7Y8K-1 +<<< Could not download PDB/mmCIF file: 7YAC-1 +<<< Could not download PDB/mmCIF file: 7YD1-1 +<<< Could not download PDB/mmCIF file: 7YFJ-1 +<<< Could not download PDB/mmCIF file: 7YIB-1 +<<< Could not download PDB/mmCIF file: 7YK3-1 +<<< Could not download PDB/mmCIF file: 7YMQ-2 +<<< Could not download PDB/mmCIF file: 7YPM-2 +<<< Could not download PDB/mmCIF file: 7YTF-1 +<<< Could not download PDB/mmCIF file: 7YYZ-1 +<<< Could not download PDB/mmCIF file: 7Z3W-1 +<<< Could not download PDB/mmCIF file: 7Z94-1 +<<< Could not download PDB/mmCIF file: 7ZG8-1 +<<< Could not download PDB/mmCIF file: 7ZJ0-2 +<<< Could not download PDB/mmCIF file: 7ZMX-2 +<<< Could not download PDB/mmCIF file: 7ZOP-1 +<<< Could not download PDB/mmCIF file: 7ZVV-1 +<<< Could not download PDB/mmCIF file: 7ZXN-1 +<<< Could not download PDB/mmCIF file: 7ZZ7-1 +<<< Could not download PDB/mmCIF file: 8A1I-2 +<<< Could not download PDB/mmCIF file: 8A4M-1 +<<< Could not download PDB/mmCIF file: 8A7R-1 +<<< Could not download PDB/mmCIF file: 8ABU-1 +<<< Could not download PDB/mmCIF file: 8ADJ-2 +<<< Could not download PDB/mmCIF file: 8AIL-2 +<<< Could not download PDB/mmCIF file: 8AOK-1 +<<< Could not download PDB/mmCIF file: 8AU9-1 +<<< Could not download PDB/mmCIF file: 8AVM-3 +<<< Could not download PDB/mmCIF file: 8AY0-1 +<<< Could not download PDB/mmCIF file: 8B08-1 +<<< Could not download PDB/mmCIF file: 8B75-1 +<<< Could not download PDB/mmCIF file: 8BCQ-3 +<<< Could not download PDB/mmCIF file: 8BE1-1 +<<< Could not download PDB/mmCIF file: 8BFZ-1 +<<< Could not download PDB/mmCIF file: 8BIC-1 +<<< Could not download PDB/mmCIF file: 8BKD-7 +<<< Could not download PDB/mmCIF file: 8BOQ-1 +<<< Could not download PDB/mmCIF file: 8BRR-2 +<<< Could not download PDB/mmCIF file: 8BVB-1 +<<< Could not download PDB/mmCIF file: 8BZO-1 +<<< Could not download PDB/mmCIF file: 8C4N-2 +<<< Could not download PDB/mmCIF file: 8C7X-1 +<<< Could not download PDB/mmCIF file: 8CCZ-2 +<<< Could not download PDB/mmCIF file: 8CO2-1 +<<< Could not download PDB/mmCIF file: 8CUJ-1 +<<< Could not download PDB/mmCIF file: 8CX9-2 +<<< Could not download PDB/mmCIF file: 8D5W-1 +<<< Could not download PDB/mmCIF file: 8D7A-1 +<<< Could not download PDB/mmCIF file: 8DMU-4 +<<< Could not download PDB/mmCIF file: 8DXI-1 +<<< Could not download PDB/mmCIF file: 8E3G-1 +<<< Could not download PDB/mmCIF file: 8EE0-1 +<<< Could not download PDB/mmCIF file: 8EGV-1 +<<< Could not download PDB/mmCIF file: 8EN2-1 +<<< Could not download PDB/mmCIF file: 8EQ7-1 +<<< Could not download PDB/mmCIF file: 8EW9-1 +<<< Could not download PDB/mmCIF file: 8EYK-1 +<<< Could not download PDB/mmCIF file: 8F0Z-1 +<<< Could not download PDB/mmCIF file: 8F3R-1 +<<< Could not download PDB/mmCIF file: 8F6D-3 +<<< Could not download PDB/mmCIF file: 8FA1-1 +<<< Could not download PDB/mmCIF file: 8FCB-1 +<<< Could not download PDB/mmCIF file: 8FFU-1 +<<< Could not download 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file: 8JOL-1 +<<< Could not download PDB/mmCIF file: 8OJE-1 +<<< Could not download PDB/mmCIF file: 8OT0-1 +<<< Could not download PDB/mmCIF file: 8P3L-1 +<<< Could not download PDB/mmCIF file: 8PIF-1 +<<< Could not download PDB/mmCIF file: 8SEU-1 +<<< Could not download PDB/mmCIF file: 8SNJ-3 +<<< Could not download PDB/mmCIF file: 7UIB-1 +<<< Could not download PDB/mmCIF file: 7V0I-2 +<<< Could not download PDB/mmCIF file: 7WWJ-1 +<<< Could not download PDB/mmCIF file: 8AD2-2 +<<< Could not download PDB/mmCIF file: 8B48-4 +<<< Could not download PDB/mmCIF file: 8CTU-1 +<<< Could not download PDB/mmCIF file: 8DM7-1 +<<< Could not download PDB/mmCIF file: 8EPQ-1 +<<< Could not download PDB/mmCIF file: 8FRA-1 +<<< Could not download PDB/mmCIF file: 8GTO-1 +<<< Could not download PDB/mmCIF file: 8OG1-1 +<<< Could not download PDB/mmCIF file: 7FS6-2 +<<< Could not download PDB/mmCIF file: 7FSO-2 +<<< Could not download PDB/mmCIF file: 7FT0-4 +<<< Could not download PDB/mmCIF file: 7FTD-2 +<<< Could not download PDB/mmCIF file: 7FW5-1 +<<< Could not download PDB/mmCIF file: 7FXG-1 +<<< Could not download PDB/mmCIF file: 7FYK-1 +<<< Could not download PDB/mmCIF file: 7FZU-1 +<<< Could not download PDB/mmCIF file: 7G0S-1 +<<< Could not download PDB/mmCIF file: 7G80-1 +<<< Could not download PDB/mmCIF file: 7G9E-1 +<<< Could not download PDB/mmCIF file: 7N46-1 +<<< Could not download PDB/mmCIF file: 7QPV-1 +<<< Could not download PDB/mmCIF file: 7QRB-4 +<<< Could not download PDB/mmCIF file: 7R2A-2 +<<< Could not download PDB/mmCIF file: 7R3A-2 +<<< Could not download PDB/mmCIF file: 7RUJ-1 +<<< Could not download PDB/mmCIF file: 7S3P-4 +<<< Could not download PDB/mmCIF file: 7STF-1 +<<< Could not download PDB/mmCIF file: 7TLH-1 +<<< Could not download PDB/mmCIF file: 7TXA-2 +<<< Could not download PDB/mmCIF file: 7TYU-2 +<<< Could not download PDB/mmCIF file: 7UBS-1 +<<< Could not download PDB/mmCIF file: 7UDM-2 +<<< Could not download PDB/mmCIF file: 7UET-1 +<<< Could not download PDB/mmCIF file: 7UG5-3 +<<< Could not download PDB/mmCIF file: 7UI1-2 +<<< Could not download PDB/mmCIF file: 7ULB-1 +<<< Could not download PDB/mmCIF file: 7URX-1 +<<< Could not download PDB/mmCIF file: 7UU6-1 +<<< Could not download PDB/mmCIF file: 7UW3-3 +<<< Could not download PDB/mmCIF file: 7UZ2-1 +<<< Could not download PDB/mmCIF file: 7VRK-1 +<<< Could not download PDB/mmCIF file: 7W8B-1 +<<< Could not download PDB/mmCIF file: 7WKM-1 +<<< Could not download PDB/mmCIF file: 7WUN-1 +<<< Could not download PDB/mmCIF file: 7X4X-3 +<<< Could not download PDB/mmCIF file: 7X8P-1 +<<< Could not download PDB/mmCIF file: 7XAC-1 +<<< Could not download PDB/mmCIF file: 7XE6-1 +<<< Could not download PDB/mmCIF file: 7XFU-1 +<<< Could not download PDB/mmCIF file: 7XGW-4 +<<< Could not download PDB/mmCIF file: 7XL7-1 +<<< Could not download PDB/mmCIF file: 7XND-1 +<<< Could not download PDB/mmCIF file: 7XPR-1 +<<< Could not download PDB/mmCIF file: 7XRL-1 +<<< Could not download 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file: 7ZHN-1 +<<< Could not download PDB/mmCIF file: 7ZKX-1 +<<< Could not download PDB/mmCIF file: 7ZLY-1 +<<< Could not download PDB/mmCIF file: 7ZMY-1 +<<< Could not download PDB/mmCIF file: 7ZSL-1 +<<< Could not download PDB/mmCIF file: 7ZUA-1 +<<< Could not download PDB/mmCIF file: 7ZVW-1 +<<< Could not download PDB/mmCIF file: 8A1I-3 +<<< Could not download PDB/mmCIF file: 8A2V-1 +<<< Could not download PDB/mmCIF file: 8A4N-1 +<<< Could not download PDB/mmCIF file: 8A5R-1 +<<< Could not download PDB/mmCIF file: 8A7S-1 +<<< Could not download PDB/mmCIF file: 8ABV-1 +<<< Could not download PDB/mmCIF file: 8ADJ-3 +<<< Could not download PDB/mmCIF file: 8AGO-1 +<<< Could not download PDB/mmCIF file: 8AIM-1 +<<< Could not download PDB/mmCIF file: 8ALK-1 +<<< Could not download PDB/mmCIF file: 8AOM-1 +<<< Could not download PDB/mmCIF file: 8AR9-1 +<<< Could not download PDB/mmCIF file: 8AUA-1 +<<< Could not download PDB/mmCIF file: 8AVN-1 +<<< Could not download PDB/mmCIF file: 8AY0-2 +<<< Could not download PDB/mmCIF file: 8B3K-1 +<<< Could not download PDB/mmCIF file: 8B75-2 +<<< Could not download PDB/mmCIF file: 8BBL-1 +<<< Could not download PDB/mmCIF file: 8BCQ-4 +<<< Could not download PDB/mmCIF file: 8BE1-2 +<<< Could not download PDB/mmCIF file: 8BG9-1 +<<< Could not download PDB/mmCIF file: 8BID-1 +<<< Could not download PDB/mmCIF file: 8BKD-8 +<<< Could not download PDB/mmCIF file: 8BOR-1 +<<< Could not download PDB/mmCIF file: 8BRS-1 +<<< Could not download PDB/mmCIF file: 8BVD-1 +<<< Could not download PDB/mmCIF file: 8BZV-1 +<<< Could not download PDB/mmCIF file: 8C4O-1 +<<< Could not download PDB/mmCIF file: 8C7Y-1 +<<< Could not download PDB/mmCIF file: 8CD8-1 +<<< Could not download PDB/mmCIF file: 8CHX-1 +<<< Could not download PDB/mmCIF file: 8CO2-2 +<<< Could not download PDB/mmCIF file: 8CT0-1 +<<< Could not download PDB/mmCIF file: 8CX9-3 +<<< Could not download PDB/mmCIF file: 8D5X-1 +<<< Could not download PDB/mmCIF file: 8D7B-1 +<<< Could not download PDB/mmCIF file: 8D8W-1 +<<< Could not download PDB/mmCIF file: 8DHV-1 +<<< Could not download PDB/mmCIF file: 8DMX-1 +<<< Could not download PDB/mmCIF file: 8DXJ-1 +<<< Could not download PDB/mmCIF file: 8DZB-1 +<<< Could not download PDB/mmCIF file: 8E3G-2 +<<< Could not download PDB/mmCIF file: 8EE1-1 +<<< Could not download PDB/mmCIF file: 8EGV-2 +<<< Could not download PDB/mmCIF file: 8EN3-1 +<<< Could not download PDB/mmCIF file: 8EQ7-2 +<<< Could not download PDB/mmCIF file: 8ESD-1 +<<< Could not download PDB/mmCIF file: 8EYL-1 +<<< Could not download PDB/mmCIF file: 8F10-1 +<<< Could not download PDB/mmCIF file: 8F3S-1 +<<< Could not download PDB/mmCIF file: 8F6D-4 +<<< Could not download PDB/mmCIF file: 8FA2-1 +<<< Could not download PDB/mmCIF file: 8FCC-1 +<<< Could not download PDB/mmCIF file: 8FFU-2 +<<< Could not download PDB/mmCIF file: 8FK8-1 +<<< Could not download PDB/mmCIF file: 8FM8-2 +<<< Could not download PDB/mmCIF file: 8FQM-2 +<<< Could not download PDB/mmCIF file: 8FUQ-1 +<<< Could not download PDB/mmCIF file: 8FZB-2 +<<< Could not download PDB/mmCIF file: 8G39-1 +<<< Could not download PDB/mmCIF file: 8G7J-1 +<<< Could not download PDB/mmCIF file: 8GDS-4 +<<< Could not download PDB/mmCIF file: 8GJV-2 +<<< Could not download PDB/mmCIF file: 8GOA-1 +<<< Could not download PDB/mmCIF file: 8H70-1 +<<< Could not download PDB/mmCIF file: 8HBR-1 +<<< Could not download PDB/mmCIF file: 8HKG-2 +<<< Could not download PDB/mmCIF file: 8HP8-3 +<<< Could not download PDB/mmCIF file: 8I5A-1 +<<< Could not download PDB/mmCIF file: 8I8S-2 +<<< Could not download PDB/mmCIF file: 8IFJ-4 +<<< Could not download PDB/mmCIF file: 8IM8-4 +<<< Could not download PDB/mmCIF file: 8IWL-1 +<<< Could not download PDB/mmCIF file: 8JPA-1 +<<< Could not download PDB/mmCIF file: 8OJE-2 +<<< Could not download PDB/mmCIF file: 8OTB-1 +<<< Could not download PDB/mmCIF file: 8P3L-2 +<<< Could not download PDB/mmCIF file: 8PIF-2 +<<< Could not download PDB/mmCIF file: 8SEV-1 +<<< Could not download PDB/mmCIF file: 8SOY-1 +<<< Could not download PDB/mmCIF file: 7V0I-3 +<<< Could not download PDB/mmCIF file: 8AD2-3 +<<< Could not download PDB/mmCIF file: 8CTU-2 +<<< Could not download PDB/mmCIF file: 8DM9-1 +<<< Could not download PDB/mmCIF file: 8EQX-1 +<<< Could not download PDB/mmCIF file: 8FRA-2 +<<< Could not download PDB/mmCIF file: 8GTP-1 +<<< Could not download PDB/mmCIF file: 8OG4-1 +<<< Could not download PDB/mmCIF file: 7FS7-1 +<<< Could not download PDB/mmCIF file: 7FSO-3 +<<< Could not download PDB/mmCIF file: 7FT1-1 +<<< Could not download PDB/mmCIF file: 7FTD-3 +<<< Could not download PDB/mmCIF file: 7FW6-1 +<<< Could not download PDB/mmCIF file: 7FXH-1 +<<< Could not download PDB/mmCIF file: 7FYL-1 +<<< Could not download PDB/mmCIF file: 7FZV-1 +<<< Could not download PDB/mmCIF file: 7G0T-1 +<<< Could not download PDB/mmCIF file: 7G81-1 +<<< Could not download PDB/mmCIF file: 7G9F-1 +<<< Could not download PDB/mmCIF file: 7QPV-2 +<<< Could not download PDB/mmCIF file: 7R3A-3 +<<< Could not download PDB/mmCIF file: 7RUK-1 +<<< Could not download PDB/mmCIF file: 7S3P-5 +<<< Could not download PDB/mmCIF file: 7TBN-1 +<<< Could not download PDB/mmCIF file: 7TEU-1 +<<< Could not download PDB/mmCIF file: 7TLH-2 +<<< Could not download PDB/mmCIF file: 7TXE-1 +<<< Could not download PDB/mmCIF file: 7UBS-2 +<<< Could not download PDB/mmCIF file: 7UDM-3 +<<< Could not download PDB/mmCIF file: 7UEU-1 +<<< Could not download PDB/mmCIF file: 7UG5-4 +<<< Could not download PDB/mmCIF file: 7UI1-3 +<<< Could not download PDB/mmCIF file: 7ULB-2 +<<< Could not download PDB/mmCIF file: 7UM8-1 +<<< Could not download PDB/mmCIF file: 7UU7-1 +<<< Could not download PDB/mmCIF file: 7UW3-4 +<<< Could not download PDB/mmCIF file: 7UZ2-2 +<<< Could not download PDB/mmCIF file: 7VRK-2 +<<< Could not download PDB/mmCIF file: 7WGE-1 +<<< Could not download PDB/mmCIF file: 7WKO-1 +<<< Could not download PDB/mmCIF file: 7X4Y-1 +<<< Could not download PDB/mmCIF file: 7X8P-2 +<<< Could not download PDB/mmCIF file: 7XAD-1 +<<< Could not download PDB/mmCIF file: 7XE7-1 +<<< Could not download PDB/mmCIF file: 7XGW-5 +<<< Could not download PDB/mmCIF file: 7XJR-1 +<<< Could not download PDB/mmCIF file: 7XPS-1 +<<< Could not download PDB/mmCIF file: 7XRO-1 +<<< Could not download PDB/mmCIF file: 7XVI-1 +<<< Could not download PDB/mmCIF file: 7XWV-1 +<<< Could not download PDB/mmCIF file: 7XYJ-2 +<<< Could not download PDB/mmCIF file: 7XZO-2 +<<< Could not download PDB/mmCIF file: 7Y4D-1 +<<< Could not download PDB/mmCIF file: 7Y6E-5 +<<< Could not download PDB/mmCIF file: 7Y8L-2 +<<< Could not download PDB/mmCIF file: 7YAG-1 +<<< Could not download PDB/mmCIF file: 7YD3-2 +<<< Could not download PDB/mmCIF file: 7YFT-1 +<<< Could not download PDB/mmCIF file: 7YID-1 +<<< Could not download PDB/mmCIF file: 7YK6-1 +<<< Could not download PDB/mmCIF file: 7YMQ-4 +<<< Could not download PDB/mmCIF file: 7YPU-1 +<<< Could not download PDB/mmCIF file: 7YTJ-1 +<<< Could not download PDB/mmCIF file: 7YZ1-1 +<<< Could not download PDB/mmCIF file: 7Z3Y-2 +<<< Could not download PDB/mmCIF file: 7Z5R-1 +<<< Could not download PDB/mmCIF file: 7Z98-1 +<<< Could not download PDB/mmCIF file: 7ZCC-1 +<<< Could not download PDB/mmCIF file: 7ZG9-1 +<<< Could not download PDB/mmCIF file: 7ZHO-1 +<<< Could not download PDB/mmCIF file: 7ZLZ-1 +<<< Could not download PDB/mmCIF file: 7ZQR-1 +<<< Could not download PDB/mmCIF file: 7ZSL-2 +<<< Could not download PDB/mmCIF file: 7ZZ9-1 +<<< Could not download PDB/mmCIF file: 8A1J-1 +<<< Could not download PDB/mmCIF file: 8A2W-1 +<<< Could not download PDB/mmCIF file: 8A4O-1 +<<< Could not download PDB/mmCIF file: 8A5S-1 +<<< Could not download PDB/mmCIF file: 8A7T-1 +<<< Could not download PDB/mmCIF file: 8A9N-1 +<<< Could not download PDB/mmCIF file: 8ABW-1 +<<< Could not download PDB/mmCIF file: 8ADK-1 +<<< Could not download PDB/mmCIF file: 8AGR-1 +<<< Could not download PDB/mmCIF file: 8AIM-2 +<<< Could not download PDB/mmCIF file: 8AOO-1 +<<< Could not download PDB/mmCIF file: 8ARA-1 +<<< Could not download PDB/mmCIF file: 8AUA-2 +<<< Could not download PDB/mmCIF file: 8AVP-1 +<<< Could not download PDB/mmCIF file: 8AY0-3 +<<< Could not download PDB/mmCIF file: 8B78-1 +<<< Could not download PDB/mmCIF file: 8BBL-2 +<<< Could not download PDB/mmCIF file: 8BCQ-5 +<<< Could not download PDB/mmCIF file: 8BE6-1 +<<< Could not download PDB/mmCIF file: 8BID-2 +<<< Could not download PDB/mmCIF file: 8BKF-1 +<<< Could not download PDB/mmCIF file: 8BOR-2 +<<< Could not download PDB/mmCIF file: 8BRT-1 +<<< Could not download PDB/mmCIF file: 8BVD-2 +<<< Could not download PDB/mmCIF file: 8BZX-1 +<<< Could not download PDB/mmCIF file: 8C4O-2 +<<< Could not download PDB/mmCIF file: 8C7Z-1 +<<< Could not download PDB/mmCIF file: 8CD8-2 +<<< Could not download PDB/mmCIF file: 8CI0-1 +<<< Could not download PDB/mmCIF file: 8COB-1 +<<< Could not download PDB/mmCIF file: 8CT0-2 +<<< Could not download PDB/mmCIF file: 8CX9-4 +<<< Could not download PDB/mmCIF file: 8D5Z-1 +<<< Could not download PDB/mmCIF file: 8D7C-1 +<<< Could not download PDB/mmCIF file: 8D8W-2 +<<< Could not download PDB/mmCIF file: 8DHW-1 +<<< Could not download PDB/mmCIF file: 8DJQ-1 +<<< Could not download PDB/mmCIF file: 8DMY-1 +<<< Could not download PDB/mmCIF file: 8DSU-1 +<<< Could not download PDB/mmCIF file: 8DXK-1 +<<< Could not download PDB/mmCIF file: 8DZC-1 +<<< Could not download PDB/mmCIF file: 8E3J-1 +<<< Could not download PDB/mmCIF file: 8EEF-1 +<<< Could not download PDB/mmCIF file: 8EN4-1 +<<< Could not download PDB/mmCIF file: 8EQ8-1 +<<< Could not download PDB/mmCIF file: 8ESE-1 +<<< Could not download PDB/mmCIF file: 8EWD-1 +<<< Could not download PDB/mmCIF file: 8EYM-1 +<<< Could not download PDB/mmCIF file: 8F11-1 +<<< Could not download PDB/mmCIF file: 8F3T-1 +<<< Could not download PDB/mmCIF file: 8F6K-1 +<<< Could not download PDB/mmCIF file: 8FCD-1 +<<< Could not download PDB/mmCIF file: 8FFX-1 +<<< Could not download PDB/mmCIF file: 8FKB-1 +<<< Could not download PDB/mmCIF file: 8FM8-3 +<<< Could not download PDB/mmCIF file: 8FQM-3 +<<< Could not download PDB/mmCIF file: 8FUQ-2 +<<< Could not download PDB/mmCIF file: 8FZB-3 +<<< Could not download PDB/mmCIF file: 8G3A-1 +<<< Could not download PDB/mmCIF file: 8G7M-1 +<<< Could not download PDB/mmCIF file: 8GJV-3 +<<< Could not download PDB/mmCIF file: 8GOB-1 +<<< Could not download PDB/mmCIF file: 8GXP-1 +<<< Could not download PDB/mmCIF file: 8H77-1 +<<< Could not download PDB/mmCIF file: 8HBR-2 +<<< Could not download PDB/mmCIF file: 8HKJ-1 +<<< Could not download PDB/mmCIF file: 8HPJ-1 +<<< Could not download PDB/mmCIF file: 8I1C-1 +<<< Could not download PDB/mmCIF file: 8I5F-1 +<<< Could not download PDB/mmCIF file: 8I8T-1 +<<< Could not download PDB/mmCIF file: 8IFJ-5 +<<< Could not download PDB/mmCIF file: 8IN9-1 +<<< Could not download PDB/mmCIF file: 8IWM-1 +<<< Could not download PDB/mmCIF file: 8JTL-1 +<<< Could not download PDB/mmCIF file: 8OJF-1 +<<< Could not download PDB/mmCIF file: 8OTO-1 +<<< Could not download PDB/mmCIF file: 8P3M-1 +<<< Could not download PDB/mmCIF file: 8PII-1 +<<< Could not download PDB/mmCIF file: 8SEW-1 +<<< Could not download PDB/mmCIF file: 8SPJ-1 +<<< Could not download PDB/mmCIF file: 7V0J-1 +<<< Could not download PDB/mmCIF file: 8AD2-4 +<<< Could not download PDB/mmCIF file: 8B8F-1 +<<< Could not download PDB/mmCIF file: 8DMI-1 +<<< Could not download PDB/mmCIF file: 8EQX-2 +<<< Could not download PDB/mmCIF file: 8FRA-3 +<<< Could not download PDB/mmCIF file: 8GTQ-1 +<<< Could not download PDB/mmCIF file: 8OWF-1 +<<< Could not download PDB/mmCIF file: 7FS7-2 +<<< Could not download PDB/mmCIF file: 7FSO-4 +<<< Could not download PDB/mmCIF file: 7FT1-2 +<<< Could not download PDB/mmCIF file: 7FTD-4 +<<< Could not download PDB/mmCIF file: 7FW7-1 +<<< Could not download PDB/mmCIF file: 7FXI-1 +<<< Could not download PDB/mmCIF file: 7FYM-1 +<<< Could not download PDB/mmCIF file: 7FZV-2 +<<< Could not download PDB/mmCIF file: 7G0U-1 +<<< Could not download PDB/mmCIF file: 7G82-1 +<<< Could not download PDB/mmCIF file: 7G9G-1 +<<< Could not download PDB/mmCIF file: 7N96-1 +<<< Could not download PDB/mmCIF file: 7R2C-1 +<<< Could not download PDB/mmCIF file: 7R3A-4 +<<< Could not download PDB/mmCIF file: 7S3P-6 +<<< Could not download PDB/mmCIF file: 7TBN-2 +<<< Could not download PDB/mmCIF file: 7TLH-3 +<<< Could not download PDB/mmCIF file: 7TME-1 +<<< Could not download PDB/mmCIF file: 7TQM-1 +<<< Could not download PDB/mmCIF file: 7TV2-1 +<<< Could not download PDB/mmCIF file: 7TXF-1 +<<< Could not download PDB/mmCIF file: 7UBT-1 +<<< Could not download PDB/mmCIF file: 7UDN-1 +<<< Could not download PDB/mmCIF file: 7UEV-1 +<<< Could not download PDB/mmCIF file: 7UG8-1 +<<< Could not download PDB/mmCIF file: 7UI1-4 +<<< Could not download PDB/mmCIF file: 7ULB-3 +<<< Could not download PDB/mmCIF file: 7UM9-1 +<<< Could not download PDB/mmCIF file: 7US2-1 +<<< Could not download PDB/mmCIF file: 7UU8-1 +<<< Could not download PDB/mmCIF file: 7UW4-1 +<<< Could not download PDB/mmCIF file: 7VRM-1 +<<< Could not download PDB/mmCIF file: 7VWD-1 +<<< Could not download PDB/mmCIF file: 7WQI-1 +<<< Could not download PDB/mmCIF file: 7WUP-1 +<<< Could not download PDB/mmCIF file: 7X4Z-1 +<<< Could not download PDB/mmCIF file: 7X8Q-1 +<<< Could not download PDB/mmCIF file: 7XAD-2 +<<< Could not download PDB/mmCIF file: 7XGW-6 +<<< Could not download PDB/mmCIF file: 7XLB-1 +<<< Could not download PDB/mmCIF file: 7XNF-1 +<<< Could not download PDB/mmCIF file: 7XPT-1 +<<< Could not download PDB/mmCIF file: 7XRQ-1 +<<< Could not download PDB/mmCIF file: 7XTO-1 +<<< Could not download PDB/mmCIF file: 7XVJ-1 +<<< Could not download PDB/mmCIF file: 7XWW-1 +<<< Could not download PDB/mmCIF file: 7XYK-1 +<<< Could not download PDB/mmCIF file: 7XZP-1 +<<< Could not download PDB/mmCIF file: 7Y4D-2 +<<< Could 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+<<< Could not download PDB/mmCIF file: 8EK4-1 +<<< Could not download PDB/mmCIF file: 8EN5-1 +<<< Could not download PDB/mmCIF file: 8ESH-1 +<<< Could not download PDB/mmCIF file: 8EWE-1 +<<< Could not download PDB/mmCIF file: 8EYN-1 +<<< Could not download PDB/mmCIF file: 8F12-1 +<<< Could not download PDB/mmCIF file: 8F3U-1 +<<< Could not download PDB/mmCIF file: 8F6L-1 +<<< Could not download PDB/mmCIF file: 8FCE-1 +<<< Could not download PDB/mmCIF file: 8FG0-1 +<<< Could not download PDB/mmCIF file: 8FKL-1 +<<< Could not download PDB/mmCIF file: 8FM8-4 +<<< Could not download PDB/mmCIF file: 8FQM-4 +<<< Could not download PDB/mmCIF file: 8FUQ-3 +<<< Could not download PDB/mmCIF file: 8FZK-1 +<<< Could not download PDB/mmCIF file: 8G3B-1 +<<< Could not download PDB/mmCIF file: 8G7W-1 +<<< Could not download PDB/mmCIF file: 8GEZ-1 +<<< Could not download PDB/mmCIF file: 8GJV-4 +<<< Could not download PDB/mmCIF file: 8GOD-1 +<<< Could not download PDB/mmCIF file: 8GUE-1 +<<< Could 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+<<< Could not download PDB/mmCIF file: 7XVJ-2 +<<< Could not download PDB/mmCIF file: 7XWW-2 +<<< Could not download PDB/mmCIF file: 7XYK-2 +<<< Could not download PDB/mmCIF file: 7Y1H-1 +<<< Could not download PDB/mmCIF file: 7Y4E-1 +<<< Could not download PDB/mmCIF file: 7Y6E-7 +<<< Could not download PDB/mmCIF file: 7Y8M-1 +<<< Could not download PDB/mmCIF file: 7YAI-1 +<<< Could not download PDB/mmCIF file: 7YD3-4 +<<< Could not download PDB/mmCIF file: 7YFU-1 +<<< Could not download PDB/mmCIF file: 7YIF-1 +<<< Could not download PDB/mmCIF file: 7YK9-1 +<<< Could not download PDB/mmCIF file: 7YMQ-6 +<<< Could not download PDB/mmCIF file: 7YPU-3 +<<< Could not download PDB/mmCIF file: 7YWP-1 +<<< Could not download PDB/mmCIF file: 7YZ3-1 +<<< Could not download PDB/mmCIF file: 7Z0J-1 +<<< Could not download PDB/mmCIF file: 7Z2K-1 +<<< Could not download PDB/mmCIF file: 7Z41-1 +<<< Could not download PDB/mmCIF file: 7Z5R-3 +<<< Could not download PDB/mmCIF file: 7Z9A-1 +<<< Could 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+<<< Could not download PDB/mmCIF file: 8G7W-2 +<<< Could not download PDB/mmCIF file: 8GF0-1 +<<< Could not download PDB/mmCIF file: 8GJW-1 +<<< Could not download PDB/mmCIF file: 8GRE-1 +<<< Could not download PDB/mmCIF file: 8GUE-2 +<<< Could not download PDB/mmCIF file: 8GY7-1 +<<< Could not download PDB/mmCIF file: 8H2J-2 +<<< Could not download PDB/mmCIF file: 8H78-2 +<<< Could not download PDB/mmCIF file: 8HBR-4 +<<< Could not download PDB/mmCIF file: 8HFW-1 +<<< Could not download PDB/mmCIF file: 8HKJ-11 +<<< Could not download PDB/mmCIF file: 8HPK-1 +<<< Could not download PDB/mmCIF file: 8I1D-1 +<<< Could not download PDB/mmCIF file: 8I5H-2 +<<< Could not download PDB/mmCIF file: 8I8Y-1 +<<< Could not download PDB/mmCIF file: 8IG0-2 +<<< Could not download PDB/mmCIF file: 8INH-2 +<<< Could not download PDB/mmCIF file: 8IYI-1 +<<< Could not download PDB/mmCIF file: 8OJS-2 +<<< Could not download PDB/mmCIF file: 8OU0-1 +<<< Could not download PDB/mmCIF file: 8P3M-3 +<<< Could 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+<<< Could not download PDB/mmCIF file: 7YXT-1 +<<< Could not download PDB/mmCIF file: 7YZ5-1 +<<< Could not download PDB/mmCIF file: 7Z0J-2 +<<< Could not download PDB/mmCIF file: 7Z2K-2 +<<< Could not download PDB/mmCIF file: 7Z9B-1 +<<< Could not download PDB/mmCIF file: 7ZCG-1 +<<< Could not download PDB/mmCIF file: 7ZGB-1 +<<< Could not download PDB/mmCIF file: 7ZJD-1 +<<< Could not download PDB/mmCIF file: 7ZL3-1 +<<< Could not download PDB/mmCIF file: 7ZN8-1 +<<< Could not download PDB/mmCIF file: 7ZQT-1 +<<< Could not download PDB/mmCIF file: 7ZSO-1 +<<< Could not download PDB/mmCIF file: 7ZUG-1 +<<< Could not download PDB/mmCIF file: 7ZXV-1 +<<< Could not download PDB/mmCIF file: 7ZZC-1 +<<< Could not download PDB/mmCIF file: 8A1K-2 +<<< Could not download PDB/mmCIF file: 8A5V-2 +<<< Could not download PDB/mmCIF file: 8A7X-2 +<<< Could not download PDB/mmCIF file: 8A9Q-1 +<<< Could not download PDB/mmCIF file: 8AC7-2 +<<< Could not download PDB/mmCIF file: 8ADM-1 +<<< Could not download PDB/mmCIF file: 8AH1-1 +<<< Could not download PDB/mmCIF file: 8AOP-3 +<<< Could not download PDB/mmCIF file: 8ARB-2 +<<< Could not download PDB/mmCIF file: 8AUC-1 +<<< Could not download PDB/mmCIF file: 8AVP-3 +<<< Could not download PDB/mmCIF file: 8AY6-1 +<<< Could not download PDB/mmCIF file: 8B0H-1 +<<< Could not download PDB/mmCIF file: 8B99-1 +<<< Could not download PDB/mmCIF file: 8BBL-5 +<<< Could not download PDB/mmCIF file: 8BCS-1 +<<< Could not download PDB/mmCIF file: 8BE9-1 +<<< Could not download PDB/mmCIF file: 8BGJ-2 +<<< Could not download PDB/mmCIF file: 8BIF-2 +<<< Could not download PDB/mmCIF file: 8BLL-3 +<<< Could not download PDB/mmCIF file: 8BP9-1 +<<< Could not download PDB/mmCIF file: 8BS7-2 +<<< Could not download PDB/mmCIF file: 8BVE-1 +<<< Could not download PDB/mmCIF file: 8C4Q-1 +<<< Could not download PDB/mmCIF file: 8C9J-1 +<<< Could not download PDB/mmCIF file: 8CDA-3 +<<< Could not download PDB/mmCIF file: 8CIC-1 +<<< Could not download 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+<<< Could not download PDB/mmCIF file: 8P3M-4 +<<< Could not download PDB/mmCIF file: 8SF0-1 +<<< Could not download PDB/mmCIF file: 8SSX-1 +<<< Could not download PDB/mmCIF file: 7XE4-1 +<<< Could not download PDB/mmCIF file: 7Y1Y-1 +<<< Could not download PDB/mmCIF file: 7Z1I-2 +<<< Could not download PDB/mmCIF file: 7ZN6-1 +<<< Could not download PDB/mmCIF file: 8DU5-1 +<<< Could not download PDB/mmCIF file: 8ESK-1 +<<< Could not download PDB/mmCIF file: 8FRB-2 +<<< Could not download PDB/mmCIF file: 8GZ2-1 +<<< Could not download PDB/mmCIF file: 8PC3-1 +<<< Could not download PDB/mmCIF file: 7FS9-1 +<<< Could not download PDB/mmCIF file: 7FSP-3 +<<< Could not download PDB/mmCIF file: 7FT2-1 +<<< Could not download PDB/mmCIF file: 7FUU-1 +<<< Could not download PDB/mmCIF file: 7FWA-1 +<<< Could not download PDB/mmCIF file: 7FXL-1 +<<< Could not download PDB/mmCIF file: 7FYQ-1 +<<< Could not download PDB/mmCIF file: 7FZY-1 +<<< Could not download PDB/mmCIF file: 7G0W-2 +<<< Could not download PDB/mmCIF file: 7G85-1 +<<< Could not download PDB/mmCIF file: 7G9J-1 +<<< Could not download PDB/mmCIF file: 7P8G-1 +<<< Could not download PDB/mmCIF file: 7QOT-1 +<<< Could not download PDB/mmCIF file: 7QSC-1 +<<< Could not download PDB/mmCIF file: 7QTZ-2 +<<< Could not download PDB/mmCIF file: 7QVJ-2 +<<< Could not download PDB/mmCIF file: 7REY-1 +<<< Could not download PDB/mmCIF file: 7RXY-1 +<<< Could not download PDB/mmCIF file: 7S3P-9 +<<< Could not download PDB/mmCIF file: 7SZB-1 +<<< Could not download PDB/mmCIF file: 7TCY-2 +<<< Could not download PDB/mmCIF file: 7TLJ-1 +<<< Could not download PDB/mmCIF file: 7TVB-1 +<<< Could not download PDB/mmCIF file: 7U5W-1 +<<< Could not download PDB/mmCIF file: 7U70-1 +<<< Could not download PDB/mmCIF file: 7UDP-1 +<<< Could not download PDB/mmCIF file: 7UGD-1 +<<< Could not download PDB/mmCIF file: 7UI2-2 +<<< Could not download PDB/mmCIF file: 7UUB-1 +<<< Could not download PDB/mmCIF file: 7VRQ-1 +<<< Could not download 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file: 7YKD-1 +<<< Could not download PDB/mmCIF file: 7YMQ-8 +<<< Could not download PDB/mmCIF file: 7YPV-1 +<<< Could not download PDB/mmCIF file: 7YWT-1 +<<< Could not download PDB/mmCIF file: 7YXT-2 +<<< Could not download PDB/mmCIF file: 7YZ6-1 +<<< Could not download PDB/mmCIF file: 7Z0K-1 +<<< Could not download PDB/mmCIF file: 7Z2L-1 +<<< Could not download PDB/mmCIF file: 7Z7C-1 +<<< Could not download PDB/mmCIF file: 7Z9B-2 +<<< Could not download PDB/mmCIF file: 7ZCJ-1 +<<< Could not download PDB/mmCIF file: 7ZGC-1 +<<< Could not download PDB/mmCIF file: 7ZJE-1 +<<< Could not download PDB/mmCIF file: 7ZN9-1 +<<< Could not download PDB/mmCIF file: 7ZQT-2 +<<< Could not download PDB/mmCIF file: 7ZSP-1 +<<< Could not download PDB/mmCIF file: 7ZVZ-1 +<<< Could not download PDB/mmCIF file: 7ZXX-1 +<<< Could not download PDB/mmCIF file: 7ZZD-1 +<<< Could not download PDB/mmCIF file: 8A1L-1 +<<< Could not download PDB/mmCIF file: 8A30-1 +<<< Could not download PDB/mmCIF file: 8A4U-1 +<<< Could not download PDB/mmCIF file: 8A5V-3 +<<< Could not download PDB/mmCIF file: 8A82-1 +<<< Could not download PDB/mmCIF file: 8A9Q-2 +<<< Could not download PDB/mmCIF file: 8AC9-1 +<<< Could not download PDB/mmCIF file: 8AH1-2 +<<< Could not download PDB/mmCIF file: 8AIR-1 +<<< Could not download PDB/mmCIF file: 8ALZ-1 +<<< Could not download PDB/mmCIF file: 8AOQ-1 +<<< Could not download PDB/mmCIF file: 8ARB-3 +<<< Could not download PDB/mmCIF file: 8AUC-2 +<<< Could not download PDB/mmCIF file: 8AVP-4 +<<< Could not download PDB/mmCIF file: 8AY7-1 +<<< Could not download PDB/mmCIF file: 8B0K-1 +<<< Could not download PDB/mmCIF file: 8B9E-1 +<<< Could not download PDB/mmCIF file: 8BBL-6 +<<< Could not download PDB/mmCIF file: 8BCT-1 +<<< Could not download PDB/mmCIF file: 8BEA-1 +<<< Could not download PDB/mmCIF file: 8BGJ-3 +<<< Could not download PDB/mmCIF file: 8BIG-1 +<<< Could not download PDB/mmCIF file: 8BLL-4 +<<< Could not download PDB/mmCIF file: 8BPB-1 +<<< Could not download PDB/mmCIF file: 8BS8-1 +<<< Could not download PDB/mmCIF file: 8BVF-1 +<<< Could not download PDB/mmCIF file: 8C0I-1 +<<< Could not download PDB/mmCIF file: 8C4Q-2 +<<< Could not download PDB/mmCIF file: 8C9J-2 +<<< Could not download PDB/mmCIF file: 8CDA-4 +<<< Could not download PDB/mmCIF file: 8CIE-1 +<<< Could not download PDB/mmCIF file: 8CP2-1 +<<< Could not download PDB/mmCIF file: 8CUO-1 +<<< Could not download PDB/mmCIF file: 8D02-1 +<<< Could not download PDB/mmCIF file: 8D8Z-1 +<<< Could not download PDB/mmCIF file: 8DCN-2 +<<< Could not download PDB/mmCIF file: 8DJT-1 +<<< Could not download PDB/mmCIF file: 8DN6-1 +<<< Could not download PDB/mmCIF file: 8DXU-1 +<<< Could not download PDB/mmCIF file: 8E3P-2 +<<< Could not download PDB/mmCIF file: 8EEH-1 +<<< Could not download PDB/mmCIF file: 8EQH-1 +<<< Could not download PDB/mmCIF file: 8ESX-1 +<<< Could not download PDB/mmCIF file: 8EWI-1 +<<< Could not download PDB/mmCIF file: 8F15-1 +<<< Could not download 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file: 8HS2-1 +<<< Could not download PDB/mmCIF file: 8I1E-1 +<<< Could not download PDB/mmCIF file: 8I5I-1 +<<< Could not download PDB/mmCIF file: 8I9I-1 +<<< Could not download PDB/mmCIF file: 8IGL-2 +<<< Could not download PDB/mmCIF file: 8IO7-1 +<<< Could not download PDB/mmCIF file: 8J0L-1 +<<< Could not download PDB/mmCIF file: 8OJU-1 +<<< Could not download PDB/mmCIF file: 8OUP-1 +<<< Could not download PDB/mmCIF file: 8P3M-5 +<<< Could not download PDB/mmCIF file: 8SF3-1 +<<< Could not download PDB/mmCIF file: 8ST7-1 +<<< Could not download PDB/mmCIF file: 7Y1Z-1 +<<< Could not download PDB/mmCIF file: 7Z1I-3 +<<< Could not download PDB/mmCIF file: 7ZNM-1 +<<< Could not download PDB/mmCIF file: 8AEN-1 +<<< Could not download PDB/mmCIF file: 8DE3-1 +<<< Could not download PDB/mmCIF file: 8DV3-1 +<<< Could not download PDB/mmCIF file: 8ESV-1 +<<< Could not download PDB/mmCIF file: 8FRB-3 +<<< Could not download PDB/mmCIF file: 8PC8-1 +<<< Could not download PDB/mmCIF file: 7FS9-2 +<<< Could not download PDB/mmCIF file: 7FSP-4 +<<< Could not download PDB/mmCIF file: 7FT2-2 +<<< Could not download PDB/mmCIF file: 7FUV-1 +<<< Could not download PDB/mmCIF file: 7FWB-1 +<<< Could not download PDB/mmCIF file: 7FXM-1 +<<< Could not download PDB/mmCIF file: 7FYR-1 +<<< Could not download PDB/mmCIF file: 7FZZ-1 +<<< Could not download PDB/mmCIF file: 7G0W-3 +<<< Could not download PDB/mmCIF file: 7G86-1 +<<< Could not download PDB/mmCIF file: 7QOT-2 +<<< Could not download PDB/mmCIF file: 7QSE-1 +<<< Could not download PDB/mmCIF file: 7QVL-1 +<<< Could not download PDB/mmCIF file: 7REZ-1 +<<< Could not download PDB/mmCIF file: 7RXY-2 +<<< Could not download PDB/mmCIF file: 7SZB-2 +<<< Could not download PDB/mmCIF file: 7T9C-1 +<<< Could not download PDB/mmCIF file: 7U5X-1 +<<< Could not download PDB/mmCIF file: 7U70-2 +<<< Could not download PDB/mmCIF file: 7U9W-1 +<<< Could not download PDB/mmCIF file: 7UDQ-1 +<<< Could not download PDB/mmCIF file: 7UGE-1 +<<< Could not download PDB/mmCIF file: 7UI4-1 +<<< Could not download PDB/mmCIF file: 7UJV-1 +<<< Could not download PDB/mmCIF file: 7ULD-1 +<<< Could not download PDB/mmCIF file: 7UUC-1 +<<< Could not download PDB/mmCIF file: 7UZM-1 +<<< Could not download PDB/mmCIF file: 7W3Z-1 +<<< Could not download PDB/mmCIF file: 7W5K-1 +<<< Could not download PDB/mmCIF file: 7WIW-1 +<<< Could not download PDB/mmCIF file: 7WQM-2 +<<< Could not download PDB/mmCIF file: 7WWY-1 +<<< Could not download PDB/mmCIF file: 7X0T-1 +<<< Could not download PDB/mmCIF file: 7X52-1 +<<< Could not download PDB/mmCIF file: 7X79-1 +<<< Could not download PDB/mmCIF file: 7X8T-1 +<<< Could not download PDB/mmCIF file: 7XC9-1 +<<< Could not download PDB/mmCIF file: 7XJV-3 +<<< Could not download PDB/mmCIF file: 7XLI-1 +<<< Could not download PDB/mmCIF file: 7XRX-1 +<<< Could not download PDB/mmCIF file: 7XTR-1 +<<< Could not download PDB/mmCIF file: 7XVK-1 +<<< Could not download PDB/mmCIF file: 7XWX-3 +<<< Could not download 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file: 8A1L-2 +<<< Could not download PDB/mmCIF file: 8A4U-2 +<<< Could not download PDB/mmCIF file: 8A5V-4 +<<< Could not download PDB/mmCIF file: 8A85-1 +<<< Could not download PDB/mmCIF file: 8A9R-1 +<<< Could not download PDB/mmCIF file: 8AC9-2 +<<< Could not download PDB/mmCIF file: 8AFF-1 +<<< Could not download PDB/mmCIF file: 8AIS-1 +<<< Could not download PDB/mmCIF file: 8AOQ-2 +<<< Could not download PDB/mmCIF file: 8ARB-4 +<<< Could not download PDB/mmCIF file: 8AUC-3 +<<< Could not download PDB/mmCIF file: 8AVP-5 +<<< Could not download PDB/mmCIF file: 8AY8-1 +<<< Could not download PDB/mmCIF file: 8B0L-1 +<<< Could not download PDB/mmCIF file: 8B3X-1 +<<< Could not download PDB/mmCIF file: 8B9H-1 +<<< Could not download PDB/mmCIF file: 8BBL-7 +<<< Could not download PDB/mmCIF file: 8BCT-2 +<<< Could not download PDB/mmCIF file: 8BEB-1 +<<< Could not download PDB/mmCIF file: 8BGL-1 +<<< Could not download PDB/mmCIF file: 8BIG-2 +<<< Could not download PDB/mmCIF file: 8BLL-5 +<<< Could not download PDB/mmCIF file: 8BPC-1 +<<< Could not download PDB/mmCIF file: 8BS9-1 +<<< Could not download PDB/mmCIF file: 8BVG-1 +<<< Could not download PDB/mmCIF file: 8C0J-1 +<<< Could not download PDB/mmCIF file: 8C4R-1 +<<< Could not download PDB/mmCIF file: 8C9K-1 +<<< Could not download PDB/mmCIF file: 8CDF-1 +<<< Could not download PDB/mmCIF file: 8CIF-1 +<<< Could not download PDB/mmCIF file: 8CP2-2 +<<< Could not download PDB/mmCIF file: 8CUP-1 +<<< Could not download PDB/mmCIF file: 8D1P-1 +<<< Could not download PDB/mmCIF file: 8D8Z-2 +<<< Could not download PDB/mmCIF file: 8DJU-1 +<<< Could not download PDB/mmCIF file: 8DL5-1 +<<< Could not download PDB/mmCIF file: 8DN6-2 +<<< Could not download PDB/mmCIF file: 8DOV-1 +<<< Could not download PDB/mmCIF file: 8DUZ-1 +<<< Could not download PDB/mmCIF file: 8DY0-1 +<<< Could not download PDB/mmCIF file: 8DZP-1 +<<< Could not download PDB/mmCIF file: 8E3Q-1 +<<< Could not download PDB/mmCIF file: 8E9F-1 +<<< Could not download PDB/mmCIF file: 8EEH-2 +<<< Could not download PDB/mmCIF file: 8EQI-1 +<<< Could not download PDB/mmCIF file: 8ESY-1 +<<< Could not download PDB/mmCIF file: 8EWL-1 +<<< Could not download PDB/mmCIF file: 8F15-2 +<<< Could not download PDB/mmCIF file: 8F6N-2 +<<< Could not download PDB/mmCIF file: 8FAV-2 +<<< Could not download PDB/mmCIF file: 8FCT-1 +<<< Could not download PDB/mmCIF file: 8FG8-1 +<<< Could not download PDB/mmCIF file: 8FLG-1 +<<< Could not download PDB/mmCIF file: 8FN1-1 +<<< Could not download PDB/mmCIF file: 8FQO-2 +<<< Could not download PDB/mmCIF file: 8FUX-1 +<<< Could not download PDB/mmCIF file: 8FZY-1 +<<< Could not download PDB/mmCIF file: 8G3I-1 +<<< Could not download PDB/mmCIF file: 8G8F-1 +<<< Could not download PDB/mmCIF file: 8GF6-1 +<<< Could not download PDB/mmCIF file: 8GJZ-1 +<<< Could not download PDB/mmCIF file: 8GOM-1 +<<< Could not download PDB/mmCIF file: 8GYJ-1 +<<< Could not download PDB/mmCIF file: 8H2T-1 +<<< Could not download 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file: 8ET8-1 +<<< Could not download PDB/mmCIF file: 8FRB-4 +<<< Could not download PDB/mmCIF file: 5SMJ-1 +<<< Could not download PDB/mmCIF file: 7F96-1 +<<< Could not download PDB/mmCIF file: 7FJP-1 +<<< Could not download PDB/mmCIF file: 7FSA-1 +<<< Could not download PDB/mmCIF file: 7FSQ-1 +<<< Could not download PDB/mmCIF file: 7FT2-3 +<<< Could not download PDB/mmCIF file: 7FUW-1 +<<< Could not download PDB/mmCIF file: 7FWC-1 +<<< Could not download PDB/mmCIF file: 7FXN-1 +<<< Could not download PDB/mmCIF file: 7FYS-1 +<<< Could not download PDB/mmCIF file: 7G00-1 +<<< Could not download PDB/mmCIF file: 7G0W-4 +<<< Could not download PDB/mmCIF file: 7G87-1 +<<< Could not download PDB/mmCIF file: 7P5L-1 +<<< Could not download PDB/mmCIF file: 7QOU-1 +<<< Could not download PDB/mmCIF file: 7QRH-1 +<<< Could not download PDB/mmCIF file: 7QVL-2 +<<< Could not download PDB/mmCIF file: 7RF0-1 +<<< Could not download PDB/mmCIF file: 7T86-1 +<<< Could not download PDB/mmCIF file: 7T9C-2 +<<< Could not download PDB/mmCIF file: 7U71-1 +<<< Could not download PDB/mmCIF file: 7UDQ-2 +<<< Could not download PDB/mmCIF file: 7UGE-2 +<<< Could not download PDB/mmCIF file: 7UI7-1 +<<< Could not download PDB/mmCIF file: 7ULE-1 +<<< Could not download PDB/mmCIF file: 7UOI-1 +<<< Could not download PDB/mmCIF file: 7UUD-1 +<<< Could not download PDB/mmCIF file: 7UXV-1 +<<< Could not download PDB/mmCIF file: 7W40-1 +<<< Could not download PDB/mmCIF file: 7W5L-1 +<<< Could not download PDB/mmCIF file: 7WQQ-1 +<<< Could not download PDB/mmCIF file: 7WZ5-1 +<<< Could not download PDB/mmCIF file: 7X0X-1 +<<< Could not download PDB/mmCIF file: 7X53-1 +<<< Could not download PDB/mmCIF file: 7X8T-2 +<<< Could not download PDB/mmCIF file: 7XCA-1 +<<< Could not download PDB/mmCIF file: 7XH2-1 +<<< Could not download PDB/mmCIF file: 7XJV-4 +<<< Could not download PDB/mmCIF file: 7XLJ-1 +<<< Could not download PDB/mmCIF file: 7XRX-2 +<<< Could not download PDB/mmCIF file: 7XTR-2 +<<< Could not download PDB/mmCIF file: 7XVR-1 +<<< Could not download PDB/mmCIF file: 7XWX-4 +<<< Could not download PDB/mmCIF file: 7XYO-1 +<<< Could not download PDB/mmCIF file: 7Y1J-1 +<<< Could not download PDB/mmCIF file: 7Y4G-1 +<<< Could not download PDB/mmCIF file: 7Y6O-1 +<<< Could not download PDB/mmCIF file: 7Y8O-1 +<<< Could not download PDB/mmCIF file: 7YAN-2 +<<< Could not download PDB/mmCIF file: 7YDA-1 +<<< Could not download PDB/mmCIF file: 7YIS-1 +<<< Could not download PDB/mmCIF file: 7YMR-2 +<<< Could not download PDB/mmCIF file: 7YPV-3 +<<< Could not download PDB/mmCIF file: 7YTT-1 +<<< Could not download PDB/mmCIF file: 7YXT-4 +<<< Could not download PDB/mmCIF file: 7YZ8-10 +<<< Could not download PDB/mmCIF file: 7Z2L-3 +<<< Could not download PDB/mmCIF file: 7ZJG-1 +<<< Could not download PDB/mmCIF file: 7ZL5-2 +<<< Could not download PDB/mmCIF file: 7ZNB-1 +<<< Could not download PDB/mmCIF file: 7ZOZ-1 +<<< Could not download PDB/mmCIF file: 7ZSR-1 +<<< Could not download 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file: 8BIG-3 +<<< Could not download PDB/mmCIF file: 8BLL-6 +<<< Could not download PDB/mmCIF file: 8BPH-1 +<<< Could not download PDB/mmCIF file: 8BS9-2 +<<< Could not download PDB/mmCIF file: 8BVG-2 +<<< Could not download PDB/mmCIF file: 8C0J-2 +<<< Could not download PDB/mmCIF file: 8C4R-2 +<<< Could not download PDB/mmCIF file: 8C9K-2 +<<< Could not download PDB/mmCIF file: 8CDJ-1 +<<< Could not download PDB/mmCIF file: 8CIK-1 +<<< Could not download PDB/mmCIF file: 8CP5-1 +<<< Could not download PDB/mmCIF file: 8CT5-1 +<<< Could not download PDB/mmCIF file: 8CUP-2 +<<< Could not download PDB/mmCIF file: 8CXH-1 +<<< Could not download PDB/mmCIF file: 8D1Q-1 +<<< Could not download PDB/mmCIF file: 8D90-1 +<<< Could not download PDB/mmCIF file: 8DE5-1 +<<< Could not download PDB/mmCIF file: 8DG9-1 +<<< Could not download PDB/mmCIF file: 8DI3-1 +<<< Could not download PDB/mmCIF file: 8DL6-1 +<<< Could not download PDB/mmCIF file: 8DN7-1 +<<< Could not download PDB/mmCIF file: 8DOV-2 +<<< Could not download PDB/mmCIF file: 8DUZ-2 +<<< Could not download PDB/mmCIF file: 8DY0-2 +<<< Could not download PDB/mmCIF file: 8DZQ-1 +<<< Could not download PDB/mmCIF file: 8E3S-1 +<<< Could not download PDB/mmCIF file: 8E6G-1 +<<< Could not download PDB/mmCIF file: 8EEI-1 +<<< Could not download PDB/mmCIF file: 8EK9-1 +<<< Could not download PDB/mmCIF file: 8ENB-1 +<<< Could not download PDB/mmCIF file: 8EQI-2 +<<< Could not download PDB/mmCIF file: 8ET4-1 +<<< Could not download PDB/mmCIF file: 8EWM-1 +<<< Could not download PDB/mmCIF file: 8F15-3 +<<< Could not download PDB/mmCIF file: 8F6O-1 +<<< Could not download PDB/mmCIF file: 8FAX-1 +<<< Could not download PDB/mmCIF file: 8FCY-1 +<<< Could not download PDB/mmCIF file: 8FG8-2 +<<< Could not download PDB/mmCIF file: 8FLH-1 +<<< Could not download PDB/mmCIF file: 8FN5-1 +<<< Could not download PDB/mmCIF file: 8FQP-1 +<<< Could not download PDB/mmCIF file: 8FUX-2 +<<< Could not download PDB/mmCIF file: 8FZY-2 +<<< Could not download PDB/mmCIF file: 8G3I-2 +<<< Could not download PDB/mmCIF file: 8G8K-1 +<<< Could not download PDB/mmCIF file: 8GF8-1 +<<< Could not download PDB/mmCIF file: 8GK0-1 +<<< Could not download PDB/mmCIF file: 8GON-1 +<<< Could not download PDB/mmCIF file: 8GRI-1 +<<< Could not download PDB/mmCIF file: 8GYN-1 +<<< Could not download PDB/mmCIF file: 8H2X-1 +<<< Could not download PDB/mmCIF file: 8H7F-2 +<<< Could not download PDB/mmCIF file: 8HBV-1 +<<< Could not download PDB/mmCIF file: 8HG6-1 +<<< Could not download PDB/mmCIF file: 8HKJ-4 +<<< Could not download PDB/mmCIF file: 8HSC-1 +<<< Could not download PDB/mmCIF file: 8I1F-1 +<<< Could not download PDB/mmCIF file: 8I5R-1 +<<< Could not download PDB/mmCIF file: 8IA5-1 +<<< Could not download PDB/mmCIF file: 8IGO-1 +<<< Could not download PDB/mmCIF file: 8IOA-1 +<<< Could not download PDB/mmCIF file: 8J18-1 +<<< Could not download PDB/mmCIF file: 8OKK-1 +<<< Could not download PDB/mmCIF file: 8OUU-1 +<<< Could not download 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file: 7G0X-1 +<<< Could not download PDB/mmCIF file: 7G88-1 +<<< Could not download PDB/mmCIF file: 7PA6-1 +<<< Could not download PDB/mmCIF file: 7QOV-1 +<<< Could not download PDB/mmCIF file: 7QRJ-1 +<<< Could not download PDB/mmCIF file: 7QSG-1 +<<< Could not download PDB/mmCIF file: 7QU4-1 +<<< Could not download PDB/mmCIF file: 7QZJ-1 +<<< Could not download PDB/mmCIF file: 7SFY-1 +<<< Could not download PDB/mmCIF file: 7SIB-1 +<<< Could not download PDB/mmCIF file: 7T86-2 +<<< Could not download PDB/mmCIF file: 7T9D-1 +<<< Could not download PDB/mmCIF file: 7TBQ-1 +<<< Could not download PDB/mmCIF file: 7TTV-1 +<<< Could not download PDB/mmCIF file: 7U0V-1 +<<< Could not download PDB/mmCIF file: 7U2V-1 +<<< Could not download PDB/mmCIF file: 7U5Z-1 +<<< Could not download PDB/mmCIF file: 7U7H-1 +<<< Could not download PDB/mmCIF file: 7UGF-1 +<<< Could not download PDB/mmCIF file: 7UI8-1 +<<< Could not download PDB/mmCIF file: 7ULF-1 +<<< Could not download PDB/mmCIF file: 7UON-1 +<<< Could not download PDB/mmCIF file: 7UUE-1 +<<< Could not download PDB/mmCIF file: 7V4X-1 +<<< Could not download PDB/mmCIF file: 7W15-1 +<<< Could not download PDB/mmCIF file: 7W41-1 +<<< Could not download PDB/mmCIF file: 7W75-1 +<<< Could not download PDB/mmCIF file: 7WIZ-1 +<<< Could not download PDB/mmCIF file: 7WOI-1 +<<< Could not download PDB/mmCIF file: 7WQR-1 +<<< Could not download PDB/mmCIF file: 7WX0-1 +<<< Could not download PDB/mmCIF file: 7X0Z-1 +<<< Could not download PDB/mmCIF file: 7X3H-1 +<<< Could not download PDB/mmCIF file: 7X56-1 +<<< Could not download PDB/mmCIF file: 7X8T-3 +<<< Could not download PDB/mmCIF file: 7XCB-1 +<<< Could not download PDB/mmCIF file: 7XEC-1 +<<< Could not download PDB/mmCIF file: 7XH4-1 +<<< Could not download PDB/mmCIF file: 7XJW-1 +<<< Could not download PDB/mmCIF file: 7XLL-1 +<<< Could not download PDB/mmCIF file: 7XRX-3 +<<< Could not download PDB/mmCIF file: 7XTS-1 +<<< Could not download PDB/mmCIF file: 7XVR-2 +<<< Could not download PDB/mmCIF file: 7XX0-1 +<<< Could not download PDB/mmCIF file: 7XYQ-1 +<<< Could not download PDB/mmCIF file: 7Y1S-1 +<<< Could not download PDB/mmCIF file: 7Y4G-2 +<<< Could not download PDB/mmCIF file: 7Y6W-1 +<<< Could not download PDB/mmCIF file: 7Y8S-1 +<<< Could not download PDB/mmCIF file: 7YAQ-1 +<<< Could not download PDB/mmCIF file: 7YDA-2 +<<< Could not download PDB/mmCIF file: 7YIT-1 +<<< Could not download PDB/mmCIF file: 7YL4-1 +<<< Could not download PDB/mmCIF file: 7YMR-3 +<<< Could not download PDB/mmCIF file: 7YPV-4 +<<< Could not download PDB/mmCIF file: 7YTU-1 +<<< Could not download PDB/mmCIF file: 7YXU-1 +<<< Could not download PDB/mmCIF file: 7YZ8-11 +<<< Could not download PDB/mmCIF file: 7Z0Q-1 +<<< Could not download PDB/mmCIF file: 7Z2L-4 +<<< Could not download PDB/mmCIF file: 7ZCT-1 +<<< Could not download PDB/mmCIF file: 7ZJH-1 +<<< Could not download PDB/mmCIF file: 7ZL6-1 +<<< Could not download PDB/mmCIF file: 7ZNC-1 +<<< Could not download 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file: 8BIG-4 +<<< Could not download PDB/mmCIF file: 8BLL-7 +<<< Could not download PDB/mmCIF file: 8BPJ-1 +<<< Could not download PDB/mmCIF file: 8BSA-1 +<<< Could not download PDB/mmCIF file: 8BVG-3 +<<< Could not download PDB/mmCIF file: 8C0N-1 +<<< Could not download PDB/mmCIF file: 8C4S-1 +<<< Could not download PDB/mmCIF file: 8C9M-1 +<<< Could not download PDB/mmCIF file: 8CDK-1 +<<< Could not download PDB/mmCIF file: 8CIO-1 +<<< Could not download PDB/mmCIF file: 8CP5-2 +<<< Could not download PDB/mmCIF file: 8CT7-1 +<<< Could not download PDB/mmCIF file: 8CUQ-1 +<<< Could not download PDB/mmCIF file: 8CXJ-1 +<<< Could not download PDB/mmCIF file: 8D90-2 +<<< Could not download PDB/mmCIF file: 8DCQ-1 +<<< Could not download PDB/mmCIF file: 8DE6-1 +<<< Could not download PDB/mmCIF file: 8DI4-1 +<<< Could not download PDB/mmCIF file: 8DJW-1 +<<< Could not download PDB/mmCIF file: 8DN7-2 +<<< Could not download PDB/mmCIF file: 8DY1-1 +<<< Could not download PDB/mmCIF file: 8DZR-1 +<<< Could not download PDB/mmCIF file: 8E6G-2 +<<< Could not download PDB/mmCIF file: 8EEJ-1 +<<< Could not download PDB/mmCIF file: 8EKE-1 +<<< Could not download PDB/mmCIF file: 8ENB-2 +<<< Could not download PDB/mmCIF file: 8EQJ-1 +<<< Could not download PDB/mmCIF file: 8ET5-1 +<<< Could not download PDB/mmCIF file: 8EWN-1 +<<< Could not download PDB/mmCIF file: 8F16-1 +<<< Could not download PDB/mmCIF file: 8F4A-1 +<<< Could not download PDB/mmCIF file: 8F6T-1 +<<< Could not download PDB/mmCIF file: 8FAZ-1 +<<< Could not download PDB/mmCIF file: 8FD6-1 +<<< Could not download PDB/mmCIF file: 8FGY-1 +<<< Could not download PDB/mmCIF file: 8FLL-1 +<<< Could not download PDB/mmCIF file: 8FN5-2 +<<< Could not download PDB/mmCIF file: 8FQP-2 +<<< Could not download PDB/mmCIF file: 8FUY-1 +<<< Could not download PDB/mmCIF file: 8FZY-3 +<<< Could not download PDB/mmCIF file: 8G3J-1 +<<< Could not download PDB/mmCIF file: 8G8O-1 +<<< Could not download PDB/mmCIF file: 8GF9-1 +<<< Could not download PDB/mmCIF file: 8GK4-1 +<<< Could not download PDB/mmCIF file: 8GOP-1 +<<< Could not download PDB/mmCIF file: 8GRN-1 +<<< Could not download PDB/mmCIF file: 8GYR-1 +<<< Could not download PDB/mmCIF file: 8H2X-2 +<<< Could not download PDB/mmCIF file: 8H7H-1 +<<< Could not download PDB/mmCIF file: 8HBW-1 +<<< Could not download PDB/mmCIF file: 8HKJ-5 +<<< Could not download PDB/mmCIF file: 8HSH-1 +<<< Could not download PDB/mmCIF file: 8I1F-2 +<<< Could not download PDB/mmCIF file: 8I5S-1 +<<< Could not download PDB/mmCIF file: 8IA8-1 +<<< Could not download PDB/mmCIF file: 8IGU-1 +<<< Could not download PDB/mmCIF file: 8IOM-1 +<<< Could not download PDB/mmCIF file: 8J19-1 +<<< Could not download PDB/mmCIF file: 8OKL-1 +<<< Could not download PDB/mmCIF file: 8OUU-2 +<<< Could not download PDB/mmCIF file: 8P3M-8 +<<< Could not download PDB/mmCIF file: 8SGH-1 +<<< Could not download PDB/mmCIF file: 8ST9-1 +<<< Could not download PDB/mmCIF file: 7Z3L-1 +<<< Could not download 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file: 7QRJ-2 +<<< Could not download PDB/mmCIF file: 7QSG-2 +<<< Could not download PDB/mmCIF file: 7QU4-2 +<<< Could not download PDB/mmCIF file: 7QVN-1 +<<< Could not download PDB/mmCIF file: 7QZK-1 +<<< Could not download PDB/mmCIF file: 7R2H-1 +<<< Could not download PDB/mmCIF file: 7R59-1 +<<< Could not download PDB/mmCIF file: 7SFY-2 +<<< Could not download PDB/mmCIF file: 7SJT-1 +<<< Could not download PDB/mmCIF file: 7T86-3 +<<< Could not download PDB/mmCIF file: 7T9D-2 +<<< Could not download PDB/mmCIF file: 7TBQ-2 +<<< Could not download PDB/mmCIF file: 7TJB-1 +<<< Could not download PDB/mmCIF file: 7TTV-2 +<<< Could not download PDB/mmCIF file: 7U0W-1 +<<< Could not download PDB/mmCIF file: 7U61-1 +<<< Could not download PDB/mmCIF file: 7U7H-2 +<<< Could not download PDB/mmCIF file: 7UIE-1 +<<< Could not download PDB/mmCIF file: 7ULG-1 +<<< Could not download PDB/mmCIF file: 7UOP-1 +<<< Could not download PDB/mmCIF file: 7VWM-1 +<<< Could not download PDB/mmCIF file: 7W15-2 +<<< Could not download PDB/mmCIF file: 7W5N-1 +<<< Could not download PDB/mmCIF file: 7W75-2 +<<< Could not download PDB/mmCIF file: 7WJ1-1 +<<< Could not download PDB/mmCIF file: 7WOI-2 +<<< Could not download PDB/mmCIF file: 7WQR-2 +<<< Could not download PDB/mmCIF file: 7WUY-1 +<<< Could not download PDB/mmCIF file: 7WX1-1 +<<< Could not download PDB/mmCIF file: 7X3L-1 +<<< Could not download PDB/mmCIF file: 7X5B-1 +<<< Could not download PDB/mmCIF file: 7X7H-1 +<<< Could not download PDB/mmCIF file: 7X8T-4 +<<< Could not download PDB/mmCIF file: 7XCC-1 +<<< Could not download PDB/mmCIF file: 7XEE-1 +<<< Could not download PDB/mmCIF file: 7XG7-1 +<<< Could not download PDB/mmCIF file: 7XIK-1 +<<< Could not download PDB/mmCIF file: 7XJW-2 +<<< Could not download PDB/mmCIF file: 7XTS-2 +<<< Could not download PDB/mmCIF file: 7XVU-1 +<<< Could not download PDB/mmCIF file: 7XX0-2 +<<< Could not download PDB/mmCIF file: 7XYR-1 +<<< Could not download PDB/mmCIF file: 7Y1U-1 +<<< Could not download PDB/mmCIF file: 7Y4H-1 +<<< Could not download PDB/mmCIF file: 7Y6X-1 +<<< Could not download PDB/mmCIF file: 7YDB-1 +<<< Could not download PDB/mmCIF file: 7YIU-1 +<<< Could not download PDB/mmCIF file: 7YL4-2 +<<< Could not download PDB/mmCIF file: 7YMR-4 +<<< Could not download PDB/mmCIF file: 7YTW-1 +<<< Could not download PDB/mmCIF file: 7YZ8-12 +<<< Could not download PDB/mmCIF file: 7Z2M-1 +<<< Could not download PDB/mmCIF file: 7Z4S-1 +<<< Could not download PDB/mmCIF file: 7ZCT-2 +<<< Could not download PDB/mmCIF file: 7ZJI-1 +<<< Could not download PDB/mmCIF file: 7ZND-1 +<<< Could not download PDB/mmCIF file: 7ZSU-1 +<<< Could not download PDB/mmCIF file: 7ZW5-1 +<<< Could not download PDB/mmCIF file: 7ZZH-1 +<<< Could not download PDB/mmCIF file: 8A0F-1 +<<< Could not download PDB/mmCIF file: 8A1N-1 +<<< Could not download PDB/mmCIF file: 8A4V-1 +<<< Could not download PDB/mmCIF file: 8A5W-3 +<<< Could not download PDB/mmCIF file: 8ACG-1 +<<< Could not download 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file: 8C5D-1 +<<< Could not download PDB/mmCIF file: 8C9S-1 +<<< Could not download PDB/mmCIF file: 8CDP-1 +<<< Could not download PDB/mmCIF file: 8CIP-1 +<<< Could not download PDB/mmCIF file: 8CT8-1 +<<< Could not download PDB/mmCIF file: 8CUQ-2 +<<< Could not download PDB/mmCIF file: 8CXJ-2 +<<< Could not download PDB/mmCIF file: 8D1S-1 +<<< Could not download PDB/mmCIF file: 8D4P-1 +<<< Could not download PDB/mmCIF file: 8D91-1 +<<< Could not download PDB/mmCIF file: 8DE7-1 +<<< Could not download PDB/mmCIF file: 8DI4-2 +<<< Could not download PDB/mmCIF file: 8DJX-1 +<<< Could not download PDB/mmCIF file: 8DY1-2 +<<< Could not download PDB/mmCIF file: 8DZS-1 +<<< Could not download PDB/mmCIF file: 8E6H-1 +<<< Could not download PDB/mmCIF file: 8EBI-1 +<<< Could not download PDB/mmCIF file: 8EEJ-2 +<<< Could not download PDB/mmCIF file: 8ENE-1 +<<< Could not download PDB/mmCIF file: 8EQO-1 +<<< Could not download PDB/mmCIF file: 8ETB-1 +<<< Could not download PDB/mmCIF file: 8F16-2 +<<< Could not download PDB/mmCIF file: 8F4B-1 +<<< Could not download PDB/mmCIF file: 8F70-1 +<<< Could not download PDB/mmCIF file: 8FB0-1 +<<< Could not download PDB/mmCIF file: 8FD8-1 +<<< Could not download PDB/mmCIF file: 8FGZ-1 +<<< Could not download PDB/mmCIF file: 8FLN-1 +<<< Could not download PDB/mmCIF file: 8FN8-1 +<<< Could not download PDB/mmCIF file: 8FQQ-1 +<<< Could not download PDB/mmCIF file: 8FUZ-1 +<<< Could not download PDB/mmCIF file: 8FZY-4 +<<< Could not download PDB/mmCIF file: 8G3J-2 +<<< Could not download PDB/mmCIF file: 8G8X-1 +<<< Could not download PDB/mmCIF file: 8GFA-1 +<<< Could not download PDB/mmCIF file: 8GKC-1 +<<< Could not download PDB/mmCIF file: 8GOT-1 +<<< Could not download PDB/mmCIF file: 8GRO-1 +<<< Could not download PDB/mmCIF file: 8GYR-2 +<<< Could not download PDB/mmCIF file: 8H2X-3 +<<< Could not download PDB/mmCIF file: 8H7H-2 +<<< Could not download PDB/mmCIF file: 8HC5-1 +<<< Could not download PDB/mmCIF file: 8HKJ-6 +<<< Could not download PDB/mmCIF file: 8HT3-1 +<<< Could not download PDB/mmCIF file: 8I1G-1 +<<< Could not download PDB/mmCIF file: 8I5V-1 +<<< Could not download PDB/mmCIF file: 8IAN-1 +<<< Could not download PDB/mmCIF file: 8IGV-1 +<<< Could not download PDB/mmCIF file: 8IP3-1 +<<< Could not download PDB/mmCIF file: 8J1A-1 +<<< Could not download PDB/mmCIF file: 8ODQ-1 +<<< Could not download PDB/mmCIF file: 8OKM-1 +<<< Could not download PDB/mmCIF file: 8OUV-1 +<<< Could not download PDB/mmCIF file: 8P4Z-1 +<<< Could not download PDB/mmCIF file: 8SHI-1 +<<< Could not download PDB/mmCIF file: 8ST9-2 +<<< Could not download PDB/mmCIF file: 7WNB-1 +<<< Could not download PDB/mmCIF file: 7XJ8-1 +<<< Could not download PDB/mmCIF file: 7Y5N-1 +<<< Could not download PDB/mmCIF file: 7ZNS-2 +<<< Could not download PDB/mmCIF file: 8CWJ-1 +<<< Could not download PDB/mmCIF file: 8DF1-3 +<<< Could not download PDB/mmCIF file: 8DVM-1 +<<< Could not download PDB/mmCIF file: 8EW1-1 +<<< Could not download 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file: 7R2I-1 +<<< Could not download PDB/mmCIF file: 7RIG-1 +<<< Could not download PDB/mmCIF file: 7S2I-1 +<<< Could not download PDB/mmCIF file: 7SJU-1 +<<< Could not download PDB/mmCIF file: 7T5O-1 +<<< Could not download PDB/mmCIF file: 7T86-4 +<<< Could not download PDB/mmCIF file: 7T9E-1 +<<< Could not download PDB/mmCIF file: 7TBQ-3 +<<< Could not download PDB/mmCIF file: 7U0W-2 +<<< Could not download PDB/mmCIF file: 7U62-1 +<<< Could not download PDB/mmCIF file: 7U7H-3 +<<< Could not download PDB/mmCIF file: 7UC3-1 +<<< Could not download PDB/mmCIF file: 7UIE-2 +<<< Could not download PDB/mmCIF file: 7ULG-2 +<<< Could not download PDB/mmCIF file: 7UUI-1 +<<< Could not download PDB/mmCIF file: 7VRZ-1 +<<< Could not download PDB/mmCIF file: 7VWM-2 +<<< Could not download PDB/mmCIF file: 7W76-1 +<<< Could not download PDB/mmCIF file: 7WMW-1 +<<< Could not download PDB/mmCIF file: 7WQS-1 +<<< Could not download PDB/mmCIF file: 7WUZ-1 +<<< Could not download PDB/mmCIF file: 7WZ9-1 +<<< Could not download PDB/mmCIF file: 7X3L-2 +<<< Could not download PDB/mmCIF file: 7X5D-1 +<<< Could not download PDB/mmCIF file: 7X7I-1 +<<< Could not download PDB/mmCIF file: 7X8U-1 +<<< Could not download PDB/mmCIF file: 7XCD-1 +<<< Could not download PDB/mmCIF file: 7XEF-1 +<<< Could not download PDB/mmCIF file: 7XG7-2 +<<< Could not download PDB/mmCIF file: 7XIL-1 +<<< Could not download PDB/mmCIF file: 7XJW-3 +<<< Could not download PDB/mmCIF file: 7XRZ-1 +<<< Could not download PDB/mmCIF file: 7XTT-1 +<<< Could not download PDB/mmCIF file: 7XVU-2 +<<< Could not download PDB/mmCIF file: 7XX1-1 +<<< Could not download PDB/mmCIF file: 7Y1W-1 +<<< Could not download PDB/mmCIF file: 7Y6X-2 +<<< Could not download PDB/mmCIF file: 7YDB-2 +<<< Could not download PDB/mmCIF file: 7YIY-1 +<<< Could not download PDB/mmCIF file: 7YL5-1 +<<< Could not download PDB/mmCIF file: 7YQ0-1 +<<< Could not download PDB/mmCIF file: 7YTY-1 +<<< Could not download PDB/mmCIF file: 7YZ8-2 +<<< Could not download PDB/mmCIF file: 7Z2M-2 +<<< Could not download PDB/mmCIF file: 7Z4T-1 +<<< Could not download PDB/mmCIF file: 7ZJJ-1 +<<< Could not download PDB/mmCIF file: 7ZNE-1 +<<< Could not download PDB/mmCIF file: 7ZSU-2 +<<< Could not download PDB/mmCIF file: 7ZUM-1 +<<< Could not download PDB/mmCIF file: 7ZW7-1 +<<< Could not download PDB/mmCIF file: 7ZY3-1 +<<< Could not download PDB/mmCIF file: 7ZZJ-1 +<<< Could not download PDB/mmCIF file: 8A0G-1 +<<< Could not download PDB/mmCIF file: 8A1N-2 +<<< Could not download PDB/mmCIF file: 8A33-1 +<<< Could not download PDB/mmCIF file: 8A4V-2 +<<< Could not download PDB/mmCIF file: 8A5W-4 +<<< Could not download PDB/mmCIF file: 8A8D-1 +<<< Could not download PDB/mmCIF file: 8A9V-1 +<<< Could not download PDB/mmCIF file: 8ACG-2 +<<< Could not download PDB/mmCIF file: 8AFF-2 +<<< Could not download PDB/mmCIF file: 8AH4-3 +<<< Could not download PDB/mmCIF file: 8AIW-1 +<<< Could not download PDB/mmCIF file: 8AMP-1 +<<< Could not download 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file: 8D1T-1 +<<< Could not download PDB/mmCIF file: 8D91-2 +<<< Could not download PDB/mmCIF file: 8DE8-1 +<<< Could not download PDB/mmCIF file: 8DGD-1 +<<< Could not download PDB/mmCIF file: 8DL9-1 +<<< Could not download PDB/mmCIF file: 8DNF-1 +<<< Could not download PDB/mmCIF file: 8DOZ-1 +<<< Could not download PDB/mmCIF file: 8DQM-1 +<<< Could not download PDB/mmCIF file: 8DY2-1 +<<< Could not download PDB/mmCIF file: 8E6I-1 +<<< Could not download PDB/mmCIF file: 8EBL-1 +<<< Could not download PDB/mmCIF file: 8EEK-1 +<<< Could not download PDB/mmCIF file: 8EKH-1 +<<< Could not download PDB/mmCIF file: 8ENF-1 +<<< Could not download PDB/mmCIF file: 8EQO-2 +<<< Could not download PDB/mmCIF file: 8F17-1 +<<< Could not download PDB/mmCIF file: 8F74-1 +<<< Could not download PDB/mmCIF file: 8FB1-1 +<<< Could not download PDB/mmCIF file: 8FD9-1 +<<< Could not download PDB/mmCIF file: 8FH0-1 +<<< Could not download PDB/mmCIF file: 8FLO-1 +<<< Could not download PDB/mmCIF file: 8FN9-1 +<<< Could not download PDB/mmCIF file: 8FQQ-2 +<<< Could not download PDB/mmCIF file: 8FV6-1 +<<< Could not download PDB/mmCIF file: 8FZY-5 +<<< Could not download PDB/mmCIF file: 8G3L-1 +<<< Could not download PDB/mmCIF file: 8G94-1 +<<< Could not download PDB/mmCIF file: 8GFB-1 +<<< Could not download PDB/mmCIF file: 8GLB-1 +<<< Could not download PDB/mmCIF file: 8GP6-1 +<<< Could not download PDB/mmCIF file: 8GRS-1 +<<< Could not download PDB/mmCIF file: 8H2X-4 +<<< Could not download PDB/mmCIF file: 8H7T-1 +<<< Could not download PDB/mmCIF file: 8HCQ-1 +<<< Could not download PDB/mmCIF file: 8HGV-1 +<<< Could not download PDB/mmCIF file: 8HKJ-7 +<<< Could not download PDB/mmCIF file: 8HTW-1 +<<< Could not download PDB/mmCIF file: 8I1G-2 +<<< Could not download PDB/mmCIF file: 8I5W-1 +<<< Could not download PDB/mmCIF file: 8IAN-2 +<<< Could not download PDB/mmCIF file: 8II1-1 +<<< Could not download PDB/mmCIF file: 8IP4-1 +<<< Could not download PDB/mmCIF file: 8J1N-1 +<<< Could not download PDB/mmCIF file: 8ODR-1 +<<< Could not download PDB/mmCIF file: 8OKN-1 +<<< Could not download PDB/mmCIF file: 8OUV-2 +<<< Could not download PDB/mmCIF file: 8P4Z-2 +<<< Could not download PDB/mmCIF file: 8SHI-2 +<<< Could not download PDB/mmCIF file: 8STE-1 +<<< Could not download PDB/mmCIF file: 7TKZ-1 +<<< Could not download PDB/mmCIF file: 7XJF-1 +<<< Could not download PDB/mmCIF file: 7ZNV-1 +<<< Could not download PDB/mmCIF file: 8CWJ-2 +<<< Could not download PDB/mmCIF file: 8DF1-4 +<<< Could not download PDB/mmCIF file: 8DVN-1 +<<< Could not download PDB/mmCIF file: 8EW1-2 +<<< Could not download PDB/mmCIF file: 8FRD-2 +<<< Could not download PDB/mmCIF file: 8PED-1 +<<< Could not download PDB/mmCIF file: 5SMN-1 +<<< Could not download PDB/mmCIF file: 7FSC-1 +<<< Could not download PDB/mmCIF file: 7FSR-1 +<<< Could not download PDB/mmCIF file: 7FT3-3 +<<< Could not download PDB/mmCIF file: 7FV0-1 +<<< Could not download PDB/mmCIF file: 7FWG-1 +<<< Could not download 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file: 7S2J-1 +<<< Could not download PDB/mmCIF file: 7SJV-1 +<<< Could not download PDB/mmCIF file: 7T87-1 +<<< Could not download PDB/mmCIF file: 7T9E-2 +<<< Could not download PDB/mmCIF file: 7TBQ-4 +<<< Could not download PDB/mmCIF file: 7TP5-1 +<<< Could not download PDB/mmCIF file: 7TTZ-1 +<<< Could not download PDB/mmCIF file: 7U62-2 +<<< Could not download PDB/mmCIF file: 7UA2-1 +<<< Could not download PDB/mmCIF file: 7UIE-3 +<<< Could not download PDB/mmCIF file: 7ULG-3 +<<< Could not download PDB/mmCIF file: 7UOR-1 +<<< Could not download PDB/mmCIF file: 7UUJ-1 +<<< Could not download PDB/mmCIF file: 7V3E-1 +<<< Could not download PDB/mmCIF file: 7VRZ-2 +<<< Could not download PDB/mmCIF file: 7W76-2 +<<< Could not download PDB/mmCIF file: 7WMX-1 +<<< Could not download PDB/mmCIF file: 7WQS-2 +<<< Could not download PDB/mmCIF file: 7WZA-1 +<<< Could not download PDB/mmCIF file: 7X3M-1 +<<< Could not download PDB/mmCIF file: 7X7J-1 +<<< Could not download PDB/mmCIF file: 7XEF-2 +<<< Could not download PDB/mmCIF file: 7XG8-1 +<<< Could not download PDB/mmCIF file: 7XJW-4 +<<< Could not download PDB/mmCIF file: 7XLP-1 +<<< Could not download PDB/mmCIF file: 7XRZ-2 +<<< Could not download PDB/mmCIF file: 7XTT-2 +<<< Could not download PDB/mmCIF file: 7XVV-1 +<<< Could not download PDB/mmCIF file: 7XX4-1 +<<< Could not download PDB/mmCIF file: 7Y1X-1 +<<< Could not download PDB/mmCIF file: 7Y4J-1 +<<< Could not download PDB/mmCIF file: 7Y6X-3 +<<< Could not download PDB/mmCIF file: 7YDC-1 +<<< Could not download PDB/mmCIF file: 7YJ0-1 +<<< Could not download PDB/mmCIF file: 7YL5-2 +<<< Could not download PDB/mmCIF file: 7YQ1-1 +<<< Could not download PDB/mmCIF file: 7YU0-1 +<<< Could not download PDB/mmCIF file: 7YZ8-3 +<<< Could not download PDB/mmCIF file: 7ZCY-1 +<<< Could not download PDB/mmCIF file: 7ZJK-1 +<<< Could not download PDB/mmCIF file: 7ZL9-1 +<<< Could not download PDB/mmCIF file: 7ZNG-1 +<<< Could not download PDB/mmCIF file: 7ZQZ-1 +<<< Could 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+<<< Could not download PDB/mmCIF file: 8GUQ-1 +<<< Could not download PDB/mmCIF file: 8H39-1 +<<< Could not download PDB/mmCIF file: 8H7T-2 +<<< Could not download PDB/mmCIF file: 8HCX-1 +<<< Could not download PDB/mmCIF file: 8HGW-1 +<<< Could not download PDB/mmCIF file: 8HKJ-8 +<<< Could not download PDB/mmCIF file: 8HTY-1 +<<< Could not download PDB/mmCIF file: 8I1H-1 +<<< Could not download PDB/mmCIF file: 8I61-1 +<<< Could not download PDB/mmCIF file: 8IAS-1 +<<< Could not download PDB/mmCIF file: 8II2-1 +<<< Could not download PDB/mmCIF file: 8IP5-1 +<<< Could not download PDB/mmCIF file: 8J3W-1 +<<< Could not download PDB/mmCIF file: 8ODW-1 +<<< Could not download PDB/mmCIF file: 8OM8-1 +<<< Could not download PDB/mmCIF file: 8OUY-1 +<<< Could not download PDB/mmCIF file: 8P5F-1 +<<< Could not download PDB/mmCIF file: 8S97-1 +<<< Could not download PDB/mmCIF file: 8SHJ-1 +<<< Could not download PDB/mmCIF file: 8STX-1 +<<< Could not download PDB/mmCIF file: 7XLQ-1 +<<< Could 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+<<< Could not download PDB/mmCIF file: 7Y04-1 +<<< Could not download PDB/mmCIF file: 7Y23-1 +<<< Could not download PDB/mmCIF file: 7Y6X-4 +<<< Could not download PDB/mmCIF file: 7Y8Z-1 +<<< Could not download PDB/mmCIF file: 7YB1-1 +<<< Could not download PDB/mmCIF file: 7YDC-2 +<<< Could not download PDB/mmCIF file: 7YGI-1 +<<< Could not download PDB/mmCIF file: 7YJ0-2 +<<< Could not download PDB/mmCIF file: 7YLE-1 +<<< Could not download PDB/mmCIF file: 7YQ1-2 +<<< Could not download PDB/mmCIF file: 7YU1-1 +<<< Could not download PDB/mmCIF file: 7YZ8-4 +<<< Could not download PDB/mmCIF file: 7Z2O-1 +<<< Could not download PDB/mmCIF file: 7Z62-1 +<<< Could not download PDB/mmCIF file: 7ZJK-2 +<<< Could not download PDB/mmCIF file: 7ZNH-1 +<<< Could not download PDB/mmCIF file: 7ZSV-1 +<<< Could not download PDB/mmCIF file: 7ZUO-1 +<<< Could not download PDB/mmCIF file: 8A1P-1 +<<< Could not download PDB/mmCIF file: 8A35-2 +<<< Could not download PDB/mmCIF file: 8A4V-4 +<<< Could 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+<<< Could not download PDB/mmCIF file: 8GZ4-1 +<<< Could not download PDB/mmCIF file: 8H39-2 +<<< Could not download PDB/mmCIF file: 8H7V-1 +<<< Could not download PDB/mmCIF file: 8HCZ-1 +<<< Could not download PDB/mmCIF file: 8HGW-2 +<<< Could not download PDB/mmCIF file: 8HKJ-9 +<<< Could not download PDB/mmCIF file: 8HTY-2 +<<< Could not download PDB/mmCIF file: 8I1H-2 +<<< Could not download PDB/mmCIF file: 8I62-1 +<<< Could not download PDB/mmCIF file: 8IAT-1 +<<< Could not download PDB/mmCIF file: 8II3-1 +<<< Could not download PDB/mmCIF file: 8IP6-1 +<<< Could not download PDB/mmCIF file: 8J3Z-1 +<<< Could not download PDB/mmCIF file: 8ODW-2 +<<< Could not download PDB/mmCIF file: 8OMM-1 +<<< Could not download PDB/mmCIF file: 8OUZ-1 +<<< Could not download PDB/mmCIF file: 8P5O-1 +<<< Could not download PDB/mmCIF file: 8S9D-1 +<<< Could not download PDB/mmCIF file: 8SHJ-2 +<<< Could not download PDB/mmCIF file: 8SU6-1 +<<< Could not download PDB/mmCIF file: 7UL0-1 +<<< Could 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+<<< Could not download PDB/mmCIF file: 7XTU-2 +<<< Could not download PDB/mmCIF file: 7XVW-1 +<<< Could not download PDB/mmCIF file: 7Y6Y-1 +<<< Could not download PDB/mmCIF file: 7Y95-1 +<<< Could not download PDB/mmCIF file: 7YB2-1 +<<< Could not download PDB/mmCIF file: 7YDD-1 +<<< Could not download PDB/mmCIF file: 7YGK-1 +<<< Could not download PDB/mmCIF file: 7YJ1-1 +<<< Could not download PDB/mmCIF file: 7YLF-1 +<<< Could not download PDB/mmCIF file: 7YQ1-3 +<<< Could not download PDB/mmCIF file: 7YU2-1 +<<< Could not download PDB/mmCIF file: 7YZ8-5 +<<< Could not download PDB/mmCIF file: 7Z0V-1 +<<< Could not download PDB/mmCIF file: 7Z63-1 +<<< Could not download PDB/mmCIF file: 7ZD0-1 +<<< Could not download PDB/mmCIF file: 7ZJL-1 +<<< Could not download PDB/mmCIF file: 7ZNI-1 +<<< Could not download PDB/mmCIF file: 7ZSW-1 +<<< Could not download PDB/mmCIF file: 7ZUO-2 +<<< Could not download PDB/mmCIF file: 7ZWB-1 +<<< Could not download PDB/mmCIF file: 7ZZL-1 +<<< Could not download PDB/mmCIF file: 8A1Q-1 +<<< Could not download PDB/mmCIF file: 8A36-1 +<<< Could not download PDB/mmCIF file: 8A4W-1 +<<< Could not download PDB/mmCIF file: 8A8H-2 +<<< Could not download PDB/mmCIF file: 8A9X-2 +<<< Could not download PDB/mmCIF file: 8ACG-5 +<<< Could not download PDB/mmCIF file: 8AE7-1 +<<< Could not download PDB/mmCIF file: 8AFF-5 +<<< Could not download PDB/mmCIF file: 8AH4-6 +<<< Could not download PDB/mmCIF file: 8AJ2-2 +<<< Could not download PDB/mmCIF file: 8AMV-1 +<<< Could not download PDB/mmCIF file: 8APQ-1 +<<< Could not download PDB/mmCIF file: 8ARK-2 +<<< Could not download PDB/mmCIF file: 8AUJ-1 +<<< Could not download PDB/mmCIF file: 8AYI-1 +<<< Could not download PDB/mmCIF file: 8B54-1 +<<< Could not download PDB/mmCIF file: 8BA2-1 +<<< Could not download PDB/mmCIF file: 8BBT-1 +<<< Could not download PDB/mmCIF file: 8BGS-1 +<<< Could not download PDB/mmCIF file: 8BIH-5 +<<< Could not download PDB/mmCIF file: 8BLM-4 +<<< Could not download 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file: 8E6N-1 +<<< Could not download PDB/mmCIF file: 8EBM-2 +<<< Could not download PDB/mmCIF file: 8EEL-2 +<<< Could not download PDB/mmCIF file: 8ENM-1 +<<< Could not download PDB/mmCIF file: 8EQP-3 +<<< Could not download PDB/mmCIF file: 8ETM-1 +<<< Could not download PDB/mmCIF file: 8EWQ-1 +<<< Could not download PDB/mmCIF file: 8F1B-2 +<<< Could not download PDB/mmCIF file: 8F4U-1 +<<< Could not download PDB/mmCIF file: 8F79-1 +<<< Could not download PDB/mmCIF file: 8FB2-2 +<<< Could not download PDB/mmCIF file: 8FDJ-1 +<<< Could not download PDB/mmCIF file: 8FH4-1 +<<< Could not download PDB/mmCIF file: 8FLS-1 +<<< Could not download PDB/mmCIF file: 8FN9-4 +<<< Could not download PDB/mmCIF file: 8FQT-1 +<<< Could not download PDB/mmCIF file: 8FV9-1 +<<< Could not download PDB/mmCIF file: 8FZY-8 +<<< Could not download PDB/mmCIF file: 8G44-1 +<<< Could not download PDB/mmCIF file: 8G9F-1 +<<< Could not download PDB/mmCIF file: 8GFE-1 +<<< Could not download PDB/mmCIF file: 8GLL-2 +<<< Could not download PDB/mmCIF file: 8GPM-1 +<<< Could not download PDB/mmCIF file: 8GUS-1 +<<< Could not download PDB/mmCIF file: 8H39-3 +<<< Could not download PDB/mmCIF file: 8H7V-2 +<<< Could not download PDB/mmCIF file: 8HD2-1 +<<< Could not download PDB/mmCIF file: 8HH0-1 +<<< Could not download PDB/mmCIF file: 8HU6-1 +<<< Could not download PDB/mmCIF file: 8I1I-1 +<<< Could not download PDB/mmCIF file: 8I63-1 +<<< Could not download PDB/mmCIF file: 8IAU-1 +<<< Could not download PDB/mmCIF file: 8II4-1 +<<< Could not download PDB/mmCIF file: 8IPQ-1 +<<< Could not download PDB/mmCIF file: 8J6V-1 +<<< Could not download PDB/mmCIF file: 8OEG-1 +<<< Could not download PDB/mmCIF file: 8OMO-1 +<<< Could not download PDB/mmCIF file: 8OV1-1 +<<< Could not download PDB/mmCIF file: 8P5O-2 +<<< Could not download PDB/mmCIF file: 8SA7-1 +<<< Could not download PDB/mmCIF file: 8SHJ-3 +<<< Could not download PDB/mmCIF file: 8SU7-1 +<<< Could not download PDB/mmCIF file: 7Y63-1 +<<< Could not download PDB/mmCIF file: 7ZRV-1 +<<< Could not download PDB/mmCIF file: 8BGO-2 +<<< Could not download PDB/mmCIF file: 8CXI-1 +<<< Could not download PDB/mmCIF file: 8DFM-1 +<<< Could not download PDB/mmCIF file: 8F0H-1 +<<< Could not download PDB/mmCIF file: 8FWR-1 +<<< Could not download PDB/mmCIF file: 8HEC-1 +<<< Could not download PDB/mmCIF file: 8SDB-3 +<<< Could not download PDB/mmCIF file: 4FPQ-3 +<<< Could not download PDB/mmCIF file: 7FSD-2 +<<< Could not download PDB/mmCIF file: 7FSR-4 +<<< Could not download PDB/mmCIF file: 7FT4-2 +<<< Could not download PDB/mmCIF file: 7FV3-1 +<<< Could not download PDB/mmCIF file: 7FWI-2 +<<< Could not download PDB/mmCIF file: 7FXT-1 +<<< Could not download PDB/mmCIF file: 7FYW-4 +<<< Could not download PDB/mmCIF file: 7G00-16 +<<< Could not download PDB/mmCIF file: 7G13-1 +<<< Could not download PDB/mmCIF file: 7G8E-1 +<<< Could not download PDB/mmCIF file: 7OYP-1 +<<< Could not download PDB/mmCIF file: 7QAJ-3 +<<< Could not download 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file: 7UOR-4 +<<< Could not download PDB/mmCIF file: 7UQ9-1 +<<< Could not download PDB/mmCIF file: 7USI-1 +<<< Could not download PDB/mmCIF file: 7UWP-1 +<<< Could not download PDB/mmCIF file: 7VS3-1 +<<< Could not download PDB/mmCIF file: 7WMZ-2 +<<< Could not download PDB/mmCIF file: 7WOM-1 +<<< Could not download PDB/mmCIF file: 7WQY-1 +<<< Could not download PDB/mmCIF file: 7WVH-1 +<<< Could not download PDB/mmCIF file: 7X3N-2 +<<< Could not download PDB/mmCIF file: 7X5J-3 +<<< Could not download PDB/mmCIF file: 7XB3-1 +<<< Could not download PDB/mmCIF file: 7XCM-1 +<<< Could not download PDB/mmCIF file: 7XEI-1 +<<< Could not download PDB/mmCIF file: 7XIN-3 +<<< Could not download PDB/mmCIF file: 7XLZ-2 +<<< Could not download PDB/mmCIF file: 7XQ7-1 +<<< Could not download PDB/mmCIF file: 7XS6-1 +<<< Could not download PDB/mmCIF file: 7XTU-3 +<<< Could not download PDB/mmCIF file: 7XVW-2 +<<< Could not download PDB/mmCIF file: 7XXC-1 +<<< Could not download PDB/mmCIF file: 7Y6Y-2 +<<< Could not download PDB/mmCIF file: 7YB3-1 +<<< Could not download PDB/mmCIF file: 7YDD-2 +<<< Could not download PDB/mmCIF file: 7YJ2-1 +<<< Could not download PDB/mmCIF file: 7YLG-1 +<<< Could not download PDB/mmCIF file: 7YQ9-1 +<<< Could not download PDB/mmCIF file: 7YZ8-6 +<<< Could not download PDB/mmCIF file: 7Z2Q-1 +<<< Could not download PDB/mmCIF file: 7Z4X-1 +<<< Could not download PDB/mmCIF file: 7ZD1-1 +<<< Could not download PDB/mmCIF file: 7ZJM-1 +<<< Could not download PDB/mmCIF file: 7ZSX-1 +<<< Could not download PDB/mmCIF file: 7ZUO-3 +<<< Could not download PDB/mmCIF file: 7ZWE-1 +<<< Could not download PDB/mmCIF file: 7ZZL-2 +<<< Could not download PDB/mmCIF file: 8A1T-1 +<<< Could not download PDB/mmCIF file: 8A36-2 +<<< Could not download PDB/mmCIF file: 8A4W-2 +<<< Could not download PDB/mmCIF file: 8A62-1 +<<< Could not download PDB/mmCIF file: 8A8I-1 +<<< Could not download PDB/mmCIF file: 8A9X-3 +<<< Could not download PDB/mmCIF file: 8ACG-6 +<<< Could not download PDB/mmCIF file: 8AEB-1 +<<< Could not download PDB/mmCIF file: 8AFF-6 +<<< Could not download PDB/mmCIF file: 8AH5-1 +<<< Could not download PDB/mmCIF file: 8AMW-1 +<<< Could not download PDB/mmCIF file: 8APQ-2 +<<< Could not download PDB/mmCIF file: 8ARK-3 +<<< Could not download PDB/mmCIF file: 8AUJ-2 +<<< Could not download PDB/mmCIF file: 8B54-2 +<<< Could not download PDB/mmCIF file: 8BA3-1 +<<< Could not download PDB/mmCIF file: 8BBU-1 +<<< Could not download PDB/mmCIF file: 8BDE-1 +<<< Could not download PDB/mmCIF file: 8BGT-1 +<<< Could not download PDB/mmCIF file: 8BIH-6 +<<< Could not download PDB/mmCIF file: 8BLM-5 +<<< Could not download PDB/mmCIF file: 8BSF-1 +<<< Could not download PDB/mmCIF file: 8C0Z-1 +<<< Could not download PDB/mmCIF file: 8C5P-1 +<<< Could not download PDB/mmCIF file: 8C9Y-1 +<<< Could not download PDB/mmCIF file: 8CE9-2 +<<< Could not download PDB/mmCIF file: 8CIT-1 +<<< Could not download PDB/mmCIF file: 8CPO-1 +<<< Could not download PDB/mmCIF file: 8CTA-4 +<<< Could not download PDB/mmCIF file: 8CV1-1 +<<< Could not download PDB/mmCIF file: 8D1Y-1 +<<< Could not download PDB/mmCIF file: 8D7K-3 +<<< Could not download PDB/mmCIF file: 8DB4-1 +<<< Could not download PDB/mmCIF file: 8DGE-4 +<<< Could not download PDB/mmCIF file: 8DI7-4 +<<< Could not download PDB/mmCIF file: 8DK4-1 +<<< Could not download PDB/mmCIF file: 8DLE-1 +<<< Could not download PDB/mmCIF file: 8DP5-1 +<<< Could not download PDB/mmCIF file: 8DQP-1 +<<< Could not download PDB/mmCIF file: 8DTB-1 +<<< Could not download PDB/mmCIF file: 8DY3-1 +<<< Could not download PDB/mmCIF file: 8E72-1 +<<< Could not download PDB/mmCIF file: 8EBR-1 +<<< Could not download PDB/mmCIF file: 8EEM-1 +<<< Could not download PDB/mmCIF file: 8EKW-1 +<<< Could not download PDB/mmCIF file: 8ENN-1 +<<< Could not download PDB/mmCIF file: 8EQP-4 +<<< Could not download PDB/mmCIF file: 8ETO-1 +<<< Could not download PDB/mmCIF file: 8EWR-1 +<<< Could not download PDB/mmCIF file: 8F1B-3 +<<< Could not download PDB/mmCIF file: 8F4W-1 +<<< Could not download PDB/mmCIF file: 8F7B-1 +<<< Could not download PDB/mmCIF file: 8FBC-1 +<<< Could not download PDB/mmCIF file: 8FDK-1 +<<< Could not download PDB/mmCIF file: 8FH4-2 +<<< Could not download PDB/mmCIF file: 8FLT-1 +<<< Could not download PDB/mmCIF file: 8FNA-1 +<<< Could not download PDB/mmCIF file: 8FQT-2 +<<< Could not download PDB/mmCIF file: 8FVA-1 +<<< Could not download PDB/mmCIF file: 8FZZ-1 +<<< Could not download PDB/mmCIF file: 8G45-1 +<<< Could not download PDB/mmCIF file: 8G9M-1 +<<< Could not download PDB/mmCIF file: 8GFF-1 +<<< Could not download PDB/mmCIF file: 8GLL-3 +<<< Could not download PDB/mmCIF file: 8GPP-1 +<<< Could not download PDB/mmCIF file: 8GRX-1 +<<< Could not download PDB/mmCIF file: 8GUT-1 +<<< Could not download PDB/mmCIF file: 8H39-4 +<<< Could not download PDB/mmCIF file: 8H7Y-1 +<<< Could not download PDB/mmCIF file: 8HD4-1 +<<< Could not download PDB/mmCIF file: 8HHF-1 +<<< Could not download PDB/mmCIF file: 8HL6-1 +<<< Could not download PDB/mmCIF file: 8HUA-1 +<<< Could not download PDB/mmCIF file: 8I1I-2 +<<< Could not download PDB/mmCIF file: 8I64-1 +<<< Could not download PDB/mmCIF file: 8IAU-2 +<<< Could not download PDB/mmCIF file: 8IIB-1 +<<< Could not download PDB/mmCIF file: 8IPQ-2 +<<< Could not download PDB/mmCIF file: 8J6V-10 +<<< Could not download PDB/mmCIF file: 8OEK-1 +<<< Could not download PDB/mmCIF file: 8OMQ-1 +<<< Could not download PDB/mmCIF file: 8OV2-1 +<<< Could not download PDB/mmCIF file: 8P5O-3 +<<< Could not download PDB/mmCIF file: 8SA8-1 +<<< Could not download PDB/mmCIF file: 8SI2-1 +<<< Could not download PDB/mmCIF file: 8SV0-1 +<<< Could not download PDB/mmCIF file: 7Y68-1 +<<< Could not download PDB/mmCIF file: 7ZSD-1 +<<< Could not download PDB/mmCIF file: 8AHN-1 +<<< Could not download PDB/mmCIF file: 8DFP-1 +<<< Could not download PDB/mmCIF file: 8F0P-1 +<<< Could not download PDB/mmCIF file: 8FWS-1 +<<< Could not download PDB/mmCIF file: 8HGO-1 +<<< Could not download PDB/mmCIF file: 8SDB-4 +<<< Could not download PDB/mmCIF file: 4FPQ-4 +<<< Could not download PDB/mmCIF file: 7FC7-1 +<<< Could not download PDB/mmCIF file: 7FSE-1 +<<< Could not download PDB/mmCIF file: 7FSS-1 +<<< Could not download PDB/mmCIF file: 7FT4-3 +<<< Could not download PDB/mmCIF file: 7FV4-1 +<<< Could not download PDB/mmCIF file: 7FWI-3 +<<< Could not download PDB/mmCIF file: 7FXU-1 +<<< Could not download PDB/mmCIF file: 7FYX-1 +<<< Could not download PDB/mmCIF file: 7G00-2 +<<< Could not download PDB/mmCIF file: 7G14-1 +<<< Could not download PDB/mmCIF file: 7G8F-1 +<<< Could not download PDB/mmCIF file: 7N6C-1 +<<< Could not download PDB/mmCIF file: 7OYQ-1 +<<< Could not download PDB/mmCIF file: 7QAJ-4 +<<< Could not download PDB/mmCIF file: 7QP0-1 +<<< Could not download PDB/mmCIF file: 7QQ4-2 +<<< Could not download PDB/mmCIF file: 7QSQ-2 +<<< Could not download PDB/mmCIF file: 7QU6-5 +<<< Could not download 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file: 7USI-2 +<<< Could not download PDB/mmCIF file: 7UWP-2 +<<< Could not download PDB/mmCIF file: 7VS6-1 +<<< Could not download PDB/mmCIF file: 7WCC-1 +<<< Could not download PDB/mmCIF file: 7WMZ-3 +<<< Could not download PDB/mmCIF file: 7WR0-1 +<<< Could not download PDB/mmCIF file: 7WVI-1 +<<< Could not download PDB/mmCIF file: 7WX7-1 +<<< Could not download PDB/mmCIF file: 7X3O-1 +<<< Could not download PDB/mmCIF file: 7XB4-1 +<<< Could not download PDB/mmCIF file: 7XCQ-1 +<<< Could not download PDB/mmCIF file: 7XEI-2 +<<< Could not download PDB/mmCIF file: 7XIO-1 +<<< Could not download PDB/mmCIF file: 7XS7-1 +<<< Could not download PDB/mmCIF file: 7XTU-4 +<<< Could not download PDB/mmCIF file: 7XVX-1 +<<< Could not download PDB/mmCIF file: 7XXC-2 +<<< Could not download PDB/mmCIF file: 7Y4R-1 +<<< Could not download PDB/mmCIF file: 7Y6Z-1 +<<< Could not download PDB/mmCIF file: 7Y97-1 +<<< Could not download PDB/mmCIF file: 7YB8-1 +<<< Could not download PDB/mmCIF file: 7YDE-1 +<<< Could not download PDB/mmCIF file: 7YGV-1 +<<< Could not download PDB/mmCIF file: 7YJ4-1 +<<< Could not download PDB/mmCIF file: 7YLK-1 +<<< Could not download PDB/mmCIF file: 7YQ9-2 +<<< Could not download PDB/mmCIF file: 7YUE-1 +<<< Could not download PDB/mmCIF file: 7YZ8-7 +<<< Could not download PDB/mmCIF file: 7Z2R-1 +<<< Could not download PDB/mmCIF file: 7ZD2-1 +<<< Could not download PDB/mmCIF file: 7ZEQ-1 +<<< Could not download PDB/mmCIF file: 7ZI1-1 +<<< Could not download PDB/mmCIF file: 7ZLF-1 +<<< Could not download PDB/mmCIF file: 7ZNP-1 +<<< Could not download PDB/mmCIF file: 7ZWG-1 +<<< Could not download PDB/mmCIF file: 7ZY6-1 +<<< Could not download PDB/mmCIF file: 7ZZL-3 +<<< Could not download PDB/mmCIF file: 8A1V-1 +<<< Could not download PDB/mmCIF file: 8A37-1 +<<< Could not download PDB/mmCIF file: 8A4W-3 +<<< Could not download PDB/mmCIF file: 8A65-1 +<<< Could not download PDB/mmCIF file: 8A8K-1 +<<< Could not download PDB/mmCIF file: 8A9X-4 +<<< Could not download PDB/mmCIF file: 8ACK-1 +<<< Could not download PDB/mmCIF file: 8AFF-7 +<<< Could not download PDB/mmCIF file: 8AH6-1 +<<< Could not download PDB/mmCIF file: 8AMX-1 +<<< Could not download PDB/mmCIF file: 8APQ-3 +<<< Could not download PDB/mmCIF file: 8AUL-1 +<<< Could not download PDB/mmCIF file: 8AW8-1 +<<< Could not download PDB/mmCIF file: 8BA4-1 +<<< Could not download PDB/mmCIF file: 8BBV-1 +<<< Could not download PDB/mmCIF file: 8BDF-1 +<<< Could not download PDB/mmCIF file: 8BGT-2 +<<< Could not download PDB/mmCIF file: 8BII-1 +<<< Could not download PDB/mmCIF file: 8BLM-6 +<<< Could not download PDB/mmCIF file: 8BSG-1 +<<< Could not download PDB/mmCIF file: 8C10-1 +<<< Could not download PDB/mmCIF file: 8C60-1 +<<< Could not download PDB/mmCIF file: 8C9Z-1 +<<< Could not download PDB/mmCIF file: 8CEB-1 +<<< Could not download PDB/mmCIF file: 8CIT-2 +<<< Could not download PDB/mmCIF file: 8CV2-1 +<<< Could not download PDB/mmCIF file: 8D20-1 +<<< Could not download 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file: 8FNB-1 +<<< Could not download PDB/mmCIF file: 8FQU-1 +<<< Could not download PDB/mmCIF file: 8FVB-1 +<<< Could not download PDB/mmCIF file: 8FZZ-2 +<<< Could not download PDB/mmCIF file: 8G46-1 +<<< Could not download PDB/mmCIF file: 8GA8-1 +<<< Could not download PDB/mmCIF file: 8GFG-1 +<<< Could not download PDB/mmCIF file: 8GLL-4 +<<< Could not download PDB/mmCIF file: 8GPS-1 +<<< Could not download PDB/mmCIF file: 8GS4-1 +<<< Could not download PDB/mmCIF file: 8GUU-1 +<<< Could not download PDB/mmCIF file: 8GZ7-1 +<<< Could not download PDB/mmCIF file: 8H3D-1 +<<< Could not download PDB/mmCIF file: 8H7Y-2 +<<< Could not download PDB/mmCIF file: 8HHG-1 +<<< Could not download PDB/mmCIF file: 8HL7-1 +<<< Could not download PDB/mmCIF file: 8HUB-1 +<<< Could not download PDB/mmCIF file: 8I1J-1 +<<< Could not download PDB/mmCIF file: 8I65-1 +<<< Could not download PDB/mmCIF file: 8IAV-1 +<<< Could not download PDB/mmCIF file: 8IIB-2 +<<< Could not download PDB/mmCIF file: 8IPR-1 +<<< Could not download PDB/mmCIF file: 8J6V-11 +<<< Could not download PDB/mmCIF file: 8OEP-1 +<<< Could not download PDB/mmCIF file: 8OMS-1 +<<< Could not download PDB/mmCIF file: 8OV3-1 +<<< Could not download PDB/mmCIF file: 8P5O-4 +<<< Could not download PDB/mmCIF file: 8SA9-1 +<<< Could not download PDB/mmCIF file: 8SI3-1 +<<< Could not download PDB/mmCIF file: 8SV5-1 +<<< Could not download PDB/mmCIF file: 7UAJ-1 +<<< Could not download PDB/mmCIF file: 7XMN-1 +<<< Could not download PDB/mmCIF file: 7Y69-1 +<<< Could not download PDB/mmCIF file: 7ZSS-1 +<<< Could not download PDB/mmCIF file: 8AI7-1 +<<< Could not download PDB/mmCIF file: 8BHH-1 +<<< Could not download PDB/mmCIF file: 8DFW-1 +<<< Could not download PDB/mmCIF file: 8E07-1 +<<< Could not download PDB/mmCIF file: 8F0Q-1 +<<< Could not download PDB/mmCIF file: 8FWT-1 +<<< Could not download PDB/mmCIF file: 8HHY-1 +<<< Could not download PDB/mmCIF file: 8SK7-1 +<<< Could not download PDB/mmCIF file: 4FPQ-5 +<<< Could not download PDB/mmCIF file: 7FSF-1 +<<< Could not download PDB/mmCIF file: 7FSS-2 +<<< Could not download PDB/mmCIF file: 7FT4-4 +<<< Could not download PDB/mmCIF file: 7FV5-1 +<<< Could not download PDB/mmCIF file: 7FWJ-1 +<<< Could not download PDB/mmCIF file: 7FXV-1 +<<< Could not download PDB/mmCIF file: 7FYY-1 +<<< Could not download PDB/mmCIF file: 7G00-3 +<<< Could not download PDB/mmCIF file: 7G15-1 +<<< Could not download PDB/mmCIF file: 7G8G-1 +<<< Could not download PDB/mmCIF file: 7OYR-1 +<<< Could not download PDB/mmCIF file: 7QP0-2 +<<< Could not download PDB/mmCIF file: 7QRR-1 +<<< Could not download PDB/mmCIF file: 7QU6-6 +<<< Could not download PDB/mmCIF file: 7R1I-3 +<<< Could not download PDB/mmCIF file: 7R2O-2 +<<< Could not download PDB/mmCIF file: 7R3O-1 +<<< Could not download PDB/mmCIF file: 7RIS-1 +<<< Could not download PDB/mmCIF file: 7S1D-1 +<<< Could not download PDB/mmCIF file: 7S2M-1 +<<< Could not download PDB/mmCIF file: 7SC4-2 +<<< Could not download 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file: 7WVI-2 +<<< Could not download PDB/mmCIF file: 7WXE-1 +<<< Could not download PDB/mmCIF file: 7WZF-1 +<<< Could not download PDB/mmCIF file: 7X3O-2 +<<< Could not download PDB/mmCIF file: 7XCZ-1 +<<< Could not download PDB/mmCIF file: 7XEJ-1 +<<< Could not download PDB/mmCIF file: 7XHF-1 +<<< Could not download PDB/mmCIF file: 7XIO-2 +<<< Could not download PDB/mmCIF file: 7XQA-1 +<<< Could not download PDB/mmCIF file: 7XS8-1 +<<< Could not download PDB/mmCIF file: 7XTV-1 +<<< Could not download PDB/mmCIF file: 7XXD-1 +<<< Could not download PDB/mmCIF file: 7Y28-1 +<<< Could not download PDB/mmCIF file: 7Y70-1 +<<< Could not download PDB/mmCIF file: 7Y97-2 +<<< Could not download PDB/mmCIF file: 7YB9-1 +<<< Could not download PDB/mmCIF file: 7YDE-2 +<<< Could not download PDB/mmCIF file: 7YGW-1 +<<< Could not download PDB/mmCIF file: 7YLO-1 +<<< Could not download PDB/mmCIF file: 7YNI-1 +<<< Could not download PDB/mmCIF file: 7YQA-1 +<<< Could not download PDB/mmCIF file: 7YUG-1 +<<< Could not download PDB/mmCIF file: 7YWZ-1 +<<< Could not download PDB/mmCIF file: 7YZ8-8 +<<< Could not download PDB/mmCIF file: 7Z2R-2 +<<< Could not download PDB/mmCIF file: 7ZD3-1 +<<< Could not download PDB/mmCIF file: 7ZI2-1 +<<< Could not download PDB/mmCIF file: 7ZLG-1 +<<< Could not download PDB/mmCIF file: 7ZWK-1 +<<< Could not download PDB/mmCIF file: 7ZY7-1 +<<< Could not download PDB/mmCIF file: 7ZZL-4 +<<< Could not download PDB/mmCIF file: 8A1W-1 +<<< Could not download PDB/mmCIF file: 8A39-1 +<<< Could not download PDB/mmCIF file: 8A4W-4 +<<< Could not download PDB/mmCIF file: 8A8K-2 +<<< Could not download PDB/mmCIF file: 8A9Y-1 +<<< Could not download PDB/mmCIF file: 8ACK-2 +<<< Could not download PDB/mmCIF file: 8AFF-8 +<<< Could not download PDB/mmCIF file: 8AH7-1 +<<< Could not download PDB/mmCIF file: 8AN6-1 +<<< Could not download PDB/mmCIF file: 8ARN-1 +<<< Could not download PDB/mmCIF file: 8AUL-2 +<<< Could not download PDB/mmCIF file: 8AW9-1 +<<< Could not download PDB/mmCIF file: 8AYL-1 +<<< Could not download PDB/mmCIF file: 8B58-1 +<<< Could not download PDB/mmCIF file: 8BA4-2 +<<< Could not download PDB/mmCIF file: 8BBW-1 +<<< Could not download PDB/mmCIF file: 8BDG-1 +<<< Could not download PDB/mmCIF file: 8BEP-1 +<<< Could not download PDB/mmCIF file: 8BGV-1 +<<< Could not download PDB/mmCIF file: 8BII-2 +<<< Could not download PDB/mmCIF file: 8BLM-7 +<<< Could not download PDB/mmCIF file: 8BQF-1 +<<< Could not download PDB/mmCIF file: 8BSK-1 +<<< Could not download PDB/mmCIF file: 8C68-1 +<<< Could not download PDB/mmCIF file: 8CEI-1 +<<< Could not download PDB/mmCIF file: 8CIT-3 +<<< Could not download PDB/mmCIF file: 8CQG-1 +<<< Could not download PDB/mmCIF file: 8CTC-1 +<<< Could not download PDB/mmCIF file: 8CV3-1 +<<< Could not download PDB/mmCIF file: 8D22-1 +<<< Could not download PDB/mmCIF file: 8D4W-1 +<<< Could not download PDB/mmCIF file: 8D7L-1 +<<< Could not download PDB/mmCIF file: 8DIC-1 +<<< Could not download PDB/mmCIF file: 8DK9-1 +<<< Could not download PDB/mmCIF file: 8DQR-1 +<<< Could not download PDB/mmCIF file: 8DVC-1 +<<< Could not download PDB/mmCIF file: 8DY5-1 +<<< Could not download PDB/mmCIF file: 8E4I-1 +<<< Could not download PDB/mmCIF file: 8E76-1 +<<< Could not download PDB/mmCIF file: 8EC3-1 +<<< Could not download PDB/mmCIF file: 8EEN-1 +<<< Could not download PDB/mmCIF file: 8EL8-1 +<<< Could not download PDB/mmCIF file: 8EOB-1 +<<< Could not download PDB/mmCIF file: 8EQQ-2 +<<< Could not download PDB/mmCIF file: 8EZ1-1 +<<< Could not download PDB/mmCIF file: 8F1B-5 +<<< Could not download PDB/mmCIF file: 8F51-1 +<<< Could not download PDB/mmCIF file: 8F7P-1 +<<< Could not download PDB/mmCIF file: 8FDM-1 +<<< Could not download PDB/mmCIF file: 8FH4-4 +<<< Could not download PDB/mmCIF file: 8FLV-1 +<<< Could not download PDB/mmCIF file: 8FNB-2 +<<< Could not download PDB/mmCIF file: 8FQU-2 +<<< Could not download PDB/mmCIF file: 8FVC-1 +<<< Could not download PDB/mmCIF file: 8G0F-1 +<<< Could not download PDB/mmCIF file: 8G4C-1 +<<< Could not download PDB/mmCIF file: 8GAE-1 +<<< Could not download PDB/mmCIF file: 8GFH-1 +<<< Could not download PDB/mmCIF file: 8GLR-1 +<<< Could not download PDB/mmCIF file: 8GS8-1 +<<< Could not download PDB/mmCIF file: 8GUW-1 +<<< Could not download PDB/mmCIF file: 8GZC-1 +<<< Could not download PDB/mmCIF file: 8H3E-1 +<<< Could not download PDB/mmCIF file: 8H81-1 +<<< Could not download PDB/mmCIF file: 8HHH-1 +<<< Could not download PDB/mmCIF file: 8HL8-1 +<<< Could not download PDB/mmCIF file: 8HUR-1 +<<< Could not download PDB/mmCIF file: 8I1J-2 +<<< Could not download PDB/mmCIF file: 8I66-1 +<<< Could not download PDB/mmCIF file: 8IAW-1 +<<< Could not download PDB/mmCIF file: 8IIC-1 +<<< Could not download PDB/mmCIF file: 8IPR-2 +<<< Could not download PDB/mmCIF file: 8J6V-12 +<<< Could not download PDB/mmCIF file: 8OEP-2 +<<< Could not download PDB/mmCIF file: 8OMT-1 +<<< Could not download PDB/mmCIF file: 8OV4-1 +<<< Could not download PDB/mmCIF file: 8P6J-1 +<<< Could not download PDB/mmCIF file: 8SAA-1 +<<< Could not download PDB/mmCIF file: 8SI4-1 +<<< Could not download PDB/mmCIF file: 8SWD-1 +<<< Could not download PDB/mmCIF file: 7QQB-1 +<<< Could not download PDB/mmCIF file: 7UP9-1 +<<< Could not download PDB/mmCIF file: 7WQV-1 +<<< Could not download PDB/mmCIF file: 7XN1-1 +<<< Could not download PDB/mmCIF file: 7Z6T-1 +<<< Could not download PDB/mmCIF file: 8AIC-1 +<<< Could not download PDB/mmCIF file: 8BHH-2 +<<< Could not download PDB/mmCIF file: 8E08-1 +<<< Could not download PDB/mmCIF file: 8F0R-1 +<<< Could not download PDB/mmCIF file: 8FWU-1 +<<< Could not download PDB/mmCIF file: 8I2G-1 +<<< Could not download PDB/mmCIF file: 8SMT-1 +<<< Could not download PDB/mmCIF file: 4FPQ-6 +<<< Could not download PDB/mmCIF file: 7FSG-1 +<<< Could not download PDB/mmCIF file: 7FSS-3 +<<< Could not download PDB/mmCIF file: 7FT5-1 +<<< Could not download PDB/mmCIF file: 7FV6-1 +<<< Could not download PDB/mmCIF file: 7FWK-1 +<<< Could not download PDB/mmCIF file: 7FXW-1 +<<< Could not download PDB/mmCIF file: 7FYZ-1 +<<< Could not download PDB/mmCIF file: 7G00-4 +<<< Could not download PDB/mmCIF file: 7G16-1 +<<< Could not download PDB/mmCIF file: 7G8H-1 +<<< Could not download PDB/mmCIF file: 7PU4-1 +<<< Could not download PDB/mmCIF file: 7QP1-1 +<<< Could not download PDB/mmCIF file: 7QRR-2 +<<< Could not download PDB/mmCIF file: 7QW4-1 +<<< Could not download PDB/mmCIF file: 7QYK-1 +<<< Could not download PDB/mmCIF file: 7QZS-1 +<<< Could not download PDB/mmCIF file: 7R1J-1 +<<< Could not download PDB/mmCIF file: 7R2O-3 +<<< Could not download PDB/mmCIF file: 7S1D-2 +<<< Could not download PDB/mmCIF file: 7S2M-2 +<<< Could not download PDB/mmCIF file: 7SLI-1 +<<< Could not download PDB/mmCIF file: 7T2L-1 +<<< Could not download PDB/mmCIF file: 7T8G-1 +<<< Could not download PDB/mmCIF file: 7TJP-1 +<<< Could not download PDB/mmCIF file: 7U64-3 +<<< Could not download 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file: 7XHG-1 +<<< Could not download PDB/mmCIF file: 7XIO-3 +<<< Could not download PDB/mmCIF file: 7XQA-2 +<<< Could not download PDB/mmCIF file: 7XSA-1 +<<< Could not download PDB/mmCIF file: 7XTV-2 +<<< Could not download PDB/mmCIF file: 7XXD-2 +<<< Could not download PDB/mmCIF file: 7Y0A-1 +<<< Could not download PDB/mmCIF file: 7Y2D-1 +<<< Could not download PDB/mmCIF file: 7Y73-1 +<<< Could not download PDB/mmCIF file: 7Y98-1 +<<< Could not download PDB/mmCIF file: 7YBA-1 +<<< Could not download PDB/mmCIF file: 7YGY-1 +<<< Could not download PDB/mmCIF file: 7YLO-2 +<<< Could not download PDB/mmCIF file: 7YNJ-1 +<<< Could not download PDB/mmCIF file: 7YQA-2 +<<< Could not download PDB/mmCIF file: 7YV4-1 +<<< Could not download PDB/mmCIF file: 7YX0-1 +<<< Could not download PDB/mmCIF file: 7YZ8-9 +<<< Could not download PDB/mmCIF file: 7Z9T-1 +<<< Could not download PDB/mmCIF file: 7ZD4-1 +<<< Could not download PDB/mmCIF file: 7ZI3-1 +<<< Could not download PDB/mmCIF file: 7ZLH-1 +<<< Could not download PDB/mmCIF file: 7ZT0-1 +<<< Could not download PDB/mmCIF file: 7ZUT-1 +<<< Could not download PDB/mmCIF file: 7ZY7-2 +<<< Could not download PDB/mmCIF file: 8A1X-1 +<<< Could not download PDB/mmCIF file: 8A39-2 +<<< Could not download PDB/mmCIF file: 8A4X-1 +<<< Could not download PDB/mmCIF file: 8A8K-3 +<<< Could not download PDB/mmCIF file: 8AEM-1 +<<< Could not download PDB/mmCIF file: 8AFF-9 +<<< Could not download PDB/mmCIF file: 8AH8-1 +<<< Could not download PDB/mmCIF file: 8AN6-2 +<<< Could not download PDB/mmCIF file: 8ARN-2 +<<< Could not download PDB/mmCIF file: 8AUM-1 +<<< Could not download PDB/mmCIF file: 8AWB-1 +<<< Could not download PDB/mmCIF file: 8AYM-1 +<<< Could not download PDB/mmCIF file: 8B14-1 +<<< Could not download PDB/mmCIF file: 8B58-2 +<<< Could not download PDB/mmCIF file: 8BBY-1 +<<< Could not download PDB/mmCIF file: 8BDI-1 +<<< Could not download PDB/mmCIF file: 8BEW-1 +<<< Could not download PDB/mmCIF file: 8BGX-1 +<<< Could not download PDB/mmCIF file: 8BII-3 +<<< Could not download PDB/mmCIF file: 8BLM-8 +<<< Could not download PDB/mmCIF file: 8BQF-2 +<<< Could not download PDB/mmCIF file: 8BSL-1 +<<< Could not download PDB/mmCIF file: 8BW6-1 +<<< Could not download PDB/mmCIF file: 8C17-1 +<<< Could not download PDB/mmCIF file: 8C6E-1 +<<< Could not download PDB/mmCIF file: 8CAA-1 +<<< Could not download PDB/mmCIF file: 8CEI-2 +<<< Could not download PDB/mmCIF file: 8CIU-1 +<<< Could not download PDB/mmCIF file: 8CQX-1 +<<< Could not download PDB/mmCIF file: 8CTD-1 +<<< Could not download PDB/mmCIF file: 8CV4-1 +<<< Could not download PDB/mmCIF file: 8D4X-1 +<<< Could not download PDB/mmCIF file: 8D7M-1 +<<< Could not download PDB/mmCIF file: 8DEH-1 +<<< Could not download PDB/mmCIF file: 8DGM-1 +<<< Could not download PDB/mmCIF file: 8DID-1 +<<< Could not download PDB/mmCIF file: 8DK9-2 +<<< Could not download PDB/mmCIF file: 8DTJ-1 +<<< Could not download PDB/mmCIF file: 8DVC-2 +<<< Could not download PDB/mmCIF file: 8DY5-2 +<<< Could not download PDB/mmCIF file: 8E4I-2 +<<< Could not download PDB/mmCIF file: 8EC4-1 +<<< Could not download PDB/mmCIF file: 8EEN-2 +<<< Could not download PDB/mmCIF file: 8ELA-1 +<<< Could not download PDB/mmCIF file: 8EOC-1 +<<< Could not download PDB/mmCIF file: 8EQQ-3 +<<< Could not download PDB/mmCIF file: 8EU4-1 +<<< Could not download PDB/mmCIF file: 8EWZ-1 +<<< Could not download PDB/mmCIF file: 8EZ1-2 +<<< Could not download PDB/mmCIF file: 8F1B-6 +<<< Could not download PDB/mmCIF file: 8F55-1 +<<< Could not download PDB/mmCIF file: 8FDN-1 +<<< Could not download PDB/mmCIF file: 8FHJ-1 +<<< Could not download PDB/mmCIF file: 8FLY-1 +<<< Could not download PDB/mmCIF file: 8FNR-1 +<<< Could not download PDB/mmCIF file: 8FQV-1 +<<< Could not download PDB/mmCIF file: 8FVD-1 +<<< Could not download PDB/mmCIF file: 8G0G-1 +<<< Could not download PDB/mmCIF file: 8G4J-1 +<<< Could not download PDB/mmCIF file: 8GAI-1 +<<< Could not download PDB/mmCIF file: 8GFI-1 +<<< Could not download PDB/mmCIF file: 8GM4-1 +<<< Could not download PDB/mmCIF file: 8GPV-1 +<<< Could not download PDB/mmCIF file: 8GS9-1 +<<< Could not download PDB/mmCIF file: 8GUZ-1 +<<< Could not download PDB/mmCIF file: 8GZC-2 +<<< Could not download PDB/mmCIF file: 8H3I-1 +<<< Could not download PDB/mmCIF file: 8H85-1 +<<< Could not download PDB/mmCIF file: 8HHI-1 +<<< Could not download PDB/mmCIF file: 8HL9-1 +<<< Could not download PDB/mmCIF file: 8HUS-1 +<<< Could not download PDB/mmCIF file: 8I1M-1 +<<< Could not download PDB/mmCIF file: 8I67-1 +<<< Could not download PDB/mmCIF file: 8IAX-1 +<<< Could not download PDB/mmCIF file: 8IIC-2 +<<< Could not download PDB/mmCIF file: 8IPT-1 +<<< Could not download PDB/mmCIF file: 8J6V-2 +<<< Could not download PDB/mmCIF file: 8OF7-1 +<<< Could not download PDB/mmCIF file: 8ONO-1 +<<< Could not download PDB/mmCIF file: 8OV7-1 +<<< Could not download PDB/mmCIF file: 8P6K-1 +<<< Could not download PDB/mmCIF file: 8SAB-1 +<<< Could not download PDB/mmCIF file: 8SI5-1 +<<< Could not download PDB/mmCIF file: 8SWD-2 +<<< Could not download PDB/mmCIF file: 7N57-1 +<<< Could not download PDB/mmCIF file: 7WQV-2 +<<< Could not download PDB/mmCIF file: 8AIC-2 +<<< Could not download PDB/mmCIF file: 8BON-1 +<<< Could not download PDB/mmCIF file: 8D0O-1 +<<< Could not download PDB/mmCIF file: 8E0P-1 +<<< Could not download PDB/mmCIF file: 8F0S-1 +<<< Could not download PDB/mmCIF file: 8FWV-1 +<<< Could not download PDB/mmCIF file: 8I5B-1 +<<< Could not download PDB/mmCIF file: 8SMT-2 +<<< Could not download PDB/mmCIF file: 7FSG-2 +<<< Could not download PDB/mmCIF file: 7FSS-4 +<<< Could not download PDB/mmCIF file: 7FT5-2 +<<< Could not download PDB/mmCIF file: 7FV7-1 +<<< Could not download PDB/mmCIF file: 7FWL-1 +<<< Could not download PDB/mmCIF file: 7FXX-1 +<<< Could not download PDB/mmCIF file: 7FZ0-1 +<<< Could not download PDB/mmCIF file: 7G00-5 +<<< Could not download PDB/mmCIF file: 7G17-1 +<<< Could not download PDB/mmCIF file: 7G8I-1 +<<< Could not download PDB/mmCIF file: 7PU4-2 +<<< Could not download PDB/mmCIF file: 7QP1-2 +<<< Could not download PDB/mmCIF file: 7QRR-3 +<<< Could not download PDB/mmCIF file: 7QW4-10 +<<< Could not download PDB/mmCIF file: 7R1J-2 +<<< Could not download PDB/mmCIF file: 7R2O-4 +<<< Could not download PDB/mmCIF file: 7RB3-1 +<<< Could not download PDB/mmCIF file: 7S1F-1 +<<< Could not download PDB/mmCIF file: 7T2L-2 +<<< Could not download PDB/mmCIF file: 7T8H-1 +<<< Could not download PDB/mmCIF file: 7T9Q-1 +<<< Could not download PDB/mmCIF file: 7TJP-2 +<<< Could not download PDB/mmCIF file: 7TRK-1 +<<< Could not download PDB/mmCIF file: 7TXT-1 +<<< Could not download PDB/mmCIF file: 7U64-4 +<<< Could not download PDB/mmCIF file: 7UAH-1 +<<< Could not download PDB/mmCIF file: 7UGL-2 +<<< Could not download PDB/mmCIF file: 7UK7-1 +<<< Could not download PDB/mmCIF file: 7ULJ-3 +<<< Could not download PDB/mmCIF file: 7UMY-1 +<<< Could not download 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file: 7XXH-1 +<<< Could not download PDB/mmCIF file: 7Y0B-1 +<<< Could not download PDB/mmCIF file: 7Y35-1 +<<< Could not download PDB/mmCIF file: 7Y77-1 +<<< Could not download PDB/mmCIF file: 7Y98-2 +<<< Could not download PDB/mmCIF file: 7YBB-1 +<<< Could not download PDB/mmCIF file: 7YH9-1 +<<< Could not download PDB/mmCIF file: 7YLR-1 +<<< Could not download PDB/mmCIF file: 7YNK-1 +<<< Could not download PDB/mmCIF file: 7YQB-1 +<<< Could not download PDB/mmCIF file: 7YVE-1 +<<< Could not download PDB/mmCIF file: 7ZD5-1 +<<< Could not download PDB/mmCIF file: 7ZGL-1 +<<< Could not download PDB/mmCIF file: 7ZI5-1 +<<< Could not download PDB/mmCIF file: 7ZLI-1 +<<< Could not download PDB/mmCIF file: 7ZPC-1 +<<< Could not download PDB/mmCIF file: 7ZRB-1 +<<< Could not download PDB/mmCIF file: 7ZT0-2 +<<< Could not download PDB/mmCIF file: 8A1Y-1 +<<< Could not download PDB/mmCIF file: 8A39-3 +<<< Could not download PDB/mmCIF file: 8A4X-2 +<<< Could not download PDB/mmCIF file: 8A67-1 +<<< Could not download PDB/mmCIF file: 8A8K-4 +<<< Could not download PDB/mmCIF file: 8AA4-1 +<<< Could not download PDB/mmCIF file: 8AEO-1 +<<< Could not download PDB/mmCIF file: 8AFG-1 +<<< Could not download PDB/mmCIF file: 8AHC-1 +<<< Could not download PDB/mmCIF file: 8APT-1 +<<< Could not download PDB/mmCIF file: 8ARP-1 +<<< Could not download PDB/mmCIF file: 8AUM-2 +<<< Could not download PDB/mmCIF file: 8AWC-1 +<<< Could not download PDB/mmCIF file: 8AYN-1 +<<< Could not download PDB/mmCIF file: 8B5A-1 +<<< Could not download PDB/mmCIF file: 8BBY-2 +<<< Could not download PDB/mmCIF file: 8BDI-2 +<<< Could not download PDB/mmCIF file: 8BF1-1 +<<< Could not download PDB/mmCIF file: 8BGX-2 +<<< Could not download PDB/mmCIF file: 8BII-4 +<<< Could not download PDB/mmCIF file: 8BLS-1 +<<< Could not download PDB/mmCIF file: 8BQF-3 +<<< Could not download PDB/mmCIF file: 8BSM-1 +<<< Could not download PDB/mmCIF file: 8BWC-1 +<<< Could not download PDB/mmCIF file: 8C19-1 +<<< Could not download PDB/mmCIF file: 8C6G-1 +<<< Could not download PDB/mmCIF file: 8CAG-1 +<<< Could not download PDB/mmCIF file: 8CEJ-1 +<<< Could not download PDB/mmCIF file: 8CIW-1 +<<< Could not download PDB/mmCIF file: 8CQX-2 +<<< Could not download PDB/mmCIF file: 8CV4-2 +<<< Could not download PDB/mmCIF file: 8D24-1 +<<< Could not download PDB/mmCIF file: 8D7M-2 +<<< Could not download PDB/mmCIF file: 8DEI-1 +<<< Could not download PDB/mmCIF file: 8DGN-1 +<<< Could not download PDB/mmCIF file: 8DIE-1 +<<< Could not download PDB/mmCIF file: 8DKA-1 +<<< Could not download PDB/mmCIF file: 8DNN-1 +<<< Could not download PDB/mmCIF file: 8DQT-1 +<<< Could not download PDB/mmCIF file: 8DVC-3 +<<< Could not download PDB/mmCIF file: 8DYB-1 +<<< Could not download PDB/mmCIF file: 8E78-1 +<<< Could not download PDB/mmCIF file: 8EEO-1 +<<< Could not download PDB/mmCIF file: 8EHP-1 +<<< Could not download PDB/mmCIF file: 8ELA-2 +<<< Could not download PDB/mmCIF file: 8EOC-2 +<<< Could not download PDB/mmCIF file: 8EQQ-4 +<<< Could not download PDB/mmCIF file: 8EU4-2 +<<< Could not download PDB/mmCIF file: 8EX0-1 +<<< Could not download PDB/mmCIF file: 8EZ2-1 +<<< Could not download PDB/mmCIF file: 8F1G-1 +<<< Could not download PDB/mmCIF file: 8FDS-1 +<<< Could not download PDB/mmCIF file: 8FHL-1 +<<< Could not download PDB/mmCIF file: 8FLY-2 +<<< Could not download PDB/mmCIF file: 8FNR-2 +<<< Could not download PDB/mmCIF file: 8FQV-2 +<<< Could not download PDB/mmCIF file: 8FVE-1 +<<< Could not download PDB/mmCIF file: 8G0K-1 +<<< Could not download PDB/mmCIF file: 8G4J-2 +<<< Could not download PDB/mmCIF file: 8GAI-2 +<<< Could not download PDB/mmCIF file: 8GFJ-1 +<<< Could not download PDB/mmCIF file: 8GM5-1 +<<< Could not download PDB/mmCIF file: 8GSO-1 +<<< Could not download PDB/mmCIF file: 8GUZ-2 +<<< Could not download PDB/mmCIF file: 8GZE-1 +<<< Could not download PDB/mmCIF file: 8H3J-1 +<<< Could not download PDB/mmCIF file: 8H8A-1 +<<< Could not download PDB/mmCIF file: 8HDF-1 +<<< Could not download PDB/mmCIF file: 8HHK-1 +<<< Could not download PDB/mmCIF file: 8HLO-1 +<<< Could not download PDB/mmCIF file: 8HUT-1 +<<< Could not download PDB/mmCIF file: 8I1N-1 +<<< Could not download PDB/mmCIF file: 8I68-1 +<<< Could not download PDB/mmCIF file: 8IAX-2 +<<< Could not download PDB/mmCIF file: 8IIE-1 +<<< Could not download PDB/mmCIF file: 8IPT-2 +<<< Could not download PDB/mmCIF file: 8J6V-3 +<<< Could not download PDB/mmCIF file: 8OF9-1 +<<< Could not download PDB/mmCIF file: 8ONV-1 +<<< Could not download PDB/mmCIF file: 8OVH-1 +<<< Could not download PDB/mmCIF file: 8P7J-1 +<<< Could not download PDB/mmCIF file: 8SAC-1 +<<< Could not download PDB/mmCIF file: 8SI6-1 +<<< Could not download PDB/mmCIF file: 8SWD-3 +<<< Could not download PDB/mmCIF file: 7WQV-3 +<<< Could not download PDB/mmCIF file: 8BPG-1 +<<< Could not download PDB/mmCIF file: 8D0P-1 +<<< Could not download PDB/mmCIF file: 8DIN-1 +<<< Could not download PDB/mmCIF file: 8E0P-2 +<<< Could not download PDB/mmCIF file: 8F2S-1 +<<< Could not download PDB/mmCIF file: 8FWW-1 +<<< Could not download PDB/mmCIF file: 8I5G-1 +<<< Could not download PDB/mmCIF file: 8SMT-3 +<<< Could not download PDB/mmCIF file: 7FSG-3 +<<< Could not download PDB/mmCIF file: 7FST-1 +<<< Could not download PDB/mmCIF file: 7FT5-3 +<<< Could not download PDB/mmCIF file: 7FV8-1 +<<< Could not download PDB/mmCIF file: 7FWM-1 +<<< Could not download PDB/mmCIF file: 7FXY-1 +<<< Could not download PDB/mmCIF file: 7FZ1-1 +<<< Could not download PDB/mmCIF file: 7G00-6 +<<< Could not download PDB/mmCIF file: 7G18-1 +<<< Could not download PDB/mmCIF file: 7G8J-1 +<<< Could not download PDB/mmCIF file: 7PN4-1 +<<< Could not download PDB/mmCIF file: 7PQK-1 +<<< Could not download PDB/mmCIF file: 7PSC-1 +<<< Could not download PDB/mmCIF file: 7QP3-1 +<<< Could not download PDB/mmCIF file: 7QQ7-1 +<<< Could not download PDB/mmCIF file: 7QRR-4 +<<< Could not download PDB/mmCIF file: 7QW4-11 +<<< Could not download PDB/mmCIF file: 7R2P-1 +<<< Could not download PDB/mmCIF file: 7RIZ-1 +<<< Could not download PDB/mmCIF file: 7S1F-2 +<<< Could not download PDB/mmCIF file: 7T2M-1 +<<< Could not download PDB/mmCIF file: 7T9R-1 +<<< Could not download PDB/mmCIF file: 7TI1-1 +<<< Could not download PDB/mmCIF file: 7TJP-3 +<<< Could not download PDB/mmCIF file: 7TN1-1 +<<< Could not download PDB/mmCIF file: 7TPK-1 +<<< Could not download PDB/mmCIF file: 7TRN-1 +<<< Could not download PDB/mmCIF file: 7TWU-1 +<<< Could not download PDB/mmCIF file: 7TXW-1 +<<< Could not download PDB/mmCIF file: 7U1B-1 +<<< Could not download PDB/mmCIF file: 7U64-5 +<<< Could not download PDB/mmCIF file: 7UAH-2 +<<< Could not download PDB/mmCIF file: 7UK8-1 +<<< Could not download PDB/mmCIF file: 7ULJ-4 +<<< Could not download PDB/mmCIF file: 7UMY-2 +<<< Could not download PDB/mmCIF file: 7UOX-2 +<<< Could not download PDB/mmCIF file: 7UQN-1 +<<< Could not download PDB/mmCIF file: 7USI-6 +<<< Could not download PDB/mmCIF file: 7WH9-1 +<<< Could not download PDB/mmCIF file: 7WJG-1 +<<< Could not download PDB/mmCIF file: 7WL2-1 +<<< Could not download PDB/mmCIF file: 7WN1-1 +<<< Could not download PDB/mmCIF file: 7WR1-4 +<<< Could not download PDB/mmCIF file: 7WSX-1 +<<< Could not download PDB/mmCIF file: 7WZM-1 +<<< Could not download PDB/mmCIF file: 7X1C-1 +<<< Could not download PDB/mmCIF file: 7X43-1 +<<< Could not download PDB/mmCIF file: 7X7Z-1 +<<< Could not download PDB/mmCIF file: 7XB6-3 +<<< Could not download PDB/mmCIF file: 7XHH-1 +<<< Could not download PDB/mmCIF file: 7XK8-1 +<<< Could not download PDB/mmCIF file: 7XQC-2 +<<< Could not download PDB/mmCIF file: 7XSB-1 +<<< Could not download PDB/mmCIF file: 7XTV-4 +<<< Could not download PDB/mmCIF file: 7XW0-2 +<<< Could not download PDB/mmCIF file: 7XXI-1 +<<< Could not download PDB/mmCIF file: 7XZ0-1 +<<< Could not download PDB/mmCIF file: 7Y0D-1 +<<< Could not download PDB/mmCIF file: 7Y36-1 +<<< Could not download PDB/mmCIF file: 7Y4X-1 +<<< Could not download PDB/mmCIF file: 7YBC-1 +<<< Could not download PDB/mmCIF file: 7YH9-2 +<<< Could not download PDB/mmCIF file: 7YLS-1 +<<< Could not download PDB/mmCIF file: 7YVF-1 +<<< Could not download PDB/mmCIF file: 7YZH-1 +<<< Could not download PDB/mmCIF file: 7Z9V-1 +<<< Could not download PDB/mmCIF file: 7ZB3-1 +<<< Could not download PDB/mmCIF file: 7ZGL-2 +<<< Could not download PDB/mmCIF file: 7ZI6-1 +<<< Could not download PDB/mmCIF file: 7ZLL-1 +<<< Could not download PDB/mmCIF file: 7ZNW-1 +<<< Could not download PDB/mmCIF file: 7ZPD-1 +<<< Could not download PDB/mmCIF file: 7ZRB-2 +<<< Could not download PDB/mmCIF file: 7ZT2-1 +<<< Could not download PDB/mmCIF file: 7ZUV-1 +<<< Could not download PDB/mmCIF file: 8A3B-1 +<<< Could not download PDB/mmCIF file: 8A4X-3 +<<< Could not download PDB/mmCIF file: 8A67-2 +<<< Could not download PDB/mmCIF file: 8A8K-5 +<<< Could not download PDB/mmCIF file: 8AA6-1 +<<< Could not download PDB/mmCIF file: 8ACQ-1 +<<< Could not download PDB/mmCIF file: 8AEP-1 +<<< Could not download PDB/mmCIF file: 8AFI-1 +<<< Could not download PDB/mmCIF file: 8AHC-2 +<<< Could not download PDB/mmCIF file: 8AJ7-1 +<<< Could not download PDB/mmCIF file: 8APU-1 +<<< Could not download PDB/mmCIF file: 8ARV-1 +<<< Could not download PDB/mmCIF file: 8AUN-1 +<<< Could not download PDB/mmCIF file: 8AWD-1 +<<< Could not download PDB/mmCIF file: 8AYO-1 +<<< Could not download PDB/mmCIF file: 8B1O-1 +<<< Could not download PDB/mmCIF file: 8B5B-1 +<<< Could not download PDB/mmCIF file: 8B8E-1 +<<< Could not download PDB/mmCIF file: 8BAB-1 +<<< Could not download PDB/mmCIF file: 8BDI-3 +<<< Could not download PDB/mmCIF file: 8BF2-1 +<<< Could not download PDB/mmCIF file: 8BGY-1 +<<< Could not download PDB/mmCIF file: 8BIJ-1 +<<< Could not download PDB/mmCIF file: 8BLS-2 +<<< Could not download PDB/mmCIF file: 8BQF-4 +<<< Could not download PDB/mmCIF file: 8BSN-1 +<<< Could not download PDB/mmCIF file: 8BX7-1 +<<< Could not download PDB/mmCIF file: 8C19-2 +<<< Could not download PDB/mmCIF file: 8C6G-2 +<<< Could not download PDB/mmCIF file: 8CAR-1 +<<< Could not download PDB/mmCIF file: 8CEJ-2 +<<< Could not download PDB/mmCIF file: 8CJ0-1 +<<< Could not download PDB/mmCIF file: 8CQY-1 +<<< Could not download PDB/mmCIF file: 8CTM-1 +<<< Could not download PDB/mmCIF file: 8CV5-1 +<<< Could not download PDB/mmCIF file: 8D0A-1 +<<< Could not download PDB/mmCIF file: 8D7N-1 +<<< Could not download PDB/mmCIF file: 8DD5-1 +<<< Could not download PDB/mmCIF file: 8DEI-2 +<<< Could not download PDB/mmCIF file: 8DGO-1 +<<< Could not download PDB/mmCIF file: 8DIF-1 +<<< Could not download PDB/mmCIF file: 8DKB-1 +<<< Could not download PDB/mmCIF file: 8DQV-1 +<<< Could not download PDB/mmCIF file: 8DTN-1 +<<< Could not download PDB/mmCIF file: 8DVC-4 +<<< Could not download PDB/mmCIF file: 8E1U-1 +<<< Could not download PDB/mmCIF file: 8E4K-1 +<<< Could not download PDB/mmCIF file: 8E7A-1 +<<< Could not download PDB/mmCIF file: 8EEO-2 +<<< Could not download PDB/mmCIF file: 8EHP-2 +<<< Could not download PDB/mmCIF file: 8ELB-1 +<<< Could not download PDB/mmCIF file: 8EOJ-1 +<<< Could not download PDB/mmCIF file: 8EQR-1 +<<< Could not download PDB/mmCIF file: 8EU9-1 +<<< Could not download PDB/mmCIF file: 8EX1-1 +<<< Could not download PDB/mmCIF file: 8EZ4-1 +<<< Could not download PDB/mmCIF file: 8F1G-2 +<<< Could not download PDB/mmCIF file: 8F57-1 +<<< Could not download PDB/mmCIF file: 8FDT-1 +<<< Could not download PDB/mmCIF file: 8FHN-1 +<<< Could not download PDB/mmCIF file: 8FLY-3 +<<< Could not download PDB/mmCIF file: 8FNS-1 +<<< Could not download PDB/mmCIF file: 8FQW-1 +<<< Could not download PDB/mmCIF file: 8FW1-1 +<<< Could not download PDB/mmCIF file: 8G0K-2 +<<< Could not download PDB/mmCIF file: 8G4U-1 +<<< Could not download PDB/mmCIF file: 8GAR-1 +<<< Could not download PDB/mmCIF file: 8GFK-1 +<<< Could not download PDB/mmCIF file: 8GM9-1 +<<< Could not download PDB/mmCIF file: 8GPY-1 +<<< Could not download PDB/mmCIF file: 8GSQ-1 +<<< Could not download PDB/mmCIF file: 8GV0-1 +<<< Could not download PDB/mmCIF file: 8GZE-2 +<<< Could not download PDB/mmCIF file: 8H3M-1 +<<< Could not download PDB/mmCIF file: 8H8B-1 +<<< Could not download PDB/mmCIF file: 8HHK-2 +<<< Could not download PDB/mmCIF file: 8HLZ-1 +<<< Could not download PDB/mmCIF file: 8HUU-1 +<<< Could not download PDB/mmCIF file: 8I1N-2 +<<< Could not download PDB/mmCIF file: 8I69-1 +<<< Could not download PDB/mmCIF file: 8IBI-1 +<<< Could not download PDB/mmCIF file: 8IIF-1 +<<< Could not download PDB/mmCIF file: 8IQ7-1 +<<< Could not download PDB/mmCIF file: 8J6V-4 +<<< Could not download PDB/mmCIF file: 8OF9-2 +<<< Could not download PDB/mmCIF file: 8OO3-1 +<<< Could not download PDB/mmCIF file: 8OVN-1 +<<< Could not download PDB/mmCIF file: 8P7J-2 +<<< Could not download PDB/mmCIF file: 8SAD-1 +<<< Could not download PDB/mmCIF file: 8SI7-1 +<<< Could not download PDB/mmCIF file: 8SWD-4 +<<< Could not download PDB/mmCIF file: 7RD2-1 +<<< Could not download PDB/mmCIF file: 7WQV-4 +<<< Could not download PDB/mmCIF file: 8AM1-1 +<<< Could not download PDB/mmCIF file: 8D0Q-1 +<<< Could not download PDB/mmCIF file: 8DIR-1 +<<< Could not download PDB/mmCIF file: 8E0P-3 +<<< Could not download PDB/mmCIF file: 8F60-1 +<<< Could not download PDB/mmCIF file: 8G18-1 +<<< Could not download PDB/mmCIF file: 8I5P-1 +<<< Could not download PDB/mmCIF file: 8SMT-4 +<<< Could not download PDB/mmCIF file: 7FSG-4 +<<< Could not download PDB/mmCIF file: 7FST-2 +<<< Could not download PDB/mmCIF file: 7FT5-4 +<<< Could not download PDB/mmCIF file: 7FV9-1 +<<< Could not download PDB/mmCIF file: 7FWN-1 +<<< Could not download PDB/mmCIF file: 7FXZ-1 +<<< Could not download PDB/mmCIF file: 7FZ2-1 +<<< Could not download PDB/mmCIF file: 7G00-7 +<<< Could not download PDB/mmCIF file: 7G19-1 +<<< Could not download PDB/mmCIF file: 7G8K-1 +<<< Could not download PDB/mmCIF file: 7PN5-1 +<<< Could not download PDB/mmCIF file: 7PZQ-1 +<<< Could not download PDB/mmCIF file: 7Q98-1 +<<< Could not download PDB/mmCIF file: 7QAR-1 +<<< Could not download PDB/mmCIF file: 7QU9-1 +<<< Could not download PDB/mmCIF file: 7QW4-12 +<<< Could not download PDB/mmCIF file: 7R1M-1 +<<< Could not download PDB/mmCIF file: 7R2P-2 +<<< Could not download PDB/mmCIF file: 7R5M-1 +<<< Could not download PDB/mmCIF file: 7S1L-1 +<<< Could not download PDB/mmCIF file: 7T2M-2 +<<< Could not download PDB/mmCIF file: 7T9R-2 +<<< Could not download PDB/mmCIF file: 7TJP-4 +<<< Could not download PDB/mmCIF file: 7TPM-1 +<<< Could not download PDB/mmCIF file: 7TRN-2 +<<< Could not download PDB/mmCIF file: 7TXY-1 +<<< Could not download PDB/mmCIF file: 7U1C-1 +<<< Could not download PDB/mmCIF file: 7U64-6 +<<< Could not download PDB/mmCIF file: 7UAK-1 +<<< Could not download PDB/mmCIF file: 7UCC-1 +<<< Could not download PDB/mmCIF file: 7UKA-1 +<<< Could not download PDB/mmCIF file: 7ULK-1 +<<< Could not download 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+<<< Could not download PDB/mmCIF file: 8AJ7-2 +<<< Could not download PDB/mmCIF file: 8AN9-1 +<<< Could not download PDB/mmCIF file: 8APV-1 +<<< Could not download PDB/mmCIF file: 8AS2-1 +<<< Could not download PDB/mmCIF file: 8AUN-2 +<<< Could not download PDB/mmCIF file: 8AWE-1 +<<< Could not download PDB/mmCIF file: 8AYP-1 +<<< Could not download PDB/mmCIF file: 8B1P-1 +<<< Could not download PDB/mmCIF file: 8B5B-2 +<<< Could not download PDB/mmCIF file: 8B8E-2 +<<< Could not download PDB/mmCIF file: 8BAC-1 +<<< Could not download PDB/mmCIF file: 8BDI-4 +<<< Could not download PDB/mmCIF file: 8BF2-2 +<<< Could not download PDB/mmCIF file: 8BGY-2 +<<< Could not download PDB/mmCIF file: 8BLT-1 +<<< Could not download PDB/mmCIF file: 8BQF-5 +<<< Could not download PDB/mmCIF file: 8BXA-1 +<<< Could not download PDB/mmCIF file: 8C1A-1 +<<< Could not download PDB/mmCIF file: 8C6O-1 +<<< Could not download PDB/mmCIF file: 8CEJ-3 +<<< Could not download PDB/mmCIF file: 8CJ2-1 +<<< Could not download PDB/mmCIF file: 8CR0-1 +<<< Could not download PDB/mmCIF file: 8CTP-1 +<<< Could not download PDB/mmCIF file: 8CV6-1 +<<< Could not download PDB/mmCIF file: 8CYH-1 +<<< Could not download PDB/mmCIF file: 8D51-1 +<<< Could not download PDB/mmCIF file: 8D7N-2 +<<< Could not download PDB/mmCIF file: 8DD7-1 +<<< Could not download PDB/mmCIF file: 8DEI-3 +<<< Could not download PDB/mmCIF file: 8DGP-1 +<<< Could not download PDB/mmCIF file: 8DIG-1 +<<< Could not download PDB/mmCIF file: 8DKB-2 +<<< Could not download PDB/mmCIF file: 8DTN-2 +<<< Could not download PDB/mmCIF file: 8DVC-5 +<<< Could not download PDB/mmCIF file: 8E1U-2 +<<< Could not download PDB/mmCIF file: 8E4K-2 +<<< Could not download PDB/mmCIF file: 8E7B-1 +<<< Could not download PDB/mmCIF file: 8EHR-1 +<<< Could not download PDB/mmCIF file: 8ELB-2 +<<< Could not download PDB/mmCIF file: 8EOL-1 +<<< Could not download PDB/mmCIF file: 8EQR-2 +<<< Could not download PDB/mmCIF file: 8EUA-1 +<<< Could not download 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file: 8H8C-1 +<<< Could not download PDB/mmCIF file: 8HHO-1 +<<< Could not download PDB/mmCIF file: 8HM0-1 +<<< Could not download PDB/mmCIF file: 8HUV-1 +<<< Could not download PDB/mmCIF file: 8I1O-1 +<<< Could not download PDB/mmCIF file: 8I6A-1 +<<< Could not download PDB/mmCIF file: 8IBI-2 +<<< Could not download PDB/mmCIF file: 8IIG-1 +<<< Could not download PDB/mmCIF file: 8IQ7-2 +<<< Could not download PDB/mmCIF file: 8J6V-5 +<<< Could not download PDB/mmCIF file: 8OFB-1 +<<< Could not download PDB/mmCIF file: 8OO4-1 +<<< Could not download PDB/mmCIF file: 8OVO-1 +<<< Could not download PDB/mmCIF file: 8P7K-1 +<<< Could not download PDB/mmCIF file: 8SAE-1 +<<< Could not download PDB/mmCIF file: 8SI8-1 +<<< Could not download PDB/mmCIF file: 8SX4-1 +<<< Could not download PDB/mmCIF file: 7RD2-2 +<<< Could not download PDB/mmCIF file: 7SPR-1 +<<< Could not download PDB/mmCIF file: 7WQV-5 +<<< Could not download PDB/mmCIF file: 8AM2-1 +<<< Could not download PDB/mmCIF file: 8BXY-1 +<<< Could not download PDB/mmCIF file: 8D0R-1 +<<< Could not download PDB/mmCIF file: 8E0P-4 +<<< Could not download PDB/mmCIF file: 8F6P-1 +<<< Could not download PDB/mmCIF file: 8G18-2 +<<< Could not download PDB/mmCIF file: 8I5P-2 +<<< Could not download PDB/mmCIF file: 7FSH-1 +<<< Could not download PDB/mmCIF file: 7FST-3 +<<< Could not download PDB/mmCIF file: 7FT6-1 +<<< Could not download PDB/mmCIF file: 7FVA-1 +<<< Could not download PDB/mmCIF file: 7FWO-1 +<<< Could not download PDB/mmCIF file: 7FY0-1 +<<< Could not download PDB/mmCIF file: 7FZ3-1 +<<< Could not download PDB/mmCIF file: 7G00-8 +<<< Could not download PDB/mmCIF file: 7G1A-1 +<<< Could not download PDB/mmCIF file: 7G8L-1 +<<< Could not download PDB/mmCIF file: 7PN6-1 +<<< Could not download PDB/mmCIF file: 7Q98-2 +<<< Could not download PDB/mmCIF file: 7QP5-1 +<<< Could not download PDB/mmCIF file: 7QU9-2 +<<< Could not download PDB/mmCIF file: 7QW4-13 +<<< Could not download PDB/mmCIF file: 7QZX-1 +<<< Could not download PDB/mmCIF file: 7R1N-1 +<<< Could not download PDB/mmCIF file: 7R2R-1 +<<< Could not download PDB/mmCIF file: 7R3T-1 +<<< Could not download PDB/mmCIF file: 7S1L-2 +<<< Could not download PDB/mmCIF file: 7T9R-3 +<<< Could not download PDB/mmCIF file: 7TRP-1 +<<< Could not download PDB/mmCIF file: 7TU9-1 +<<< Could not download PDB/mmCIF file: 7TXY-2 +<<< Could not download PDB/mmCIF file: 7U64-7 +<<< Could not download PDB/mmCIF file: 7UCD-1 +<<< Could not download PDB/mmCIF file: 7UKB-1 +<<< Could not download PDB/mmCIF file: 7ULK-2 +<<< Could not download PDB/mmCIF file: 7UOY-2 +<<< Could not download PDB/mmCIF file: 7UQU-1 +<<< Could not download PDB/mmCIF file: 7USJ-2 +<<< Could not download PDB/mmCIF file: 7UWU-2 +<<< Could not download PDB/mmCIF file: 7UY4-2 +<<< Could not download PDB/mmCIF file: 7WHA-2 +<<< Could not download PDB/mmCIF file: 7WN2-2 +<<< Could not download PDB/mmCIF file: 7WR4-1 +<<< Could not download PDB/mmCIF file: 7WZU-1 +<<< Could not download 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file: 7ZPF-2 +<<< Could not download PDB/mmCIF file: 7ZT4-1 +<<< Could not download PDB/mmCIF file: 7ZUV-3 +<<< Could not download PDB/mmCIF file: 7ZYB-1 +<<< Could not download PDB/mmCIF file: 8A23-1 +<<< Could not download PDB/mmCIF file: 8A6F-1 +<<< Could not download PDB/mmCIF file: 8A8L-1 +<<< Could not download PDB/mmCIF file: 8AA8-1 +<<< Could not download PDB/mmCIF file: 8AER-1 +<<< Could not download PDB/mmCIF file: 8AFI-3 +<<< Could not download PDB/mmCIF file: 8AJI-1 +<<< Could not download PDB/mmCIF file: 8ANO-1 +<<< Could not download PDB/mmCIF file: 8APW-1 +<<< Could not download PDB/mmCIF file: 8AS3-1 +<<< Could not download PDB/mmCIF file: 8AUO-1 +<<< Could not download PDB/mmCIF file: 8AWF-1 +<<< Could not download PDB/mmCIF file: 8AYP-2 +<<< Could not download PDB/mmCIF file: 8B5B-3 +<<< Could not download PDB/mmCIF file: 8B8E-3 +<<< Could not download PDB/mmCIF file: 8BC2-1 +<<< Could not download PDB/mmCIF file: 8BDJ-1 +<<< Could not download PDB/mmCIF file: 8BF4-1 +<<< Could not download PDB/mmCIF file: 8BGZ-1 +<<< Could not download PDB/mmCIF file: 8BLT-2 +<<< Could not download PDB/mmCIF file: 8BQF-6 +<<< Could not download PDB/mmCIF file: 8BXF-1 +<<< Could not download PDB/mmCIF file: 8C1A-2 +<<< Could not download PDB/mmCIF file: 8C6O-2 +<<< Could not download PDB/mmCIF file: 8CAV-1 +<<< Could not download PDB/mmCIF file: 8CEK-1 +<<< Could not download PDB/mmCIF file: 8CJ3-1 +<<< Could not download PDB/mmCIF file: 8CR3-1 +<<< Could not download PDB/mmCIF file: 8CTQ-1 +<<< Could not download PDB/mmCIF file: 8CV7-1 +<<< Could not download PDB/mmCIF file: 8CYI-1 +<<< Could not download PDB/mmCIF file: 8D2S-1 +<<< Could not download PDB/mmCIF file: 8D52-1 +<<< Could not download PDB/mmCIF file: 8D7O-1 +<<< Could not download PDB/mmCIF file: 8DEI-4 +<<< Could not download PDB/mmCIF file: 8DGP-2 +<<< Could not download PDB/mmCIF file: 8DIH-1 +<<< Could not download PDB/mmCIF file: 8DKB-3 +<<< Could not download PDB/mmCIF file: 8DTN-3 +<<< Could not download PDB/mmCIF file: 8E0E-1 +<<< Could not download PDB/mmCIF file: 8E1U-3 +<<< Could not download PDB/mmCIF file: 8E7B-2 +<<< Could not download PDB/mmCIF file: 8ECF-1 +<<< Could not download PDB/mmCIF file: 8EHS-1 +<<< Could not download PDB/mmCIF file: 8ELC-1 +<<< Could not download PDB/mmCIF file: 8EOM-1 +<<< Could not download PDB/mmCIF file: 8EQR-3 +<<< Could not download PDB/mmCIF file: 8EUD-1 +<<< Could not download PDB/mmCIF file: 8EX3-1 +<<< Could not download PDB/mmCIF file: 8EZD-1 +<<< Could not download PDB/mmCIF file: 8F24-1 +<<< Could not download PDB/mmCIF file: 8F5D-1 +<<< Could not download PDB/mmCIF file: 8F7U-2 +<<< Could not download PDB/mmCIF file: 8FBG-1 +<<< Could not download PDB/mmCIF file: 8FDX-1 +<<< Could not download PDB/mmCIF file: 8FHP-1 +<<< Could not download PDB/mmCIF file: 8FLZ-1 +<<< Could not download PDB/mmCIF file: 8FNU-1 +<<< Could not download PDB/mmCIF file: 8FQX-1 +<<< Could not download PDB/mmCIF file: 8FW1-3 +<<< Could not download 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file: 8OVP-1 +<<< Could not download PDB/mmCIF file: 8P82-1 +<<< Could not download PDB/mmCIF file: 8SAH-1 +<<< Could not download PDB/mmCIF file: 8SIA-1 +<<< Could not download PDB/mmCIF file: 8SX4-2 +<<< Could not download PDB/mmCIF file: 7RDG-1 +<<< Could not download PDB/mmCIF file: 7WQV-6 +<<< Could not download PDB/mmCIF file: 7Y76-1 +<<< Could not download PDB/mmCIF file: 8BXY-2 +<<< Could not download PDB/mmCIF file: 8D0S-1 +<<< Could not download PDB/mmCIF file: 8DJ7-1 +<<< Could not download PDB/mmCIF file: 8E15-1 +<<< Could not download PDB/mmCIF file: 8F6Y-1 +<<< Could not download PDB/mmCIF file: 8G1A-1 +<<< Could not download PDB/mmCIF file: 8I5Q-1 +<<< Could not download PDB/mmCIF file: 7FSH-2 +<<< Could not download PDB/mmCIF file: 7FST-4 +<<< Could not download PDB/mmCIF file: 7FT6-2 +<<< Could not download PDB/mmCIF file: 7FVB-1 +<<< Could not download PDB/mmCIF file: 7FWP-1 +<<< Could not download PDB/mmCIF file: 7FY1-1 +<<< Could not download PDB/mmCIF file: 7FZ4-1 +<<< Could not download PDB/mmCIF file: 7G00-9 +<<< Could not download PDB/mmCIF file: 7G1B-1 +<<< Could not download PDB/mmCIF file: 7G8M-1 +<<< Could not download PDB/mmCIF file: 7PDO-1 +<<< Could not download PDB/mmCIF file: 7PN7-1 +<<< Could not download PDB/mmCIF file: 7Q98-3 +<<< Could not download PDB/mmCIF file: 7QNR-1 +<<< Could not download PDB/mmCIF file: 7QP5-2 +<<< Could not download PDB/mmCIF file: 7QU9-3 +<<< Could not download PDB/mmCIF file: 7QW4-14 +<<< Could not download PDB/mmCIF file: 7QZY-1 +<<< Could not download PDB/mmCIF file: 7R2R-2 +<<< Could not download PDB/mmCIF file: 7R3U-1 +<<< Could not download PDB/mmCIF file: 7SZR-1 +<<< Could not download PDB/mmCIF file: 7T4F-1 +<<< Could not download PDB/mmCIF file: 7T9R-4 +<<< Could not download PDB/mmCIF file: 7TRQ-1 +<<< Could not download PDB/mmCIF file: 7TUA-1 +<<< Could not download PDB/mmCIF file: 7TXY-3 +<<< Could not download PDB/mmCIF file: 7U64-8 +<<< Could not download PDB/mmCIF file: 7U8S-1 +<<< Could not download PDB/mmCIF file: 7UJ2-1 +<<< Could not download PDB/mmCIF file: 7ULL-1 +<<< Could not download PDB/mmCIF file: 7UP1-1 +<<< Could not download PDB/mmCIF file: 7UQU-2 +<<< Could not download PDB/mmCIF file: 7USK-1 +<<< Could not download PDB/mmCIF file: 7UYA-1 +<<< Could not download PDB/mmCIF file: 7V0B-1 +<<< Could not download PDB/mmCIF file: 7WJK-1 +<<< Could not download PDB/mmCIF file: 7WPG-1 +<<< Could not download PDB/mmCIF file: 7WR5-1 +<<< Could not download PDB/mmCIF file: 7WZU-2 +<<< Could not download PDB/mmCIF file: 7X48-1 +<<< Could not download PDB/mmCIF file: 7X81-1 +<<< Could not download PDB/mmCIF file: 7XBC-1 +<<< Could not download PDB/mmCIF file: 7XDG-1 +<<< Could not download PDB/mmCIF file: 7XEP-1 +<<< Could not download PDB/mmCIF file: 7XHL-1 +<<< Could not download PDB/mmCIF file: 7XKA-1 +<<< Could not download PDB/mmCIF file: 7XON-1 +<<< Could not download PDB/mmCIF file: 7XQK-1 +<<< Could not download PDB/mmCIF file: 7XSB-4 +<<< Could not download 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+<<< Could not download PDB/mmCIF file: 8BQG-1 +<<< Could not download PDB/mmCIF file: 8BXK-1 +<<< Could not download PDB/mmCIF file: 8C1N-1 +<<< Could not download PDB/mmCIF file: 8C6P-1 +<<< Could not download PDB/mmCIF file: 8CBH-1 +<<< Could not download PDB/mmCIF file: 8CEK-2 +<<< Could not download PDB/mmCIF file: 8CJD-1 +<<< Could not download PDB/mmCIF file: 8CR4-1 +<<< Could not download PDB/mmCIF file: 8CV7-2 +<<< Could not download PDB/mmCIF file: 8D2T-1 +<<< Could not download PDB/mmCIF file: 8D6H-1 +<<< Could not download PDB/mmCIF file: 8D7O-2 +<<< Could not download PDB/mmCIF file: 8DII-1 +<<< Could not download PDB/mmCIF file: 8DKB-4 +<<< Could not download PDB/mmCIF file: 8DM6-1 +<<< Could not download PDB/mmCIF file: 8DNV-1 +<<< Could not download PDB/mmCIF file: 8DP8-1 +<<< Could not download PDB/mmCIF file: 8DTN-4 +<<< Could not download PDB/mmCIF file: 8E1U-4 +<<< Could not download PDB/mmCIF file: 8E7C-1 +<<< Could not download PDB/mmCIF file: 8EHT-1 +<<< Could not download PDB/mmCIF file: 8ELE-1 +<<< Could not download PDB/mmCIF file: 8EOO-1 +<<< Could not download PDB/mmCIF file: 8EQR-4 +<<< Could not download PDB/mmCIF file: 8EUD-2 +<<< Could not download PDB/mmCIF file: 8EX4-1 +<<< Could not download PDB/mmCIF file: 8EZE-1 +<<< Could not download PDB/mmCIF file: 8F28-1 +<<< Could not download PDB/mmCIF file: 8F5F-1 +<<< Could not download PDB/mmCIF file: 8F7V-1 +<<< Could not download PDB/mmCIF file: 8FBG-2 +<<< Could not download PDB/mmCIF file: 8FDY-1 +<<< Could not download PDB/mmCIF file: 8FHQ-1 +<<< Could not download PDB/mmCIF file: 8FLZ-2 +<<< Could not download PDB/mmCIF file: 8FNY-1 +<<< Could not download PDB/mmCIF file: 8FQY-1 +<<< Could not download PDB/mmCIF file: 8FWA-2 +<<< Could not download PDB/mmCIF file: 8G0Q-1 +<<< Could not download PDB/mmCIF file: 8G52-1 +<<< Could not download PDB/mmCIF file: 8GB2-1 +<<< Could not download PDB/mmCIF file: 8GFN-1 +<<< Could not download PDB/mmCIF file: 8GMC-2 +<<< Could not download 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file: 7RDG-2 +<<< Could not download PDB/mmCIF file: 7WQV-7 +<<< Could not download PDB/mmCIF file: 7Y9A-1 +<<< Could not download PDB/mmCIF file: 8AQU-1 +<<< Could not download PDB/mmCIF file: 8BY3-1 +<<< Could not download PDB/mmCIF file: 8D0U-1 +<<< Could not download PDB/mmCIF file: 8DK6-1 +<<< Could not download PDB/mmCIF file: 8F6Z-1 +<<< Could not download PDB/mmCIF file: 8G24-1 +<<< Could not download PDB/mmCIF file: 8I5Q-2 +<<< Could not download PDB/mmCIF file: 7FSH-3 +<<< Could not download PDB/mmCIF file: 7FSU-1 +<<< Could not download PDB/mmCIF file: 7FT6-3 +<<< Could not download PDB/mmCIF file: 7FVC-1 +<<< Could not download PDB/mmCIF file: 7FWQ-1 +<<< Could not download PDB/mmCIF file: 7FY2-1 +<<< Could not download PDB/mmCIF file: 7FZ5-1 +<<< Could not download PDB/mmCIF file: 7G01-1 +<<< Could not download PDB/mmCIF file: 7G1C-1 +<<< Could not download PDB/mmCIF file: 7G8N-1 +<<< Could not download PDB/mmCIF file: 7PN8-1 +<<< Could not download PDB/mmCIF file: 7Q98-4 +<<< Could not download PDB/mmCIF file: 7QNS-1 +<<< Could not download PDB/mmCIF file: 7QT2-1 +<<< Could not download PDB/mmCIF file: 7QW4-15 +<<< Could not download PDB/mmCIF file: 7R2S-1 +<<< Could not download PDB/mmCIF file: 7R3U-2 +<<< Could not download PDB/mmCIF file: 7SKD-1 +<<< Could not download PDB/mmCIF file: 7SXF-1 +<<< Could not download PDB/mmCIF file: 7SZR-2 +<<< Could not download PDB/mmCIF file: 7TAI-1 +<<< Could not download PDB/mmCIF file: 7TLV-1 +<<< Could not download PDB/mmCIF file: 7TRR-1 +<<< Could not download PDB/mmCIF file: 7TSQ-1 +<<< Could not download PDB/mmCIF file: 7TXY-4 +<<< Could not download PDB/mmCIF file: 7TZL-1 +<<< Could not download PDB/mmCIF file: 7U4W-1 +<<< Could not download PDB/mmCIF file: 7U64-9 +<<< Could not download PDB/mmCIF file: 7UJ3-1 +<<< Could not download PDB/mmCIF file: 7ULL-2 +<<< Could not download PDB/mmCIF file: 7UP1-2 +<<< Could not download PDB/mmCIF file: 7UYB-1 +<<< Could not download PDB/mmCIF file: 7V0B-2 +<<< Could not download PDB/mmCIF file: 7WJL-1 +<<< Could not download PDB/mmCIF file: 7WR6-1 +<<< Could not download PDB/mmCIF file: 7WZU-3 +<<< Could not download PDB/mmCIF file: 7X4A-1 +<<< Could not download PDB/mmCIF file: 7XEQ-1 +<<< Could not download PDB/mmCIF file: 7XHL-2 +<<< Could not download PDB/mmCIF file: 7XKA-2 +<<< Could not download PDB/mmCIF file: 7XOO-1 +<<< Could not download PDB/mmCIF file: 7XQL-1 +<<< Could not download PDB/mmCIF file: 7XSC-1 +<<< Could not download PDB/mmCIF file: 7XTY-2 +<<< Could not download PDB/mmCIF file: 7XXM-1 +<<< Could not download PDB/mmCIF file: 7XZ3-2 +<<< Could not download PDB/mmCIF file: 7Y9G-1 +<<< Could not download PDB/mmCIF file: 7YBR-1 +<<< Could not download PDB/mmCIF file: 7YDL-2 +<<< Could not download PDB/mmCIF file: 7YH9-6 +<<< Could not download PDB/mmCIF file: 7YLT-4 +<<< Could not download PDB/mmCIF file: 7YNX-2 +<<< Could not download PDB/mmCIF file: 7YQN-1 +<<< Could not download PDB/mmCIF file: 7YVM-1 +<<< Could not download 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file: 8AYQ-2 +<<< Could not download PDB/mmCIF file: 8B8E-5 +<<< Could not download PDB/mmCIF file: 8BC4-1 +<<< Could not download PDB/mmCIF file: 8BDJ-3 +<<< Could not download PDB/mmCIF file: 8BF6-1 +<<< Could not download PDB/mmCIF file: 8BH0-1 +<<< Could not download PDB/mmCIF file: 8BIS-1 +<<< Could not download PDB/mmCIF file: 8BQH-1 +<<< Could not download PDB/mmCIF file: 8BXK-2 +<<< Could not download PDB/mmCIF file: 8C23-1 +<<< Could not download PDB/mmCIF file: 8C6Q-1 +<<< Could not download PDB/mmCIF file: 8CBH-2 +<<< Could not download PDB/mmCIF file: 8CEK-3 +<<< Could not download PDB/mmCIF file: 8CJD-2 +<<< Could not download PDB/mmCIF file: 8CR7-1 +<<< Could not download PDB/mmCIF file: 8CVN-1 +<<< Could not download PDB/mmCIF file: 8D2U-1 +<<< Could not download PDB/mmCIF file: 8D6I-1 +<<< Could not download PDB/mmCIF file: 8D7P-1 +<<< Could not download PDB/mmCIF file: 8DDA-1 +<<< Could not download PDB/mmCIF file: 8DKB-5 +<<< Could not download PDB/mmCIF file: 8DM8-1 +<<< Could not download PDB/mmCIF file: 8DNW-1 +<<< Could not download PDB/mmCIF file: 8DP8-2 +<<< Could not download PDB/mmCIF file: 8DTN-5 +<<< Could not download PDB/mmCIF file: 8DVQ-1 +<<< Could not download PDB/mmCIF file: 8E7F-1 +<<< Could not download PDB/mmCIF file: 8EHU-1 +<<< Could not download PDB/mmCIF file: 8ELE-2 +<<< Could not download PDB/mmCIF file: 8EOO-2 +<<< Could not download PDB/mmCIF file: 8EQS-1 +<<< Could not download PDB/mmCIF file: 8EUF-1 +<<< Could not download PDB/mmCIF file: 8EX5-1 +<<< Could not download PDB/mmCIF file: 8EZF-1 +<<< Could not download PDB/mmCIF file: 8F2E-1 +<<< Could not download PDB/mmCIF file: 8F5F-2 +<<< Could not download PDB/mmCIF file: 8F7V-2 +<<< Could not download PDB/mmCIF file: 8FBH-1 +<<< Could not download PDB/mmCIF file: 8FDZ-1 +<<< Could not download PDB/mmCIF file: 8FHR-1 +<<< Could not download PDB/mmCIF file: 8FLZ-3 +<<< Could not download PDB/mmCIF file: 8FNY-2 +<<< Could not download PDB/mmCIF file: 8FQZ-1 +<<< Could not download PDB/mmCIF file: 8FWK-1 +<<< Could not download PDB/mmCIF file: 8G0Q-2 +<<< Could not download PDB/mmCIF file: 8G52-2 +<<< Could not download PDB/mmCIF file: 8GB2-2 +<<< Could not download PDB/mmCIF file: 8GFO-1 +<<< Could not download PDB/mmCIF file: 8GMD-1 +<<< Could not download PDB/mmCIF file: 8GQ9-1 +<<< Could not download PDB/mmCIF file: 8GSQ-5 +<<< Could not download PDB/mmCIF file: 8GV1-1 +<<< Could not download PDB/mmCIF file: 8H02-1 +<<< Could not download PDB/mmCIF file: 8H3Y-1 +<<< Could not download PDB/mmCIF file: 8HDJ-1 +<<< Could not download PDB/mmCIF file: 8HI4-1 +<<< Could not download PDB/mmCIF file: 8HMR-1 +<<< Could not download PDB/mmCIF file: 8HUY-1 +<<< Could not download PDB/mmCIF file: 8I1W-1 +<<< Could not download PDB/mmCIF file: 8I6D-1 +<<< Could not download PDB/mmCIF file: 8IBL-2 +<<< Could not download PDB/mmCIF file: 8IIJ-1 +<<< Could not download PDB/mmCIF file: 8IRS-1 +<<< Could not download PDB/mmCIF file: 8J6V-8 +<<< Could not download PDB/mmCIF file: 8OFH-1 +<<< Could not download PDB/mmCIF file: 8OOG-1 +<<< Could not download PDB/mmCIF file: 8OVZ-1 +<<< Could not download PDB/mmCIF file: 8P9F-1 +<<< Could not download PDB/mmCIF file: 8SBI-2 +<<< Could not download PDB/mmCIF file: 8SIK-1 +<<< Could not download PDB/mmCIF file: 8SZA-1 +<<< Could not download PDB/mmCIF file: 7N8D-1 +<<< Could not download PDB/mmCIF file: 7URU-1 +<<< Could not download PDB/mmCIF file: 7WQV-8 +<<< Could not download PDB/mmCIF file: 8AQV-1 +<<< Could not download PDB/mmCIF file: 8BY3-2 +<<< Could not download PDB/mmCIF file: 8D0W-1 +<<< Could not download PDB/mmCIF file: 8F8W-1 +<<< Could not download PDB/mmCIF file: 8G26-1 +<<< Could not download PDB/mmCIF file: 8I5T-1 +<<< Could not download PDB/mmCIF file: 6NAK-1 +<<< Could not download PDB/mmCIF file: 7FSH-4 +<<< Could not download PDB/mmCIF file: 7FSU-2 +<<< Could not download PDB/mmCIF file: 7FT6-4 +<<< Could not download PDB/mmCIF file: 7FVD-1 +<<< Could not download PDB/mmCIF file: 7FWR-1 +<<< Could not download PDB/mmCIF file: 7FY3-1 +<<< Could not download PDB/mmCIF file: 7FZ6-1 +<<< Could not download PDB/mmCIF file: 7G02-1 +<<< Could not download PDB/mmCIF file: 7G1D-1 +<<< Could not download PDB/mmCIF file: 7G8O-1 +<<< Could not download PDB/mmCIF file: 7MX9-1 +<<< Could not download PDB/mmCIF file: 7PN9-1 +<<< Could not download PDB/mmCIF file: 7PXZ-1 +<<< Could not download PDB/mmCIF file: 7Q4H-1 +<<< Could not download PDB/mmCIF file: 7Q8E-1 +<<< Could not download PDB/mmCIF file: 7Q98-5 +<<< Could not download PDB/mmCIF file: 7QLB-1 +<<< Could not download PDB/mmCIF file: 7QNS-2 +<<< Could not download PDB/mmCIF file: 7QQE-1 +<<< Could not download PDB/mmCIF file: 7QT2-2 +<<< Could not download PDB/mmCIF file: 7QW4-16 +<<< Could not download PDB/mmCIF file: 7R2S-2 +<<< Could not download PDB/mmCIF file: 7R3U-3 +<<< Could not download PDB/mmCIF file: 7SKE-1 +<<< Could not download PDB/mmCIF file: 7SXG-1 +<<< Could not download PDB/mmCIF file: 7TAK-1 +<<< Could not download PDB/mmCIF file: 7TLW-1 +<<< Could not download PDB/mmCIF file: 7TRS-1 +<<< Could not download PDB/mmCIF file: 7TXY-5 +<<< Could not download PDB/mmCIF file: 7TZM-1 +<<< Could not download PDB/mmCIF file: 7U4Z-1 +<<< Could not download PDB/mmCIF file: 7U68-1 +<<< Could not download PDB/mmCIF file: 7U8Y-1 +<<< Could not download PDB/mmCIF file: 7UE1-1 +<<< Could not download PDB/mmCIF file: 7UGV-1 +<<< Could not download PDB/mmCIF file: 7UP2-1 +<<< Could not download PDB/mmCIF file: 7UYC-1 +<<< Could not download PDB/mmCIF file: 7V0D-1 +<<< Could not download PDB/mmCIF file: 7WVS-1 +<<< Could not download PDB/mmCIF file: 7WZU-4 +<<< Could not download PDB/mmCIF file: 7X9D-1 +<<< Could not download PDB/mmCIF file: 7XBE-1 +<<< Could not download PDB/mmCIF file: 7XHM-1 +<<< Could not download PDB/mmCIF file: 7XOP-1 +<<< Could not download PDB/mmCIF file: 7XQL-2 +<<< Could not download PDB/mmCIF file: 7XSC-2 +<<< Could not download PDB/mmCIF file: 7XXM-2 +<<< Could not download PDB/mmCIF file: 7Y0K-1 +<<< Could not download PDB/mmCIF file: 7Y7V-1 +<<< Could not download PDB/mmCIF file: 7Y9H-1 +<<< Could not download PDB/mmCIF file: 7YDM-1 +<<< Could not download PDB/mmCIF file: 7YHA-1 +<<< Could not download PDB/mmCIF file: 7YJE-1 +<<< Could not download PDB/mmCIF file: 7YLZ-1 +<<< Could not download PDB/mmCIF file: 7YQN-2 +<<< Could not download PDB/mmCIF file: 7YVN-1 +<<< Could not download PDB/mmCIF file: 7Z58-4 +<<< Could not download PDB/mmCIF file: 7Z6E-3 +<<< Could not download PDB/mmCIF file: 7ZBA-1 +<<< Could not download PDB/mmCIF file: 7ZDC-1 +<<< Could not download PDB/mmCIF file: 7ZIB-1 +<<< Could not download PDB/mmCIF file: 7ZLN-1 +<<< Could not download PDB/mmCIF file: 7ZO0-1 +<<< Could not download PDB/mmCIF file: 7ZT7-1 +<<< Could not download PDB/mmCIF file: 7ZV1-1 +<<< Could not download PDB/mmCIF file: 8A26-1 +<<< Could not download PDB/mmCIF file: 8A53-1 +<<< Could not download PDB/mmCIF file: 8A6T-1 +<<< Could not download 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file: 8CR7-2 +<<< Could not download PDB/mmCIF file: 8D2W-1 +<<< Could not download PDB/mmCIF file: 8D7P-2 +<<< Could not download PDB/mmCIF file: 8D9Y-1 +<<< Could not download PDB/mmCIF file: 8DBB-1 +<<< Could not download PDB/mmCIF file: 8DDA-2 +<<< Could not download PDB/mmCIF file: 8DGR-1 +<<< Could not download PDB/mmCIF file: 8DKB-6 +<<< Could not download PDB/mmCIF file: 8DMA-1 +<<< Could not download PDB/mmCIF file: 8DNX-1 +<<< Could not download PDB/mmCIF file: 8DP8-3 +<<< Could not download PDB/mmCIF file: 8DR8-1 +<<< Could not download PDB/mmCIF file: 8DS3-1 +<<< Could not download PDB/mmCIF file: 8DYJ-1 +<<< Could not download PDB/mmCIF file: 8E0L-1 +<<< Could not download PDB/mmCIF file: 8E7N-1 +<<< Could not download PDB/mmCIF file: 8ECM-1 +<<< Could not download PDB/mmCIF file: 8EFG-1 +<<< Could not download PDB/mmCIF file: 8EID-1 +<<< Could not download PDB/mmCIF file: 8ELF-1 +<<< Could not download PDB/mmCIF file: 8EQT-1 +<<< Could not download PDB/mmCIF file: 8EUH-1 +<<< Could not download PDB/mmCIF file: 8EXB-1 +<<< Could not download PDB/mmCIF file: 8EZH-1 +<<< Could not download PDB/mmCIF file: 8F5J-1 +<<< Could not download PDB/mmCIF file: 8FBJ-1 +<<< Could not download PDB/mmCIF file: 8FE0-1 +<<< Could not download PDB/mmCIF file: 8FHT-1 +<<< Could not download PDB/mmCIF file: 8FLZ-4 +<<< Could not download PDB/mmCIF file: 8FO0-1 +<<< Could not download PDB/mmCIF file: 8FR1-1 +<<< Could not download PDB/mmCIF file: 8FWL-1 +<<< Could not download PDB/mmCIF file: 8G0R-1 +<<< Could not download PDB/mmCIF file: 8G53-1 +<<< Could not download PDB/mmCIF file: 8GB8-1 +<<< Could not download PDB/mmCIF file: 8GFP-1 +<<< Could not download PDB/mmCIF file: 8GMD-2 +<<< Could not download PDB/mmCIF file: 8GQB-1 +<<< Could not download PDB/mmCIF file: 8GSR-1 +<<< Could not download PDB/mmCIF file: 8GV2-1 +<<< Could not download PDB/mmCIF file: 8H3Y-2 +<<< Could not download PDB/mmCIF file: 8HDJ-2 +<<< Could not download PDB/mmCIF file: 8HI5-1 +<<< Could not download PDB/mmCIF file: 8HMS-1 +<<< Could not download PDB/mmCIF file: 8HVH-1 +<<< Could not download PDB/mmCIF file: 8I1Y-1 +<<< Could not download PDB/mmCIF file: 8I6D-2 +<<< Could not download PDB/mmCIF file: 8IBM-1 +<<< Could not download PDB/mmCIF file: 8IIL-1 +<<< Could not download PDB/mmCIF file: 8IRT-1 +<<< Could not download PDB/mmCIF file: 8J6V-9 +<<< Could not download PDB/mmCIF file: 8OFH-2 +<<< Could not download PDB/mmCIF file: 8OOV-1 +<<< Could not download PDB/mmCIF file: 8OVZ-2 +<<< Could not download PDB/mmCIF file: 8P9G-1 +<<< Could not download PDB/mmCIF file: 8SBN-1 +<<< Could not download PDB/mmCIF file: 8SJF-1 +<<< Could not download PDB/mmCIF file: 8SZB-1 +<<< Could not download PDB/mmCIF file: 7WR3-1 +<<< Could not download PDB/mmCIF file: 8AQW-1 +<<< Could not download PDB/mmCIF file: 8C1V-1 +<<< Could not download PDB/mmCIF file: 8D0X-1 +<<< Could not download PDB/mmCIF file: 8DL1-1 +<<< Could not download PDB/mmCIF file: 8F8W-2 +<<< Could not download 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file: 7SH7-1 +<<< Could not download PDB/mmCIF file: 7SKF-1 +<<< Could not download PDB/mmCIF file: 7SXH-1 +<<< Could not download PDB/mmCIF file: 7T8P-1 +<<< Could not download PDB/mmCIF file: 7TAL-1 +<<< Could not download PDB/mmCIF file: 7TKW-1 +<<< Could not download PDB/mmCIF file: 7TRT-1 +<<< Could not download PDB/mmCIF file: 7TXY-6 +<<< Could not download PDB/mmCIF file: 7TZN-1 +<<< Could not download PDB/mmCIF file: 7U68-2 +<<< Could not download PDB/mmCIF file: 7UE2-1 +<<< Could not download PDB/mmCIF file: 7UFN-1 +<<< Could not download PDB/mmCIF file: 7UGX-1 +<<< Could not download PDB/mmCIF file: 7UJ5-1 +<<< Could not download PDB/mmCIF file: 7UP3-1 +<<< Could not download PDB/mmCIF file: 7UYD-1 +<<< Could not download PDB/mmCIF file: 7VSF-1 +<<< Could not download PDB/mmCIF file: 7WLF-1 +<<< Could not download PDB/mmCIF file: 7WXS-1 +<<< Could not download PDB/mmCIF file: 7X1W-1 +<<< Could not download PDB/mmCIF file: 7X4C-1 +<<< Could not download PDB/mmCIF file: 7X85-1 +<<< Could not download PDB/mmCIF file: 7XBH-1 +<<< Could not download PDB/mmCIF file: 7XES-1 +<<< Could not download PDB/mmCIF file: 7XHP-1 +<<< Could not download PDB/mmCIF file: 7XME-1 +<<< Could not download PDB/mmCIF file: 7XOQ-1 +<<< Could not download PDB/mmCIF file: 7XSF-1 +<<< Could not download PDB/mmCIF file: 7XWC-1 +<<< Could not download PDB/mmCIF file: 7XXN-1 +<<< Could not download PDB/mmCIF file: 7Y0P-1 +<<< Could not download PDB/mmCIF file: 7Y56-1 +<<< Could not download PDB/mmCIF file: 7Y7W-1 +<<< Could not download PDB/mmCIF file: 7Y9I-1 +<<< Could not download PDB/mmCIF file: 7YC0-1 +<<< Could not download PDB/mmCIF file: 7YDO-1 +<<< Could not download PDB/mmCIF file: 7YHA-2 +<<< Could not download PDB/mmCIF file: 7YJE-2 +<<< Could not download PDB/mmCIF file: 7YLZ-2 +<<< Could not download PDB/mmCIF file: 7YRK-1 +<<< Could not download PDB/mmCIF file: 7Z6E-4 +<<< Could not download PDB/mmCIF file: 7Z89-1 +<<< Could not download PDB/mmCIF file: 7ZBA-2 +<<< Could not download PDB/mmCIF file: 7ZIC-1 +<<< Could not download PDB/mmCIF file: 7ZJZ-1 +<<< Could not download PDB/mmCIF file: 7ZLO-1 +<<< Could not download PDB/mmCIF file: 7ZO2-1 +<<< Could not download PDB/mmCIF file: 7ZPH-1 +<<< Could not download PDB/mmCIF file: 7ZT8-1 +<<< Could not download PDB/mmCIF file: 7ZV1-2 +<<< Could not download PDB/mmCIF file: 8A53-2 +<<< Could not download PDB/mmCIF file: 8A6U-1 +<<< Could not download PDB/mmCIF file: 8A8S-1 +<<< Could not download PDB/mmCIF file: 8ACW-1 +<<< Could not download PDB/mmCIF file: 8AFI-7 +<<< Could not download PDB/mmCIF file: 8AJJ-1 +<<< Could not download PDB/mmCIF file: 8ANP-4 +<<< Could not download PDB/mmCIF file: 8AQ3-1 +<<< Could not download PDB/mmCIF file: 8ASI-1 +<<< Could not download PDB/mmCIF file: 8AUQ-1 +<<< Could not download PDB/mmCIF file: 8AWO-1 +<<< Could not download PDB/mmCIF file: 8AYR-2 +<<< Could not download PDB/mmCIF file: 8B8H-1 +<<< Could not download PDB/mmCIF file: 8BAL-1 +<<< Could not download 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file: 8DBC-1 +<<< Could not download PDB/mmCIF file: 8DGU-1 +<<< Could not download PDB/mmCIF file: 8DKB-7 +<<< Could not download PDB/mmCIF file: 8DMD-1 +<<< Could not download PDB/mmCIF file: 8DNY-1 +<<< Could not download PDB/mmCIF file: 8DP9-1 +<<< Could not download PDB/mmCIF file: 8DYL-1 +<<< Could not download PDB/mmCIF file: 8E0N-1 +<<< Could not download PDB/mmCIF file: 8E1W-1 +<<< Could not download PDB/mmCIF file: 8ECM-2 +<<< Could not download PDB/mmCIF file: 8EFH-1 +<<< Could not download PDB/mmCIF file: 8EID-2 +<<< Could not download PDB/mmCIF file: 8ELG-1 +<<< Could not download PDB/mmCIF file: 8EQU-1 +<<< Could not download PDB/mmCIF file: 8EUK-1 +<<< Could not download PDB/mmCIF file: 8EXC-1 +<<< Could not download PDB/mmCIF file: 8EZI-1 +<<< Could not download PDB/mmCIF file: 8F2K-1 +<<< Could not download PDB/mmCIF file: 8F5K-1 +<<< Could not download PDB/mmCIF file: 8FBK-1 +<<< Could not download PDB/mmCIF file: 8FE1-1 +<<< Could not download PDB/mmCIF file: 8FHU-1 +<<< Could not download PDB/mmCIF file: 8FM0-1 +<<< Could not download PDB/mmCIF file: 8FO3-1 +<<< Could not download PDB/mmCIF file: 8FR2-1 +<<< Could not download PDB/mmCIF file: 8FWN-1 +<<< Could not download PDB/mmCIF file: 8G0S-1 +<<< Could not download PDB/mmCIF file: 8G59-1 +<<< Could not download PDB/mmCIF file: 8GBB-1 +<<< Could not download PDB/mmCIF file: 8GFQ-1 +<<< Could not download PDB/mmCIF file: 8GMF-1 +<<< Could not download PDB/mmCIF file: 8GQC-1 +<<< Could not download PDB/mmCIF file: 8GSR-2 +<<< Could not download PDB/mmCIF file: 8H3Y-3 +<<< Could not download PDB/mmCIF file: 8H8J-1 +<<< Could not download PDB/mmCIF file: 8HDJ-3 +<<< Could not download PDB/mmCIF file: 8HI6-1 +<<< Could not download PDB/mmCIF file: 8HMU-1 +<<< Could not download PDB/mmCIF file: 8I1Z-1 +<<< Could not download PDB/mmCIF file: 8I6G-1 +<<< Could not download PDB/mmCIF file: 8IBM-2 +<<< Could not download PDB/mmCIF file: 8IIM-1 +<<< Could not download PDB/mmCIF file: 8IRU-1 +<<< Could not download PDB/mmCIF file: 8J79-1 +<<< Could not download PDB/mmCIF file: 8OFH-3 +<<< Could not download PDB/mmCIF file: 8OP0-1 +<<< Could not download PDB/mmCIF file: 8OW2-1 +<<< Could not download PDB/mmCIF file: 8P9H-1 +<<< Could not download PDB/mmCIF file: 8SBO-1 +<<< Could not download PDB/mmCIF file: 8SJG-1 +<<< Could not download PDB/mmCIF file: 8SZD-1 +<<< Could not download PDB/mmCIF file: 7WR3-2 +<<< Could not download PDB/mmCIF file: 7ZBC-1 +<<< Could not download PDB/mmCIF file: 8C3V-1 +<<< Could not download PDB/mmCIF file: 8DL1-2 +<<< Could not download PDB/mmCIF file: 8F8X-1 +<<< Could not download PDB/mmCIF file: 8G2J-1 +<<< Could not download PDB/mmCIF file: 8I5X-1 +<<< Could not download PDB/mmCIF file: 7E45-1 +<<< Could not download PDB/mmCIF file: 7FSI-2 +<<< Could not download PDB/mmCIF file: 7FSU-4 +<<< Could not download PDB/mmCIF file: 7FT7-2 +<<< Could not download PDB/mmCIF file: 7FVF-1 +<<< Could not download PDB/mmCIF file: 7FWT-1 +<<< Could not download 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file: 7TZO-1 +<<< Could not download PDB/mmCIF file: 7UE3-1 +<<< Could not download PDB/mmCIF file: 7UFN-2 +<<< Could not download PDB/mmCIF file: 7UH3-1 +<<< Could not download PDB/mmCIF file: 7UJ5-2 +<<< Could not download PDB/mmCIF file: 7ULQ-1 +<<< Could not download PDB/mmCIF file: 7UP3-2 +<<< Could not download PDB/mmCIF file: 7UR1-1 +<<< Could not download PDB/mmCIF file: 7UYD-2 +<<< Could not download PDB/mmCIF file: 7VE0-1 +<<< Could not download PDB/mmCIF file: 7VSF-2 +<<< Could not download PDB/mmCIF file: 7WXT-1 +<<< Could not download PDB/mmCIF file: 7X4D-1 +<<< Could not download PDB/mmCIF file: 7X85-2 +<<< Could not download PDB/mmCIF file: 7XBI-1 +<<< Could not download PDB/mmCIF file: 7XDQ-1 +<<< Could not download PDB/mmCIF file: 7XET-1 +<<< Could not download PDB/mmCIF file: 7XHP-2 +<<< Could not download PDB/mmCIF file: 7XME-2 +<<< Could not download PDB/mmCIF file: 7XOR-1 +<<< Could not download PDB/mmCIF file: 7XSG-1 +<<< Could not download PDB/mmCIF file: 7XUA-1 +<<< Could not download PDB/mmCIF file: 7XWD-1 +<<< Could not download PDB/mmCIF file: 7XXO-1 +<<< Could not download PDB/mmCIF file: 7Y0Q-1 +<<< Could not download PDB/mmCIF file: 7Y57-1 +<<< Could not download PDB/mmCIF file: 7Y7Y-1 +<<< Could not download PDB/mmCIF file: 7Y9J-1 +<<< Could not download PDB/mmCIF file: 7YC0-2 +<<< Could not download PDB/mmCIF file: 7YDP-1 +<<< Could not download PDB/mmCIF file: 7YHA-3 +<<< Could not download PDB/mmCIF file: 7YJF-1 +<<< Could not download PDB/mmCIF file: 7YM0-1 +<<< Could not download PDB/mmCIF file: 7YRP-1 +<<< Could not download PDB/mmCIF file: 7YVR-1 +<<< Could not download PDB/mmCIF file: 7YXB-1 +<<< Could not download PDB/mmCIF file: 7Z35-1 +<<< Could not download PDB/mmCIF file: 7Z5B-1 +<<< Could not download PDB/mmCIF file: 7Z6E-5 +<<< Could not download PDB/mmCIF file: 7Z89-2 +<<< Could not download PDB/mmCIF file: 7ZBB-1 +<<< Could not download PDB/mmCIF file: 7ZDE-1 +<<< Could not download PDB/mmCIF file: 7ZIC-2 +<<< Could not download PDB/mmCIF file: 7ZLP-1 +<<< Could not download PDB/mmCIF file: 7ZO3-1 +<<< Could not download PDB/mmCIF file: 7ZT9-1 +<<< Could not download PDB/mmCIF file: 7ZV1-3 +<<< Could not download PDB/mmCIF file: 8A53-3 +<<< Could not download PDB/mmCIF file: 8A6V-1 +<<< Could not download PDB/mmCIF file: 8A8T-1 +<<< Could not download PDB/mmCIF file: 8AAE-1 +<<< Could not download PDB/mmCIF file: 8ACY-1 +<<< Could not download PDB/mmCIF file: 8AFI-8 +<<< Could not download PDB/mmCIF file: 8AJJ-2 +<<< Could not download PDB/mmCIF file: 8ANQ-1 +<<< Could not download PDB/mmCIF file: 8AQ4-1 +<<< Could not download PDB/mmCIF file: 8AUQ-2 +<<< Could not download PDB/mmCIF file: 8AWP-1 +<<< Could not download PDB/mmCIF file: 8B28-1 +<<< Could not download PDB/mmCIF file: 8BAL-2 +<<< Could not download PDB/mmCIF file: 8BC6-2 +<<< Could not download PDB/mmCIF file: 8BDK-2 +<<< Could not download PDB/mmCIF file: 8BFC-1 +<<< Could not download PDB/mmCIF file: 8BH0-4 +<<< Could not download 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file: 8DS9-1 +<<< Could not download PDB/mmCIF file: 8E0N-2 +<<< Could not download PDB/mmCIF file: 8E7Q-1 +<<< Could not download PDB/mmCIF file: 8ECM-3 +<<< Could not download PDB/mmCIF file: 8EIL-1 +<<< Could not download PDB/mmCIF file: 8ELH-1 +<<< Could not download PDB/mmCIF file: 8EQZ-1 +<<< Could not download PDB/mmCIF file: 8EUL-1 +<<< Could not download PDB/mmCIF file: 8EXE-1 +<<< Could not download PDB/mmCIF file: 8EZO-1 +<<< Could not download PDB/mmCIF file: 8F2L-1 +<<< Could not download PDB/mmCIF file: 8F5K-2 +<<< Could not download PDB/mmCIF file: 8F88-1 +<<< Could not download PDB/mmCIF file: 8FBL-1 +<<< Could not download PDB/mmCIF file: 8FE9-1 +<<< Could not download PDB/mmCIF file: 8FHU-2 +<<< Could not download PDB/mmCIF file: 8FM0-2 +<<< Could not download PDB/mmCIF file: 8FO3-2 +<<< Could not download PDB/mmCIF file: 8FR4-1 +<<< Could not download PDB/mmCIF file: 8FWP-1 +<<< Could not download PDB/mmCIF file: 8G0T-1 +<<< Could not download PDB/mmCIF file: 8G5C-1 +<<< Could not download PDB/mmCIF file: 8GBE-1 +<<< Could not download PDB/mmCIF file: 8GFR-1 +<<< Could not download PDB/mmCIF file: 8GMF-2 +<<< Could not download PDB/mmCIF file: 8H4I-1 +<<< Could not download PDB/mmCIF file: 8H97-1 +<<< Could not download PDB/mmCIF file: 8HDJ-4 +<<< Could not download PDB/mmCIF file: 8HIQ-1 +<<< Could not download PDB/mmCIF file: 8HMV-1 +<<< Could not download PDB/mmCIF file: 8HWP-1 +<<< Could not download PDB/mmCIF file: 8I27-1 +<<< Could not download PDB/mmCIF file: 8I6G-2 +<<< Could not download PDB/mmCIF file: 8IBR-1 +<<< Could not download PDB/mmCIF file: 8IIN-1 +<<< Could not download PDB/mmCIF file: 8IRV-1 +<<< Could not download PDB/mmCIF file: 8J8P-1 +<<< Could not download PDB/mmCIF file: 8OFJ-1 +<<< Could not download PDB/mmCIF file: 8OPI-1 +<<< Could not download PDB/mmCIF file: 8OW3-1 +<<< Could not download PDB/mmCIF file: 8P9I-1 +<<< Could not download PDB/mmCIF file: 8SBO-2 +<<< Could not download PDB/mmCIF file: 8SJG-2 +<<< Could not download PDB/mmCIF file: 8SZE-1 +<<< Could not download PDB/mmCIF file: 7ZBE-1 +<<< Could not download PDB/mmCIF file: 8C3V-2 +<<< Could not download PDB/mmCIF file: 8D3T-1 +<<< Could not download PDB/mmCIF file: 8DL1-3 +<<< Could not download PDB/mmCIF file: 8FBW-1 +<<< Could not download PDB/mmCIF file: 8G3M-1 +<<< Could not download PDB/mmCIF file: 8I5Y-1 +<<< Could not download PDB/mmCIF file: 7FRV-1 +<<< Could not download PDB/mmCIF file: 7FSI-3 +<<< Could not download PDB/mmCIF file: 7FSV-1 +<<< Could not download PDB/mmCIF file: 7FT7-3 +<<< Could not download PDB/mmCIF file: 7FVG-1 +<<< Could not download PDB/mmCIF file: 7FWT-2 +<<< Could not download PDB/mmCIF file: 7FY6-1 +<<< Could not download PDB/mmCIF file: 7FZ9-1 +<<< Could not download PDB/mmCIF file: 7G04-2 +<<< Could not download PDB/mmCIF file: 7G1G-1 +<<< Could not download PDB/mmCIF file: 7G8R-1 +<<< Could not download PDB/mmCIF file: 7Q9B-1 +<<< Could not download PDB/mmCIF file: 7QNT-3 +<<< Could not download 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file: 7X86-1 +<<< Could not download PDB/mmCIF file: 7X9G-1 +<<< Could not download PDB/mmCIF file: 7XBJ-1 +<<< Could not download PDB/mmCIF file: 7XDR-1 +<<< Could not download PDB/mmCIF file: 7XGI-1 +<<< Could not download PDB/mmCIF file: 7XHQ-1 +<<< Could not download PDB/mmCIF file: 7XJ9-1 +<<< Could not download PDB/mmCIF file: 7XME-3 +<<< Could not download PDB/mmCIF file: 7XOS-1 +<<< Could not download PDB/mmCIF file: 7XSH-1 +<<< Could not download PDB/mmCIF file: 7XUB-1 +<<< Could not download PDB/mmCIF file: 7XWE-1 +<<< Could not download PDB/mmCIF file: 7XXP-1 +<<< Could not download PDB/mmCIF file: 7Y0R-1 +<<< Could not download PDB/mmCIF file: 7Y3G-1 +<<< Could not download PDB/mmCIF file: 7Y57-2 +<<< Could not download PDB/mmCIF file: 7Y7Z-1 +<<< Could not download PDB/mmCIF file: 7Y9J-2 +<<< Could not download PDB/mmCIF file: 7YDT-1 +<<< Could not download PDB/mmCIF file: 7YHA-4 +<<< Could not download PDB/mmCIF file: 7YJF-2 +<<< Could not download PDB/mmCIF file: 7YM0-2 +<<< Could not download PDB/mmCIF file: 7YRP-2 +<<< Could not download PDB/mmCIF file: 7YXB-2 +<<< Could not download PDB/mmCIF file: 7YYE-1 +<<< Could not download PDB/mmCIF file: 7YZT-1 +<<< Could not download PDB/mmCIF file: 7Z5B-2 +<<< Could not download PDB/mmCIF file: 7Z6G-1 +<<< Could not download PDB/mmCIF file: 7Z8A-1 +<<< Could not download PDB/mmCIF file: 7ZBB-2 +<<< Could not download PDB/mmCIF file: 7ZDF-1 +<<< Could not download PDB/mmCIF file: 7ZIC-3 +<<< Could not download PDB/mmCIF file: 7ZLR-1 +<<< Could not download PDB/mmCIF file: 7ZO4-1 +<<< Could not download PDB/mmCIF file: 7ZPN-1 +<<< Could not download PDB/mmCIF file: 8A53-4 +<<< Could not download PDB/mmCIF file: 8A6W-1 +<<< Could not download PDB/mmCIF file: 8AAI-1 +<<< Could not download PDB/mmCIF file: 8AD0-1 +<<< Could not download PDB/mmCIF file: 8AFJ-1 +<<< Could not download PDB/mmCIF file: 8AJJ-3 +<<< Could not download PDB/mmCIF file: 8ANQ-2 +<<< Could not download PDB/mmCIF file: 8AWS-1 +<<< Could not download PDB/mmCIF file: 8AYV-1 +<<< Could not download PDB/mmCIF file: 8B29-1 +<<< Could not download PDB/mmCIF file: 8B5P-1 +<<< Could not download PDB/mmCIF file: 8BAL-3 +<<< Could not download PDB/mmCIF file: 8BC6-3 +<<< Could not download PDB/mmCIF file: 8BDL-1 +<<< Could not download PDB/mmCIF file: 8BHC-1 +<<< Could not download PDB/mmCIF file: 8BIX-1 +<<< Could not download PDB/mmCIF file: 8BQL-1 +<<< Could not download PDB/mmCIF file: 8BXW-1 +<<< Could not download PDB/mmCIF file: 8C2G-1 +<<< Could not download PDB/mmCIF file: 8C70-1 +<<< Could not download PDB/mmCIF file: 8CBU-1 +<<< Could not download PDB/mmCIF file: 8CER-2 +<<< Could not download PDB/mmCIF file: 8CJE-4 +<<< Could not download PDB/mmCIF file: 8CRI-2 +<<< Could not download PDB/mmCIF file: 8CTT-2 +<<< Could not download PDB/mmCIF file: 8CZ8-1 +<<< Could not download PDB/mmCIF file: 8D2Z-1 +<<< Could not download PDB/mmCIF file: 8D5B-1 +<<< Could not download PDB/mmCIF file: 8D6N-1 +<<< Could not download PDB/mmCIF file: 8D9Y-4 +<<< Could not download PDB/mmCIF file: 8DBG-1 +<<< Could not download PDB/mmCIF file: 8DEO-2 +<<< Could not download PDB/mmCIF file: 8DGW-1 +<<< Could not download PDB/mmCIF file: 8DKC-1 +<<< Could not download PDB/mmCIF file: 8DML-1 +<<< Could not download PDB/mmCIF file: 8DO0-1 +<<< Could not download PDB/mmCIF file: 8DPA-1 +<<< Could not download PDB/mmCIF file: 8DSA-1 +<<< Could not download PDB/mmCIF file: 8E0O-1 +<<< Could not download PDB/mmCIF file: 8E4T-1 +<<< Could not download PDB/mmCIF file: 8E7R-1 +<<< Could not download PDB/mmCIF file: 8EA5-1 +<<< Could not download PDB/mmCIF file: 8ECM-4 +<<< Could not download PDB/mmCIF file: 8EIL-2 +<<< Could not download PDB/mmCIF file: 8ELO-1 +<<< Could not download PDB/mmCIF file: 8ER0-1 +<<< Could not download PDB/mmCIF file: 8EXF-1 +<<< Could not download PDB/mmCIF file: 8EZP-1 +<<< Could not download PDB/mmCIF file: 8F2L-2 +<<< Could not download PDB/mmCIF file: 8F5K-3 +<<< Could not download PDB/mmCIF file: 8F88-2 +<<< Could not download PDB/mmCIF file: 8FBM-1 +<<< Could not download PDB/mmCIF file: 8FEE-1 +<<< Could not download PDB/mmCIF file: 8FM0-3 +<<< Could not download PDB/mmCIF file: 8FO3-3 +<<< Could not download PDB/mmCIF file: 8FSI-1 +<<< Could not download PDB/mmCIF file: 8FWX-1 +<<< Could not download PDB/mmCIF file: 8G0U-1 +<<< Could not download PDB/mmCIF file: 8G5D-1 +<<< Could not download PDB/mmCIF file: 8GBV-1 +<<< Could not download PDB/mmCIF file: 8GFS-1 +<<< Could not download PDB/mmCIF file: 8GMF-3 +<<< Could not download PDB/mmCIF file: 8GQR-1 +<<< Could not download PDB/mmCIF file: 8H0E-1 +<<< Could not download PDB/mmCIF file: 8H4K-1 +<<< Could not download PDB/mmCIF file: 8H98-1 +<<< Could not download PDB/mmCIF file: 8HDO-1 +<<< Could not download PDB/mmCIF file: 8HIT-1 +<<< Could not download PDB/mmCIF file: 8HN2-1 +<<< Could not download PDB/mmCIF file: 8HX3-1 +<<< Could not download PDB/mmCIF file: 8I28-1 +<<< Could not download PDB/mmCIF file: 8I6H-1 +<<< Could not download PDB/mmCIF file: 8IBS-1 +<<< Could not download PDB/mmCIF file: 8IIO-1 +<<< Could not download PDB/mmCIF file: 8ITF-1 +<<< Could not download PDB/mmCIF file: 8J8Q-1 +<<< Could not download PDB/mmCIF file: 8OFL-1 +<<< Could not download PDB/mmCIF file: 8OPQ-1 +<<< Could not download PDB/mmCIF file: 8OWA-1 +<<< Could not download PDB/mmCIF file: 8P9I-2 +<<< Could not download PDB/mmCIF file: 8SBR-1 +<<< Could not download PDB/mmCIF file: 8SJH-1 +<<< Could not download PDB/mmCIF file: 8SZE-2 +<<< Could not download PDB/mmCIF file: 7WR9-1 +<<< Could not download PDB/mmCIF file: 8C3V-3 +<<< Could not download PDB/mmCIF file: 8D3T-2 +<<< Could not download PDB/mmCIF file: 8DL1-4 +<<< Could not download PDB/mmCIF file: 8FBW-2 +<<< Could not download PDB/mmCIF file: 8G3O-1 +<<< Could not download PDB/mmCIF file: 8IBK-1 +<<< Could not download PDB/mmCIF file: 7FRV-2 +<<< Could not download PDB/mmCIF file: 7FSI-4 +<<< Could not download PDB/mmCIF file: 7FSV-2 +<<< Could not download PDB/mmCIF file: 7FT7-4 +<<< Could not download PDB/mmCIF file: 7FVH-1 +<<< Could not download PDB/mmCIF file: 7FWU-1 +<<< Could not download PDB/mmCIF file: 7FY7-1 +<<< Could not download PDB/mmCIF file: 7FZA-1 +<<< Could not download PDB/mmCIF file: 7G05-1 +<<< Could not download PDB/mmCIF file: 7G1H-1 +<<< Could not download PDB/mmCIF file: 7G8S-1 +<<< Could not download PDB/mmCIF file: 7QNT-4 +<<< Could not download PDB/mmCIF file: 7QPF-1 +<<< Could not download PDB/mmCIF file: 7QW4-2 +<<< Could not download PDB/mmCIF file: 7R3Z-3 +<<< Could not download PDB/mmCIF file: 7SVF-1 +<<< Could not download PDB/mmCIF file: 7T8Q-2 +<<< Could not download PDB/mmCIF file: 7TND-1 +<<< Could not download PDB/mmCIF file: 7TSW-1 +<<< Could not download PDB/mmCIF file: 7UCQ-1 +<<< Could not download PDB/mmCIF file: 7UE5-1 +<<< Could not download PDB/mmCIF file: 7UJ6-2 +<<< Could not download PDB/mmCIF file: 7ULQ-11 +<<< Could not download PDB/mmCIF file: 7UR2-2 +<<< Could not download 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file: 7Y9K-1 +<<< Could not download PDB/mmCIF file: 7YDT-2 +<<< Could not download PDB/mmCIF file: 7YHB-1 +<<< Could not download PDB/mmCIF file: 7YJG-1 +<<< Could not download PDB/mmCIF file: 7YM8-1 +<<< Could not download PDB/mmCIF file: 7YRQ-1 +<<< Could not download PDB/mmCIF file: 7YYE-2 +<<< Could not download PDB/mmCIF file: 7YZT-2 +<<< Could not download PDB/mmCIF file: 7Z5B-3 +<<< Could not download PDB/mmCIF file: 7Z6G-2 +<<< Could not download PDB/mmCIF file: 7ZBD-1 +<<< Could not download PDB/mmCIF file: 7ZDG-1 +<<< Could not download PDB/mmCIF file: 7ZLS-1 +<<< Could not download PDB/mmCIF file: 7ZO5-1 +<<< Could not download PDB/mmCIF file: 7ZPO-1 +<<< Could not download PDB/mmCIF file: 8A29-1 +<<< Could not download PDB/mmCIF file: 8A6W-2 +<<< Could not download PDB/mmCIF file: 8AAI-2 +<<< Could not download PDB/mmCIF file: 8AD3-1 +<<< Could not download PDB/mmCIF file: 8AFN-1 +<<< Could not download PDB/mmCIF file: 8AHS-1 +<<< Could not download PDB/mmCIF file: 8AJK-1 +<<< Could not download PDB/mmCIF file: 8ANR-1 +<<< Could not download PDB/mmCIF file: 8ASR-1 +<<< Could not download PDB/mmCIF file: 8AWU-1 +<<< Could not download PDB/mmCIF file: 8B2A-1 +<<< Could not download PDB/mmCIF file: 8BAL-4 +<<< Could not download PDB/mmCIF file: 8BC7-1 +<<< Could not download PDB/mmCIF file: 8BDL-2 +<<< Could not download PDB/mmCIF file: 8BHC-2 +<<< Could not download PDB/mmCIF file: 8BIZ-1 +<<< Could not download PDB/mmCIF file: 8BM5-1 +<<< Could not download PDB/mmCIF file: 8BQM-1 +<<< Could not download PDB/mmCIF file: 8BT6-1 +<<< Could not download PDB/mmCIF file: 8BXX-1 +<<< Could not download PDB/mmCIF file: 8C2O-1 +<<< Could not download PDB/mmCIF file: 8C71-1 +<<< Could not download PDB/mmCIF file: 8CBV-1 +<<< Could not download PDB/mmCIF file: 8CES-1 +<<< Could not download PDB/mmCIF file: 8CJF-1 +<<< Could not download PDB/mmCIF file: 8CRJ-1 +<<< Could not download PDB/mmCIF file: 8CTV-1 +<<< Could not download PDB/mmCIF file: 8CZ8-2 +<<< Could not download PDB/mmCIF file: 8D2Z-2 +<<< Could not download PDB/mmCIF file: 8D9Z-1 +<<< Could not download PDB/mmCIF file: 8DBI-1 +<<< Could not download PDB/mmCIF file: 8DGW-2 +<<< Could not download PDB/mmCIF file: 8DIP-1 +<<< Could not download PDB/mmCIF file: 8DKD-1 +<<< Could not download PDB/mmCIF file: 8DML-2 +<<< Could not download PDB/mmCIF file: 8DO1-1 +<<< Could not download PDB/mmCIF file: 8DPB-1 +<<< Could not download PDB/mmCIF file: 8DSC-1 +<<< Could not download PDB/mmCIF file: 8DTU-1 +<<< Could not download PDB/mmCIF file: 8E0Q-1 +<<< Could not download PDB/mmCIF file: 8E7W-1 +<<< Could not download PDB/mmCIF file: 8EA6-1 +<<< Could not download PDB/mmCIF file: 8ECM-5 +<<< Could not download PDB/mmCIF file: 8EFM-1 +<<< Could not download PDB/mmCIF file: 8EIL-3 +<<< Could not download PDB/mmCIF file: 8ELP-1 +<<< Could not download PDB/mmCIF file: 8ER0-2 +<<< Could not download PDB/mmCIF file: 8EUR-1 +<<< Could not download PDB/mmCIF file: 8EXG-1 +<<< Could not download PDB/mmCIF file: 8EZU-1 +<<< Could not download PDB/mmCIF file: 8F2L-3 +<<< Could not download PDB/mmCIF file: 8F5K-4 +<<< Could not download PDB/mmCIF file: 8F88-3 +<<< Could not download PDB/mmCIF file: 8FBM-2 +<<< Could not download PDB/mmCIF file: 8FEF-1 +<<< Could not download PDB/mmCIF file: 8FM0-4 +<<< Could not download PDB/mmCIF file: 8FO3-4 +<<< Could not download PDB/mmCIF file: 8FT6-1 +<<< Could not download PDB/mmCIF file: 8FWX-2 +<<< Could not download PDB/mmCIF file: 8G0V-1 +<<< Could not download PDB/mmCIF file: 8G5E-1 +<<< Could not download PDB/mmCIF file: 8GBV-2 +<<< Could not download PDB/mmCIF file: 8GFU-1 +<<< Could not download PDB/mmCIF file: 8GMF-4 +<<< Could not download PDB/mmCIF file: 8GQR-2 +<<< Could not download PDB/mmCIF file: 8GST-1 +<<< Could not download PDB/mmCIF file: 8GV8-1 +<<< Could not download PDB/mmCIF file: 8H0F-1 +<<< Could not download PDB/mmCIF file: 8H4L-1 +<<< Could not download PDB/mmCIF file: 8H99-1 +<<< Could not download PDB/mmCIF file: 8HDP-1 +<<< Could not download PDB/mmCIF file: 8HIV-1 +<<< Could not download PDB/mmCIF file: 8HN3-1 +<<< Could not download PDB/mmCIF file: 8HX3-2 +<<< Could not download PDB/mmCIF file: 8I29-1 +<<< Could not download PDB/mmCIF file: 8I6H-2 +<<< Could not download PDB/mmCIF file: 8IBS-2 +<<< Could not download PDB/mmCIF file: 8IIP-1 +<<< Could not download PDB/mmCIF file: 8ITH-1 +<<< Could not download PDB/mmCIF file: 8JAT-1 +<<< Could not download PDB/mmCIF file: 8OFO-1 +<<< Could not download PDB/mmCIF file: 8OPZ-1 +<<< Could not download PDB/mmCIF file: 8OWG-1 +<<< Could not download PDB/mmCIF file: 8P9J-1 +<<< Could not download PDB/mmCIF file: 8SBV-1 +<<< Could not download PDB/mmCIF file: 8SJI-1 +<<< Could not download PDB/mmCIF file: 8T1A-1 +<<< Could not download PDB/mmCIF file: 7QUO-1 +<<< Could not download PDB/mmCIF file: 7WRH-1 +<<< Could not download PDB/mmCIF file: 7X2N-1 +<<< Could not download PDB/mmCIF file: 7YCK-1 +<<< Could not download PDB/mmCIF file: 7ZYL-1 +<<< Could not download PDB/mmCIF file: 8C6I-1 +<<< Could not download PDB/mmCIF file: 8D3Z-1 +<<< Could not download PDB/mmCIF file: 8DL2-1 +<<< Could not download PDB/mmCIF file: 8FD7-1 +<<< Could not download PDB/mmCIF file: 8G3Q-1 +<<< Could not download PDB/mmCIF file: 8IBT-1 +<<< Could not download PDB/mmCIF file: 7E47-1 +<<< Could not download PDB/mmCIF file: 7FRW-1 +<<< Could not download PDB/mmCIF file: 7FSJ-1 +<<< Could not download PDB/mmCIF file: 7FSV-3 +<<< Could not download PDB/mmCIF file: 7FT8-1 +<<< Could not download PDB/mmCIF file: 7FVI-1 +<<< Could not download PDB/mmCIF file: 7FWV-1 +<<< Could not download PDB/mmCIF file: 7FY8-1 +<<< Could not download PDB/mmCIF file: 7FZA-2 +<<< Could not download PDB/mmCIF file: 7G06-1 +<<< Could not download PDB/mmCIF file: 7G1I-1 +<<< Could not download PDB/mmCIF file: 7G8T-1 +<<< Could not download PDB/mmCIF file: 7PVL-1 +<<< Could not download PDB/mmCIF file: 7QNU-1 +<<< Could not download PDB/mmCIF file: 7QPF-2 +<<< Could not download PDB/mmCIF file: 7QW4-20 +<<< Could not download PDB/mmCIF file: 7R3Z-4 +<<< Could not download PDB/mmCIF file: 7R5X-1 +<<< Could not download PDB/mmCIF file: 7RYD-1 +<<< Could not download PDB/mmCIF file: 7SCS-1 +<<< Could not download PDB/mmCIF file: 7SVG-1 +<<< Could not download PDB/mmCIF file: 7TDY-1 +<<< Could not download PDB/mmCIF file: 7TGP-1 +<<< Could not download PDB/mmCIF file: 7TSW-2 +<<< Could not download PDB/mmCIF file: 7TUI-1 +<<< Could not download PDB/mmCIF file: 7UCQ-2 +<<< Could not download PDB/mmCIF file: 7UE6-1 +<<< Could not download PDB/mmCIF file: 7UFQ-1 +<<< Could not download PDB/mmCIF file: 7UH6-1 +<<< Could not download PDB/mmCIF file: 7ULQ-12 +<<< Could not download PDB/mmCIF file: 7UR2-3 +<<< Could not download PDB/mmCIF file: 7UVA-2 +<<< Could not download PDB/mmCIF file: 7VA1-1 +<<< Could not download PDB/mmCIF file: 7VX2-2 +<<< Could not download PDB/mmCIF file: 7WJR-1 +<<< Could not download PDB/mmCIF file: 7WZZ-1 +<<< Could not 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file: 8B8N-1 +<<< Could not download PDB/mmCIF file: 8BAL-5 +<<< Could not download PDB/mmCIF file: 8BC7-2 +<<< Could not download PDB/mmCIF file: 8BDL-3 +<<< Could not download PDB/mmCIF file: 8BHD-1 +<<< Could not download PDB/mmCIF file: 8BJ1-1 +<<< Could not download PDB/mmCIF file: 8BN6-1 +<<< Could not download PDB/mmCIF file: 8BQO-1 +<<< Could not download PDB/mmCIF file: 8BXX-2 +<<< Could not download PDB/mmCIF file: 8C2O-2 +<<< Could not download PDB/mmCIF file: 8C72-1 +<<< Could not download PDB/mmCIF file: 8CBX-1 +<<< Could not download PDB/mmCIF file: 8CES-2 +<<< Could not download PDB/mmCIF file: 8CJF-2 +<<< Could not download PDB/mmCIF file: 8CRL-1 +<<< Could not download PDB/mmCIF file: 8CTV-2 +<<< Could not download PDB/mmCIF file: 8CZ9-1 +<<< Could not download PDB/mmCIF file: 8D0V-1 +<<< Could not download PDB/mmCIF file: 8DA0-1 +<<< Could not download PDB/mmCIF file: 8DBK-1 +<<< Could not download PDB/mmCIF file: 8DGW-3 +<<< Could not download PDB/mmCIF file: 8DIQ-1 +<<< Could not download PDB/mmCIF file: 8DML-3 +<<< Could not download PDB/mmCIF file: 8DO2-1 +<<< Could not download PDB/mmCIF file: 8DSD-1 +<<< Could not download PDB/mmCIF file: 8DWI-1 +<<< Could not download PDB/mmCIF file: 8E0R-1 +<<< Could not download PDB/mmCIF file: 8E4Z-1 +<<< Could not download PDB/mmCIF file: 8E7W-2 +<<< Could not download PDB/mmCIF file: 8EA7-1 +<<< Could not download PDB/mmCIF file: 8ECM-6 +<<< Could not download PDB/mmCIF file: 8EFN-1 +<<< Could not download PDB/mmCIF file: 8EIL-4 +<<< Could not download PDB/mmCIF file: 8ELP-2 +<<< Could not download PDB/mmCIF file: 8ER1-1 +<<< Could not download PDB/mmCIF file: 8EUR-2 +<<< Could not download PDB/mmCIF file: 8EXI-1 +<<< Could not download PDB/mmCIF file: 8EZW-1 +<<< Could not download PDB/mmCIF file: 8F2L-4 +<<< Could not download PDB/mmCIF file: 8F5L-1 +<<< Could not download PDB/mmCIF file: 8F8E-1 +<<< Could not download PDB/mmCIF file: 8FBN-1 +<<< Could not download PDB/mmCIF file: 8FEI-1 +<<< Could not download PDB/mmCIF file: 8FM2-1 +<<< Could not download PDB/mmCIF file: 8FO3-5 +<<< Could not download PDB/mmCIF file: 8FT7-1 +<<< Could not download PDB/mmCIF file: 8FX6-1 +<<< Could not download PDB/mmCIF file: 8G1E-1 +<<< Could not download PDB/mmCIF file: 8G5W-1 +<<< Could not download PDB/mmCIF file: 8GBW-1 +<<< Could not download PDB/mmCIF file: 8GH7-1 +<<< Could not download PDB/mmCIF file: 8GMI-1 +<<< Could not download PDB/mmCIF file: 8GQU-1 +<<< Could not download PDB/mmCIF file: 8GST-2 +<<< Could not download PDB/mmCIF file: 8GV9-1 +<<< Could not download PDB/mmCIF file: 8H0M-1 +<<< Could not download PDB/mmCIF file: 8H9A-1 +<<< Could not download PDB/mmCIF file: 8HDU-1 +<<< Could not download PDB/mmCIF file: 8HIX-1 +<<< Could not download PDB/mmCIF file: 8HN3-2 +<<< Could not download PDB/mmCIF file: 8HXM-1 +<<< Could not download PDB/mmCIF file: 8I2A-1 +<<< Could not download PDB/mmCIF file: 8I6V-1 +<<< Could not download PDB/mmCIF file: 8IBV-1 +<<< Could not download 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file: 7FRW-2 +<<< Could not download PDB/mmCIF file: 7FSJ-2 +<<< Could not download PDB/mmCIF file: 7FSV-4 +<<< Could not download PDB/mmCIF file: 7FT8-2 +<<< Could not download PDB/mmCIF file: 7FVJ-1 +<<< Could not download PDB/mmCIF file: 7FWW-1 +<<< Could not download PDB/mmCIF file: 7FY8-2 +<<< Could not download PDB/mmCIF file: 7FZB-1 +<<< Could not download PDB/mmCIF file: 7G07-1 +<<< Could not download PDB/mmCIF file: 7G1J-1 +<<< Could not download PDB/mmCIF file: 7G8U-1 +<<< Could not download PDB/mmCIF file: 7QNV-1 +<<< Could not download PDB/mmCIF file: 7QPH-1 +<<< Could not download PDB/mmCIF file: 7QUG-1 +<<< Could not download PDB/mmCIF file: 7QW4-3 +<<< Could not download PDB/mmCIF file: 7R2X-1 +<<< Could not download PDB/mmCIF file: 7R5X-2 +<<< Could not download PDB/mmCIF file: 7RYD-2 +<<< Could not download PDB/mmCIF file: 7SCT-1 +<<< Could not download PDB/mmCIF file: 7SPQ-1 +<<< Could not download PDB/mmCIF file: 7SVH-1 +<<< Could not download PDB/mmCIF file: 7T4T-1 +<<< Could not download PDB/mmCIF file: 7T8S-1 +<<< Could not download PDB/mmCIF file: 7TNF-1 +<<< Could not download PDB/mmCIF file: 7TQ1-1 +<<< Could not download PDB/mmCIF file: 7TSW-3 +<<< Could not download PDB/mmCIF file: 7TZW-1 +<<< Could not download PDB/mmCIF file: 7U6H-1 +<<< Could not download PDB/mmCIF file: 7UCQ-3 +<<< Could not download PDB/mmCIF file: 7UE7-1 +<<< Could not download PDB/mmCIF file: 7UFQ-2 +<<< Could not download PDB/mmCIF file: 7ULQ-2 +<<< Could not download PDB/mmCIF file: 7UR2-4 +<<< Could not download PDB/mmCIF file: 7UVB-1 +<<< Could not download PDB/mmCIF file: 7VA1-2 +<<< Could not download PDB/mmCIF file: 7X00-1 +<<< Could not download PDB/mmCIF file: 7X4H-1 +<<< Could not download PDB/mmCIF file: 7X8B-1 +<<< Could not download PDB/mmCIF file: 7XBM-1 +<<< Could not download PDB/mmCIF file: 7XHU-1 +<<< Could not download PDB/mmCIF file: 7XJB-2 +<<< Could not download PDB/mmCIF file: 7XMJ-1 +<<< Could not download PDB/mmCIF file: 7XQZ-1 +<<< Could 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file: 8BYA-1 +<<< Could not download PDB/mmCIF file: 8C2P-1 +<<< Could not download PDB/mmCIF file: 8C74-1 +<<< Could not download PDB/mmCIF file: 8CBY-1 +<<< Could not download PDB/mmCIF file: 8CET-1 +<<< Could not download PDB/mmCIF file: 8CJG-1 +<<< Could not download PDB/mmCIF file: 8CRL-2 +<<< Could not download PDB/mmCIF file: 8CTW-1 +<<< Could not download PDB/mmCIF file: 8D0V-2 +<<< Could not download PDB/mmCIF file: 8DA0-2 +<<< Could not download PDB/mmCIF file: 8DBL-1 +<<< Could not download PDB/mmCIF file: 8DDJ-1 +<<< Could not download PDB/mmCIF file: 8DGW-4 +<<< Could not download PDB/mmCIF file: 8DIZ-1 +<<< Could not download PDB/mmCIF file: 8DKF-1 +<<< Could not download PDB/mmCIF file: 8DML-4 +<<< Could not download PDB/mmCIF file: 8DO3-1 +<<< Could not download PDB/mmCIF file: 8DRE-1 +<<< Could not download PDB/mmCIF file: 8DSE-1 +<<< Could not download PDB/mmCIF file: 8DWK-1 +<<< Could not download PDB/mmCIF file: 8E0R-2 +<<< Could not download PDB/mmCIF file: 8E4Z-2 +<<< Could not download PDB/mmCIF file: 8E7X-1 +<<< Could not download PDB/mmCIF file: 8EA8-1 +<<< Could not download PDB/mmCIF file: 8ECM-7 +<<< Could not download PDB/mmCIF file: 8EIM-1 +<<< Could not download PDB/mmCIF file: 8ELQ-1 +<<< Could not download PDB/mmCIF file: 8ER4-1 +<<< Could not download PDB/mmCIF file: 8EUS-1 +<<< Could not download PDB/mmCIF file: 8EXJ-1 +<<< Could not download PDB/mmCIF file: 8EZW-2 +<<< Could not download PDB/mmCIF file: 8F2L-5 +<<< Could not download PDB/mmCIF file: 8F5L-2 +<<< Could not download PDB/mmCIF file: 8F8E-2 +<<< Could not download PDB/mmCIF file: 8FBN-2 +<<< Could not download PDB/mmCIF file: 8FF0-1 +<<< Could not download PDB/mmCIF file: 8FM2-2 +<<< Could not download PDB/mmCIF file: 8FO3-6 +<<< Could not download PDB/mmCIF file: 8FT7-2 +<<< Could not download PDB/mmCIF file: 8FX6-2 +<<< Could not download PDB/mmCIF file: 8G1F-1 +<<< Could not download PDB/mmCIF file: 8G5X-1 +<<< Could not download PDB/mmCIF file: 8GBX-1 +<<< Could not download PDB/mmCIF file: 8GH7-2 +<<< Could not download PDB/mmCIF file: 8GMI-2 +<<< Could not download PDB/mmCIF file: 8GQV-1 +<<< Could not download PDB/mmCIF file: 8GSU-1 +<<< Could not download PDB/mmCIF file: 8GVA-1 +<<< Could not download PDB/mmCIF file: 8H0N-1 +<<< Could not download PDB/mmCIF file: 8H9B-1 +<<< Could not download PDB/mmCIF file: 8HDV-1 +<<< Could not download PDB/mmCIF file: 8HIZ-1 +<<< Could not download PDB/mmCIF file: 8HN6-1 +<<< Could not download PDB/mmCIF file: 8HXS-1 +<<< Could not download PDB/mmCIF file: 8I2C-1 +<<< Could not download PDB/mmCIF file: 8I6Z-1 +<<< Could not download PDB/mmCIF file: 8IC9-1 +<<< Could not download PDB/mmCIF file: 8IIR-1 +<<< Could not download PDB/mmCIF file: 8IU9-1 +<<< Could not download PDB/mmCIF file: 8JBJ-2 +<<< Could not download PDB/mmCIF file: 8OG5-1 +<<< Could not download PDB/mmCIF file: 8OQ1-1 +<<< Could not download PDB/mmCIF file: 8OWG-3 +<<< Could not download PDB/mmCIF file: 8P9L-1 +<<< Could not download 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file: 7FWX-1 +<<< Could not download PDB/mmCIF file: 7FY8-3 +<<< Could not download PDB/mmCIF file: 7FZC-1 +<<< Could not download PDB/mmCIF file: 7G08-1 +<<< Could not download PDB/mmCIF file: 7G1K-1 +<<< Could not download PDB/mmCIF file: 7G8V-1 +<<< Could not download PDB/mmCIF file: 7N8G-1 +<<< Could not download PDB/mmCIF file: 7PE4-1 +<<< Could not download PDB/mmCIF file: 7QUH-1 +<<< Could not download PDB/mmCIF file: 7QW4-4 +<<< Could not download PDB/mmCIF file: 7R2X-2 +<<< Could not download PDB/mmCIF file: 7RYK-1 +<<< Could not download PDB/mmCIF file: 7SCU-1 +<<< Could not download PDB/mmCIF file: 7SVH-2 +<<< Could not download PDB/mmCIF file: 7T4T-2 +<<< Could not download PDB/mmCIF file: 7T8S-2 +<<< Could not download PDB/mmCIF file: 7TQ1-2 +<<< Could not download PDB/mmCIF file: 7TSW-4 +<<< Could not download PDB/mmCIF file: 7TUN-1 +<<< Could not download PDB/mmCIF file: 7TZX-1 +<<< Could not download PDB/mmCIF file: 7U59-1 +<<< Could not download PDB/mmCIF file: 7U6H-2 +<<< Could not download PDB/mmCIF file: 7UCQ-4 +<<< Could not download PDB/mmCIF file: 7UE8-1 +<<< Could not download PDB/mmCIF file: 7ULQ-3 +<<< Could not download PDB/mmCIF file: 7UR2-5 +<<< Could not download PDB/mmCIF file: 7UVC-1 +<<< Could not download PDB/mmCIF file: 7VA1-3 +<<< Could not download PDB/mmCIF file: 7WVZ-1 +<<< Could not download PDB/mmCIF file: 7X4I-1 +<<< Could not download PDB/mmCIF file: 7X66-1 +<<< Could not download PDB/mmCIF file: 7X8B-2 +<<< Could not download PDB/mmCIF file: 7XBM-2 +<<< Could not download PDB/mmCIF file: 7XF3-1 +<<< Could not download PDB/mmCIF file: 7XHW-1 +<<< Could not download PDB/mmCIF file: 7XJB-3 +<<< Could not download PDB/mmCIF file: 7XMJ-2 +<<< Could not download PDB/mmCIF file: 7XR0-1 +<<< Could not download PDB/mmCIF file: 7XUJ-1 +<<< Could not download PDB/mmCIF file: 7XXS-1 +<<< Could not download PDB/mmCIF file: 7Y0X-1 +<<< Could not download PDB/mmCIF file: 7Y3S-1 +<<< Could not download PDB/mmCIF file: 7Y5J-1 +<<< Could not download PDB/mmCIF file: 7Y9L-2 +<<< Could not download PDB/mmCIF file: 7YC4-3 +<<< Could not download PDB/mmCIF file: 7YE4-1 +<<< Could not download PDB/mmCIF file: 7YHC-2 +<<< Could not download PDB/mmCIF file: 7YJH-2 +<<< Could not download PDB/mmCIF file: 7YME-1 +<<< Could not download PDB/mmCIF file: 7YOT-1 +<<< Could not download PDB/mmCIF file: 7YYF-1 +<<< Could not download PDB/mmCIF file: 7YZW-1 +<<< Could not download PDB/mmCIF file: 7ZAB-1 +<<< Could not download PDB/mmCIF file: 7ZDN-1 +<<< Could not download PDB/mmCIF file: 7ZGZ-1 +<<< Could not download PDB/mmCIF file: 7ZK6-1 +<<< Could not download PDB/mmCIF file: 7ZLS-4 +<<< Could not download PDB/mmCIF file: 7ZPU-1 +<<< Could not download PDB/mmCIF file: 7ZRX-1 +<<< Could not download PDB/mmCIF file: 7ZTJ-1 +<<< Could not download PDB/mmCIF file: 7ZV6-1 +<<< Could not download PDB/mmCIF file: 7ZX3-1 +<<< Could not download PDB/mmCIF file: 7ZYN-1 +<<< Could not download PDB/mmCIF file: 8A3X-1 +<<< Could not download PDB/mmCIF file: 8A6Z-3 +<<< Could not download PDB/mmCIF file: 8A8Z-1 +<<< Could not download PDB/mmCIF file: 8AAO-1 +<<< Could not download PDB/mmCIF file: 8AD4-2 +<<< Could not download PDB/mmCIF file: 8AFU-1 +<<< Could not download PDB/mmCIF file: 8AHT-3 +<<< Could not download PDB/mmCIF file: 8AQ8-2 +<<< Could not download PDB/mmCIF file: 8ASS-2 +<<< Could not download PDB/mmCIF file: 8AWX-1 +<<< Could not download PDB/mmCIF file: 8B2B-2 +<<< Could not download PDB/mmCIF file: 8B8U-1 +<<< Could not download PDB/mmCIF file: 8BAT-1 +<<< Could not download PDB/mmCIF file: 8BC8-1 +<<< Could not download PDB/mmCIF file: 8BDM-1 +<<< Could not download PDB/mmCIF file: 8BHD-3 +<<< Could not download PDB/mmCIF file: 8BJ3-1 +<<< Could not download PDB/mmCIF file: 8BNQ-2 +<<< Could not download PDB/mmCIF file: 8BQQ-1 +<<< Could not download PDB/mmCIF file: 8BYH-1 +<<< Could not download PDB/mmCIF file: 8C3C-1 +<<< Could not download PDB/mmCIF file: 8C77-1 +<<< Could not download PDB/mmCIF file: 8CBZ-1 +<<< Could not download PDB/mmCIF file: 8CET-2 +<<< Could not download PDB/mmCIF file: 8CJG-2 +<<< Could not download PDB/mmCIF file: 8CRS-1 +<<< Could not download PDB/mmCIF file: 8CTW-2 +<<< Could not download PDB/mmCIF file: 8D32-1 +<<< Could not download PDB/mmCIF file: 8DA1-1 +<<< Could not download PDB/mmCIF file: 8DBN-1 +<<< Could not download PDB/mmCIF file: 8DDL-1 +<<< Could not download PDB/mmCIF file: 8DEZ-1 +<<< Could not download PDB/mmCIF file: 8DGX-1 +<<< Could not download PDB/mmCIF file: 8DJ0-1 +<<< Could not download PDB/mmCIF file: 8DKF-2 +<<< Could not download PDB/mmCIF file: 8DSF-1 +<<< Could not download PDB/mmCIF file: 8DWK-2 +<<< Could not download PDB/mmCIF file: 8DYR-1 +<<< Could not download PDB/mmCIF file: 8E51-1 +<<< Could not download PDB/mmCIF file: 8E7X-2 +<<< Could not download PDB/mmCIF file: 8EA9-1 +<<< Could not download PDB/mmCIF file: 8ECM-8 +<<< Could not download PDB/mmCIF file: 8EIN-1 +<<< Could not download PDB/mmCIF file: 8EM1-1 +<<< Could not download PDB/mmCIF file: 8EPJ-1 +<<< Could not download PDB/mmCIF file: 8ER4-2 +<<< Could not download PDB/mmCIF file: 8EUS-2 +<<< Could not download PDB/mmCIF file: 8EXK-1 +<<< Could not download PDB/mmCIF file: 8EZW-3 +<<< Could not download PDB/mmCIF file: 8F2L-6 +<<< Could not download PDB/mmCIF file: 8F5N-1 +<<< Could not download PDB/mmCIF file: 8FBO-1 +<<< Could not download PDB/mmCIF file: 8FF6-1 +<<< Could not download PDB/mmCIF file: 8FIB-1 +<<< Could not download PDB/mmCIF file: 8FM2-3 +<<< Could not download PDB/mmCIF file: 8FO4-1 +<<< Could not download PDB/mmCIF file: 8FT8-1 +<<< Could not download PDB/mmCIF file: 8FX7-1 +<<< Could not download PDB/mmCIF file: 8G1N-1 +<<< Could not download PDB/mmCIF file: 8G62-1 +<<< Could not download PDB/mmCIF file: 8GBY-1 +<<< Could not download PDB/mmCIF file: 8GHF-1 +<<< Could not download PDB/mmCIF file: 8GMI-3 +<<< Could not download PDB/mmCIF file: 8GQV-2 +<<< Could not download PDB/mmCIF file: 8GSW-1 +<<< Could not download PDB/mmCIF file: 8H0R-1 +<<< Could not download PDB/mmCIF file: 8H9C-1 +<<< Could not download PDB/mmCIF file: 8HE0-1 +<<< Could not download PDB/mmCIF file: 8HJ0-1 +<<< Could not download PDB/mmCIF file: 8HN7-1 +<<< Could not download PDB/mmCIF file: 8HY4-1 +<<< Could not download PDB/mmCIF file: 8I2D-1 +<<< Could not download PDB/mmCIF file: 8I70-1 +<<< Could not download PDB/mmCIF file: 8IC9-2 +<<< Could not download PDB/mmCIF file: 8IIS-1 +<<< Could not download PDB/mmCIF file: 8IUK-1 +<<< Could not download PDB/mmCIF file: 8JBZ-1 +<<< Could not download PDB/mmCIF file: 8OG6-1 +<<< Could not download PDB/mmCIF file: 8OQC-1 +<<< Could not download PDB/mmCIF file: 8OWI-1 +<<< Could not download PDB/mmCIF file: 8PA6-1 +<<< Could not download PDB/mmCIF file: 8SBW-2 +<<< Could not download PDB/mmCIF file: 8SKH-1 +<<< Could not download PDB/mmCIF file: 8T1C-1 +<<< Too many missing values in total: 148l-1 +<<< Too many missing values in total: 1fvm-6 +<<< Sequence is too short: 2d1k-1 +<<< Sequence is too short: 2vdp-1 +<<< Sequence is too short: 3pma-2 +<<< Too many missing values in the middle: 3rg1-3 +<<< Too many missing values in the ends: 3wsr-2 +<<< Too many missing values in the ends: 4fqx-1 +<<< Unnatural amino acids found: 4gz8-1 +<<< Too many missing values in total: 4kbb-1 +<<< Too many missing values in the middle: 3k6s-5 +<<< Too many missing values in the ends: 4ycg-1 +<<< Too many missing values in the middle: 4zxb-1 +<<< Sequence is too short: 5djd-1 +<<< Too many missing values in the middle: 5es4-2 +<<< Sequence is too short: 5j4x-1 +<<< Unnatural amino acids found: 5jq3-1 +<<< Too many missing values in the middle: 5m3v-1 +<<< Sequence is too short: 5ujt-1 +<<< Too many missing values in total: 5w5s-1 +<<< Unnatural amino acids found: 6hs4-1 +<<< Unknown: 6m8p-4 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in the middle: 6plx-1 +<<< Some chains in the PDB do not appear in the fasta file: 6t2s-3 +<<< Some chains in the PDB do not appear in the fasta file: 6ytp-1 +<<< Some chains in the PDB do not appear in the fasta file: 7b6t-1 +<<< Too many missing values in total: 6x3x-1 +<<< Too many missing values in the middle: 7k9k-1 +<<< Unnatural amino acids found: 7l8x-1 +<<< Too many missing values in total: 7lkf-1 +<<< Too many missing values in the middle: 7mww-1 +<<< Too many missing values in total: 7or1-1 +<<< Incorrect alignment: 7puy-1 +<<< Sequence is too short: 7e9l-1 +<<< Too many missing values in the ends: 7uwm-1 +<<< Too many missing values in total: 7wfw-1 +<<< Too many missing values in the ends: 8as0-7 +<<< Too many missing values in total: 1a09-2 +<<< Too many missing values in total: 7m6e-1 +<<< Too many missing values in the middle: 1b3s-2 +<<< Too many missing values in the middle: 1b9y-1 +<<< Sequence is too short: 1b8h-1 +<<< Too many missing values in total: 1bm2-1 +<<< Sequence is too short: 1cmi-1 +<<< Sequence is too short: 1cq4-1 +<<< Sequence is too short: 1d4t-1 +<<< Sequence is too short: 1ctp-1 +<<< Sequence is too short: 1dei-3 +<<< Sequence is too short: 1d9i-1 +<<< Sequence is too short: 1dit-1 +<<< Too many missing values in the middle: 1dla-3 +<<< Too many missing values in the ends: 1f1j-5 +<<< Sequence is too short: 1ffo-1 +<<< Sequence is too short: 1fyt-1 +<<< Sequence is too short: 1g39-1 +<<< Sequence is too short: 1gwr-2 +<<< Too many missing values in total: 1h0g-1 +<<< Sequence is too short: 1hxy-1 +<<< Too many missing values in total: 1i7w-1 +<<< Too many missing values in total: 1iqk-1 +<<< Too many missing values in the middle: 1h8e-1 +<<< Sequence is too short: 1jht-1 +<<< Too many missing values in total: 1jni-1 +<<< Sequence is too short: 1k6f-3 +<<< Unnatural amino acids found: 1kga-1 +<<< Too many missing values in the ends: 1khq-1 +<<< Too many missing values in the middle: 1ky9-2 +<<< Sequence is too short: 1lvb-5 +<<< Sequence is too short: 1m7e-2 +<<< Sequence is too short: 1mk7-2 +<<< Sequence is too short: 1n5z-3 +<<< Too many missing values in total: 1n4r-5 +<<< Too many missing values in the middle: 1nju-2 +<<< Too many missing values in the ends: 1nrq-1 +<<< Too many missing values in total: 1o3p-1 +<<< Too many missing values in total: 1o5c-1 +<<< Sequence is too short: 1o6k-1 +<<< Sequence is too short: 1oqn-2 +<<< Too many missing values in the middle: 1ozt-4 +<<< Too many missing values in the middle: 1p13-1 +<<< Too many missing values in the ends: 1p4u-1 +<<< Sequence is too short: 1pfb-1 +<<< Too many missing values in total: 1q4q-1 +<<< Too many missing values in the middle: 1q7d-1 +<<< Too many missing values in the middle: 1qx7-4 +<<< Sequence is too short: 1rbe-2 +<<< Sequence is too short: 1s7q-1 +<<< Too many missing values in the middle: 1smr-9 +<<< Too many missing values in the middle: 1t2v-1 +<<< Sequence is too short: 1t5w-1 +<<< Too many missing values in the middle: 1tgg-2 +<<< Sequence is too short: 1tvb-1 +<<< Too many missing values in total: 1u2m-1 +<<< Too many missing values in the middle: 1u83-2 +<<< Too many missing values in the ends: 1ud0-3 +<<< Sequence is too short: 1uma-1 +<<< Too many missing values in the middle: 1vh1-1 +<<< Too many missing values in total: 1w7q-2 +<<< Sequence is too short: 1xda-1 +<<< Sequence is too short: 1ypj-1 +<<< Too many missing values in the middle: 1ytj-1 +<<< Too many missing values in total: 1zea-1 +<<< Sequence is too short: 1zmi-4 +<<< Sequence is too short: 1zhb-4 +<<< Too many missing values in the middle: 1zw0-13 +<<< Sequence is too short: 1zuz-1 +<<< Sequence is too short: 1zsd-1 +<<< Too many missing values in the middle: 1zyc-2 +<<< Too many missing values in the middle: 2abz-1 +<<< Sequence is too short: 2ak4-3 +<<< Too many missing values in the middle: 2at2-1 +<<< Too many missing values in the ends: 2b1a-1 +<<< Too many missing values in total: 2bd2-1 +<<< Sequence is too short: 2bst-1 +<<< Sequence is too short: 2c2l-4 +<<< Too many missing values in the middle: 2cfv-1 +<<< Too many missing values in the ends: 2d11-2 +<<< Too many missing values in the ends: 2df6-2 +<<< Too many missing values in the middle: 2dpx-2 +<<< Too many missing values in the middle: 2drt-1 +<<< Too many missing values in the middle: 2egu-2 +<<< Too many missing values in the middle: 2f0a-4 +<<< Too many missing values in the ends: 2f8e-1 +<<< Too many missing values in total: 2fiv-1 +<<< Sequence is too short: 2fmi-2 +<<< Too many missing values in total: 2fo5-3 +<<< Sequence is too short: 2fym-2 +<<< Too many missing values in the middle: 2hww-1 +<<< Too many missing values in the middle: 2i0i-1 +<<< Sequence is too short: 2hpc-2 +<<< Sequence is too short: 2ins-2 +<<< Sequence is too short: 2j8u-2 +<<< Sequence is too short: 2nw3-1 +<<< Too many missing values in the middle: 2o1w-4 +<<< Too many missing values in the middle: 2o97-1 +<<< Sequence is too short: 2omq-1 +<<< Sequence is too short: 2opz-2 +<<< Too many missing values in the middle: 2ozo-1 +<<< Too many missing values in the middle: 2nut-1 +<<< Sequence is too short: 2p15-1 +<<< Sequence is too short: 2pm5-3 +<<< Sequence is too short: 2pv9-1 +<<< Too many missing values in the middle: 2q7t-1 +<<< Too many missing values in the ends: 2qa7-1 +<<< Too many missing values in the middle: 2qf9-1 +<<< Too many missing values in the ends: 2qj9-1 +<<< Too many missing values in the middle: 2qo7-1 +<<< Too many missing values in the middle: 2qqs-1 +<<< Unnatural amino acids found: 2v5i-1 +<<< Too many missing values in the middle: 2vgc-2 +<<< Sequence is too short: 2vo6-1 +<<< Too many missing values in the ends: 2wph-1 +<<< Sequence is too short: 2ws6-3 +<<< Too many missing values in the middle: 2wuq-1 +<<< Too many missing values in the middle: 2xzd-2 +<<< Sequence is too short: 2xum-1 +<<< Too many missing values in the ends: 2yek-2 +<<< Too many missing values in the middle: 2ygv-3 +<<< Too many missing values in the middle: 2yxj-1 +<<< Too many missing values in the ends: 2z5n-2 +<<< Too many missing values in the middle: 2zkz-3 +<<< Sequence is too short: 2zmj-1 +<<< Too many missing values in the middle: 2zix-1 +<<< Too many missing values in the middle: 2zhr-2 +<<< Too many missing values in the middle: 2ztt-1 +<<< Sequence is too short: 3a1h-2 +<<< Too many missing values in total: 2zsi-1 +<<< Too many missing values in total: 3a5z-2 +<<< Too many missing values in total: 3aln-3 +<<< Too many missing values in the middle: 3bbp-6 +<<< Too many missing values in total: 3bzx-2 +<<< Too many missing values in total: 3bts-1 +<<< Too many missing values in total: 3cbp-1 +<<< Too many missing values in total: 3che-2 +<<< Too many missing values in the middle: 3cra-1 +<<< Too many missing values in total: 3cy3-1 +<<< Too many missing values in the middle: 3d8e-1 +<<< Too many missing values in the middle: 3dcx-1 +<<< Too many missing values in the middle: 3dgs-2 +<<< Sequence is too short: 3dne-1 +<<< Too many missing values in total: 3drt-1 +<<< Too many missing values in the ends: 3e1i-2 +<<< Too many missing values in the middle: 3eb0-3 +<<< Sequence is too short: 3e8c-2 +<<< Too many missing values in total: 3ehf-2 +<<< Too many missing values in total: 3egg-2 +<<< Too many missing values in total: 3ewf-5 +<<< Too many missing values in total: 3f5r-1 +<<< Too many missing values in the middle: 3f86-1 +<<< Too many missing values in the middle: 3f9x-3 +<<< Too many missing values in the middle: 3fal-3 +<<< Too many missing values in the middle: 3fif-8 +<<< Sequence is too short: 3fod-3 +<<< Too many missing values in the middle: 3fz3-1 +<<< Sequence is too short: 3g5y-1 +<<< Sequence is too short: 3ggw-1 +<<< Too many missing values in total: 3gj7-2 +<<< Too many missing values in the middle: 3h2q-1 +<<< Too many missing values in the middle: 3h7x-1 +<<< Too many missing values in the middle: 3hff-2 +<<< Sequence is too short: 3h9q-2 +<<< Too many missing values in total: 3hqm-1 +<<< Too many missing values in the middle: 3hyh-2 +<<< Too many missing values in the middle: 3hvl-3 +<<< Sequence is too short: 3i6k-1 +<<< Too many missing values in the middle: 3iih-1 +<<< Too many missing values in the middle: 3iml-2 +<<< Sequence is too short: 3iux-2 +<<< Sequence is too short: 3jq5-1 +<<< Sequence is too short: 3kf9-1 +<<< Unknown: 3knr-4 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Sequence is too short: 3i7o-1 +<<< Too many missing values in the middle: 3l13-1 +<<< Too many missing values in the middle: 3l6t-2 +<<< Unknown: 3l8r-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3l9u-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lbz-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3ld2-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in total: 3lay-1 +<<< Unknown: 3le5-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lf6-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3li6-4 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lh9-2 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lg7-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3liq-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3ljx-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3llr-4 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lkn-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in the middle: 3lpm-1 +<<< Too many missing values in the middle: 3lsy-1 +<<< Too many missing values in total: 3mbu-3 +<<< Too many missing values in total: 3met-2 +<<< Too many missing values in total: 3mh5-1 +<<< Too many missing values in total: 3m4w-1 +<<< Too many missing values in the middle: 3mmn-1 +<<< Too many missing values in the middle: 3mks-2 +<<< Sequence is too short: 3mls-2 +<<< Too many missing values in the middle: 3mwh-1 +<<< Sequence is too short: 3mro-1 +<<< Sequence is too short: 3mvj-1 +<<< Incorrect alignment: 3nbj-2 +<<< Sequence is too short: 3nfk-1 +<<< Too many missing values in total: 3nmx-2 +<<< Too many missing values in the middle: 3nsu-2 +<<< Too many missing values in total: 3o34-1 +<<< Sequence is too short: 3omk-1 +<<< Too many missing values in total: 3oq0-7 +<<< Unnatural amino acids found: 3ou0-2 +<<< Sequence is too short: 3p33-4 +<<< Too many missing values in total: 3ofi-2 +<<< Sequence is too short: 3pk1-1 +<<< Sequence is too short: 3pfv-2 +<<< Sequence is too short: 3pwj-2 +<<< Too many missing values in the middle: 3q15-2 +<<< Sequence is too short: 3q6s-1 +<<< Too many missing values in the middle: 3q9i-1 +<<< Too many missing values in the middle: 3qg2-1 +<<< Sequence is too short: 3qjn-3 +<<< Too many missing values in total: 3qxy-2 +<<< Too many missing values in the middle: 3r7r-1 +<<< Too many missing values in the ends: 3ray-1 +<<< Too many missing values in the middle: 3rbw-2 +<<< Sequence is too short: 3rew-1 +<<< Too many missing values in the middle: 3rj3-2 +<<< Too many missing values in the ends: 3r1r-3 +<<< Sequence is too short: 3rwd-1 +<<< Too many missing values in the ends: 3s90-2 +<<< Too many missing values in total: 3shv-2 +<<< Too many missing values in the middle: 3sl0-2 +<<< Too many missing values in total: 3sow-1 +<<< Sequence is too short: 3ssb-2 +<<< Too many missing values in total: 3sui-1 +<<< Too many missing values in the middle: 3swc-1 +<<< Too many missing values in the middle: 3t30-2 +<<< Too many missing values in the ends: 3t1u-1 +<<< Sequence is too short: 3tie-2 +<<< Sequence is too short: 3tcg-6 +<<< Too many missing values in the ends: 3tje-1 +<<< Too many missing values in the middle: 3tvz-1 +<<< Too many missing values in total: 3t5v-2 +<<< Too many missing values in total: 3u3d-1 +<<< Too many missing values in total: 3uf7-1 +<<< Sequence is too short: 3uvk-1 +<<< Too many missing values in the middle: 3v6m-2 +<<< Sequence is too short: 3vj6-1 +<<< Incorrect alignment: 3von-18 +<<< Too many missing values in the middle: 3vrq-2 +<<< Too many missing values in the middle: 3w20-1 +<<< Sequence is too short: 3w0j-1 +<<< Too many missing values in the middle: 3wfn-3 +<<< Too many missing values in the middle: 3zdt-1 +<<< Too many missing values in total: 3w3w-1 +<<< Too many missing values in total: 3x3f-1 +<<< Too many missing values in the middle: 3zkj-1 +<<< Too many missing values in total: 3wgu-1 +<<< Sequence is too short: 3zrk-1 +<<< Too many missing values in the ends: 4afz-2 +<<< Too many missing values in total: 4apr-1 +<<< Too many missing values in the middle: 4b95-3 +<<< Sequence is too short: 4bah-1 +<<< Too many missing values in the middle: 4bj3-1 +<<< Too many missing values in total: 4bwq-1 +<<< Too many missing values in total: 4c5h-1 +<<< Too many missing values in total: 4chg-2 +<<< Too many missing values in total: 4ccn-1 +<<< Too many missing values in the middle: 4dor-1 +<<< Sequence is too short: 4d11-1 +<<< Too many missing values in the middle: 4dyv-1 +<<< Sequence is too short: 4e17-1 +<<< Sequence is too short: 4ekk-2 +<<< Sequence is too short: 4ep3-1 +<<< Too many missing values in the middle: 4etu-1 +<<< Sequence is too short: 4esg-2 +<<< Too many missing values in the middle: 4ezq-2 +<<< Sequence is too short: 4fgt-1 +<<< Sequence is too short: 4fm6-1 +<<< Too many missing values in the middle: 4fo0-1 +<<< Too many missing values in the middle: 4fvt-1 +<<< Sequence is too short: 4g0d-3 +<<< Too many missing values in the middle: 4go6-1 +<<< Too many missing values in total: 4gow-1 +<<< Too many missing values in total: 4gye-1 +<<< Too many missing values in total: 4h3k-2 +<<< Sequence is too short: 4i5b-2 +<<< Too many missing values in the middle: 4iao-1 +<<< Sequence is too short: 4ins-4 +<<< Sequence is too short: 4iv4-1 +<<< Sequence is too short: 4j9f-3 +<<< Sequence is too short: 4j78-1 +<<< Sequence is too short: 4j82-2 +<<< Too many missing values in the middle: 4jcq-3 +<<< Too many missing values in total: 4jj8-1 +<<< Too many missing values in the ends: 4jok-2 +<<< Too many missing values in total: 4jqi-3 +<<< Too many missing values in total: 4k45-1 +<<< Sequence is too short: 4jzw-1 +<<< Too many missing values in total: 4kml-1 +<<< Too many missing values in total: 4l58-1 +<<< Sequence is too short: 4laj-1 +<<< Too many missing values in the ends: 4lk9-1 +<<< Too many missing values in total: 4m6b-2 +<<< Sequence is too short: 4mj5-1 +<<< Sequence is too short: 4mnw-1 +<<< Sequence is too short: 4mzl-2 +<<< Too many missing values in the middle: 4m8n-2 +<<< Too many missing values in the middle: 4nj7-16 +<<< Unnatural amino acids found: 4nkq-1 +<<< Too many missing values in total: 4nms-1 +<<< Sequence is too short: 4ny3-2 +<<< Too many missing values in total: 4oed-1 +<<< Sequence is too short: 4ok1-1 +<<< Too many missing values in the middle: 4oz7-2 +<<< Too many missing values in the ends: 4p30-1 +<<< Too many missing values in total: 4p0a-1 +<<< Too many missing values in the middle: 4on9-3 +<<< Too many missing values in the ends: 4pa6-1 +<<< Too many missing values in the middle: 4pdn-1 +<<< Too many missing values in the middle: 4phx-1 +<<< Too many missing values in the middle: 4pw8-1 +<<< Sequence is too short: 4qbq-1 +<<< Too many missing values in the middle: 4qrh-2 +<<< Sequence is too short: 4qx8-1 +<<< Sequence is too short: 4r8m-2 +<<< Sequence is too short: 4rme-1 +<<< Sequence is too short: 4rof-2 +<<< Sequence is too short: 4rt4-1 +<<< Too many missing values in total: 4rr2-1 +<<< Too many missing values in total: 4rwd-1 +<<< Sequence is too short: 4tky-3 +<<< Too many missing values in total: 4tot-3 +<<< Too many missing values in the middle: 4tn7-2 +<<< Too many missing values in the middle: 4tyj-1 +<<< Too many missing values in the middle: 4u9e-1 +<<< Too many missing values in the middle: 4up2-4 +<<< Sequence is too short: 4uu7-1 +<<< Too many missing values in total: 4uw2-3 +<<< Sequence is too short: 4w50-1 +<<< Unknown: 4v7n-13 +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert + for (chain,) in pdb_entry.get_chains(): +ValueError: too many values to unpack (expected 1) + +<<< Unknown: 4v45-3 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Sequence is too short: 4wjq-1 +<<< Too many missing values in the middle: 4wov-3 +<<< Too many missing values in total: 4wx8-1 +<<< Too many missing values in the middle: 4x0s-1 +<<< Too many missing values in total: 4v1v-1 +<<< Too many missing values in total: 4xi7-1 +<<< Too many missing values in total: 4xyi-1 +<<< Too many missing values in the ends: 4y66-1 +<<< Sequence is too short: 4wz9-1 +<<< Too many missing values in total: 4z29-2 +<<< Too many missing values in total: 4z8m-1 +<<< Too many missing values in the ends: 4zp3-6 +<<< Too many missing values in the middle: 4zqk-1 +<<< Sequence is too short: 5a53-1 +<<< Sequence is too short: 5ajk-3 +<<< Too many missing values in the middle: 5b7b-1 +<<< Unnatural amino acids found: 5bu8-1 +<<< Too many missing values in the middle: 5c01-1 +<<< Too many missing values in total: 5c13-1 +<<< Too many missing values in the middle: 5c59-6 +<<< Too many missing values in the middle: 5cwv-2 +<<< Too many missing values in total: 5cxt-6 +<<< Too many missing values in the ends: 5d56-1 +<<< Too many missing values in total: 5dhm-2 +<<< Sequence is too short: 5dmf-1 +<<< Sequence is too short: 5dow-3 +<<< Too many missing values in the middle: 5dsc-2 +<<< Too many missing values in the middle: 5dxb-1 +<<< Too many missing values in the middle: 5e4l-2 +<<< Too many missing values in total: 5e8d-1 +<<< Too many missing values in the middle: 5e0w-1 +<<< Too many missing values in the middle: 5ej0-1 +<<< Some chains in the PDB do not appear in the fasta file: 5exc-2 +<<< Too many missing values in the middle: 5f7c-1 +<<< Sequence is too short: 5f88-2 +<<< Too many missing values in the middle: 5go3-1 +<<< Sequence is too short: 5gp7-1 +<<< Too many missing values in the middle: 5gvi-1 +<<< Too many missing values in the ends: 5gu4-2 +<<< Too many missing values in the middle: 5h5a-3 +<<< Sequence is too short: 5hed-1 +<<< Sequence is too short: 5h94-2 +<<< Too many missing values in the middle: 5hfj-3 +<<< Sequence is too short: 5fq6-1 +<<< Sequence is too short: 5hhn-1 +<<< Sequence is too short: 5hox-2 +<<< Sequence is too short: 5icz-1 +<<< Sequence is too short: 5iqn-2 +<<< Sequence is too short: 5iop-1 +<<< Too many missing values in total: 5izt-2 +<<< Sequence is too short: 5isz-1 +<<< Too many missing values in total: 5jer-3 +<<< Too many missing values in the middle: 5jhb-1 +<<< Too many missing values in total: 5ix2-1 +<<< Too many missing values in total: 5jja-1 +<<< Sequence is too short: 5jwd-1 +<<< Sequence is too short: 5jzy-1 +<<< Too many missing values in the middle: 5k19-1 +<<< Unnatural amino acids found: 5k4l-2 +<<< Sequence is too short: 5ksv-1 +<<< Too many missing values in the middle: 5kxj-2 +<<< Too many missing values in the middle: 5ls6-3 +<<< Too many missing values in total: 5lut-1 +<<< Too many missing values in the middle: 5lye-1 +<<< Unnatural amino acids found: 5me3-1 +<<< Sequence is too short: 5mlw-2 +<<< Too many missing values in the ends: 5mk1-3 +<<< Too many missing values in total: 5mst-1 +<<< Too many missing values in the middle: 5mvg-1 +<<< Too many missing values in total: 5n10-1 +<<< Too many missing values in total: 5mub-5 +<<< Too many missing values in total: 5mu0-3 +<<< Too many missing values in total: 5n74-1 +<<< Too many missing values in total: 5n9p-1 +<<< Sequence is too short: 5nc7-3 +<<< Too many missing values in the middle: 5nne-1 +<<< Too many missing values in the middle: 5npv-2 +<<< Sequence is too short: 5n4d-2 +<<< Sequence is too short: 5o9t-2 +<<< Too many missing values in the middle: 5oup-1 +<<< Too many missing values in the middle: 5o7a-1 +<<< Too many missing values in total: 5oo6-4 +<<< Sequence is too short: 5q0k-1 +<<< Sequence is too short: 5q1e-1 +<<< Too many missing values in the middle: 5r48-1 +<<< Too many missing values in the middle: 5s5w-1 +<<< Too many missing values in the middle: 5sb9-1 +<<< Sequence is too short: 5t1k-2 +<<< Sequence is too short: 5t8r-6 +<<< Sequence is too short: 5t7g-1 +<<< Too many missing values in total: 5twg-1 +<<< Sequence is too short: 5u62-1 +<<< Sequence is too short: 5urt-1 +<<< Sequence is too short: 5uwm-1 +<<< Sequence is too short: 5va6-2 +<<< Too many missing values in the middle: 5vlq-1 +<<< Too many missing values in the middle: 5vvo-1 +<<< Sequence is too short: 5vx3-2 +<<< Sequence is too short: 5vyo-4 +<<< Too many missing values in the middle: 5w5o-6 +<<< Too many missing values in the ends: 5w4e-1 +<<< Too many missing values in the middle: 5wer-1 +<<< Sequence is too short: 5wg1-1 +<<< Sequence is too short: 5wli-2 +<<< Sequence is too short: 5wy2-2 +<<< Sequence is too short: 5x54-1 +<<< Too many missing values in total: 5ve8-1 +<<< Too many missing values in total: 5x6c-1 +<<< Too many missing values in the middle: 5yc2-2 +<<< Sequence is too short: 5yd4-3 +<<< Too many missing values in the middle: 5yj1-12 +<<< Too many missing values in the middle: 5yva-1 +<<< Too many missing values in total: 5xoj-1 +<<< Too many missing values in the ends: 5z72-3 +<<< Too many missing values in total: 5z8n-2 +<<< Too many missing values in the middle: 5zia-2 +<<< Too many missing values in the ends: 5zv3-1 +<<< Too many missing values in the ends: 5zwx-2 +<<< Sequence is too short: 6av8-1 +<<< Too many missing values in the middle: 6b4c-10 +<<< Too many missing values in total: 6b67-1 +<<< Too many missing values in the ends: 6bg1-1 +<<< Too many missing values in total: 6bpe-3 +<<< Sequence is too short: 6bwz-1 +<<< Too many missing values in total: 6c4u-1 +<<< Sequence is too short: 6cnu-2 +<<< Too many missing values in the middle: 6cqo-3 +<<< Too many missing values in the middle: 6czn-1 +<<< Too many missing values in the middle: 6cw3-1 +<<< Too many missing values in total: 6dca-2 +<<< Unnatural amino acids found: 6bcx-1 +<<< Sequence is too short: 6dn8-3 +<<< Sequence is too short: 6dtg-1 +<<< Too many missing values in total: 6ecf-3 +<<< Too many missing values in the middle: 6et3-1 +<<< Too many missing values in the middle: 6eyn-3 +<<< Sequence is too short: 6ewo-2 +<<< Too many missing values in the middle: 6ffj-3 +<<< Too many missing values in the middle: 6fjy-2 +<<< Too many missing values in the middle: 6fel-1 +<<< Too many missing values in the middle: 6fyz-1 +<<< Too many missing values in the middle: 6g2z-1 +<<< Too many missing values in total: 6g07-1 +<<< Sequence is too short: 6g6c-4 +<<< Too many missing values in the middle: 6g8l-1 +<<< Too many missing values in the middle: 6gmn-3 +<<< Too many missing values in total: 6grg-1 +<<< Too many missing values in total: 6h06-1 +<<< Sequence is too short: 6hos-2 +<<< Too many missing values in the ends: 6hm5-1 +<<< Incorrect alignment: 6ikm-8 +<<< Too many missing values in total: 6isb-1 +<<< Unknown: 6igc-6 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in total: 6j19-1 +<<< Too many missing values in the ends: 6j7b-1 +<<< Sequence is too short: 6j2d-1 +<<< Too many missing values in the middle: 6jck-1 +<<< Too many missing values in the middle: 6jqv-1 +<<< Too many missing values in the middle: 6kgv-1 +<<< Too many missing values in the ends: 6kdr-1 +<<< Too many missing values in the middle: 6kwb-3 +<<< Too many missing values in the middle: 6kzg-1 +<<< Too many missing values in total: 6kr4-3 +<<< Too many missing values in total: 6lhu-1 +<<< Too many missing values in the middle: 6lzk-2 +<<< Too many missing values in the middle: 6m7f-2 +<<< Sequence is too short: 6m4z-1 +<<< Sequence is too short: 6mbj-2 +<<< Too many missing values in the middle: 6mkh-1 +<<< Sequence is too short: 6me1-2 +<<< Sequence is too short: 6mpm-1 +<<< Too many missing values in the middle: 6mta-3 +<<< Too many missing values in the ends: 6mwh-1 +<<< Sequence is too short: 6nca-11 +<<< Too many missing values in total: 6nzz-1 +<<< Sequence is too short: 6o3w-2 +<<< Too many missing values in total: 6nuu-1 +<<< Sequence is too short: 6o9b-1 +<<< Too many missing values in total: 6oi3-1 +<<< Too many missing values in total: 6osj-1 +<<< Too many missing values in the ends: 6of7-1 +<<< Too many missing values in the ends: 6p2p-1 +<<< Too many missing values in the middle: 6o7d-1 +<<< Sequence is too short: 6phl-1 +<<< Too many missing values in total: 6pit-1 +<<< Too many missing values in total: 6psd-3 +<<< Too many missing values in the middle: 6pw5-1 +<<< Sequence is too short: 6q0m-2 +<<< Sequence is too short: 6q5n-1 +<<< Sequence is too short: 6qc0-1 +<<< Too many missing values in the middle: 6qpc-1 +<<< Sequence is too short: 6qqg-1 +<<< Too many missing values in total: 6qsz-2 +<<< Sequence is too short: 6r50-1 +<<< Too many missing values in total: 6qio-1 +<<< Too many missing values in the ends: 6rgn-1 +<<< Too many missing values in the ends: 6rrk-2 +<<< Too many missing values in total: 6rxm-3 +<<< Unnatural amino acids found: 6sdr-1 +<<< Too many missing values in the middle: 6squ-1 +<<< Sequence is too short: 6ssq-1 +<<< Some chains in the PDB do not appear in the fasta file: 6sx4-2 +<<< Some chains in the PDB do not appear in the fasta file: 6t9m-1 +<<< Some chains in the PDB do not appear in the fasta file: 6t5o-2 +<<< Some chains in the PDB do not appear in the fasta file: 6tkp-2 +<<< Sequence is too short: 6tq0-4 +<<< Some chains in the PDB do not appear in the fasta file: 6tnl-2 +<<< Too many missing values in total: 6txb-2 +<<< Too many missing values in total: 6u39-10 +<<< Too many missing values in the middle: 6u8g-1 +<<< Too many missing values in the middle: 6ug3-1 +<<< Too many missing values in the middle: 6uie-2 +<<< Too many missing values in total: 6uyz-2 +<<< Sequence is too short: 6v3n-2 +<<< Too many missing values in the middle: 6vrg-2 +<<< Too many missing values in the ends: 6vxn-1 +<<< Sequence is too short: 6wa0-3 +<<< Unknown: 6wat-3 +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert + for (chain,) in pdb_entry.get_chains(): +ValueError: too many values to unpack (expected 1) + +<<< Too many missing values in the ends: 6wfx-1 +<<< Too many missing values in total: 6wi3-2 +<<< Incorrect alignment: 6x0a-18 +<<< Too many missing values in total: 6y0d-1 +<<< Some chains in the PDB do not appear in the fasta file: 6xwk-1 +<<< Too many missing values in total: 6ybu-2 +<<< Too many missing values in the ends: 6yie-2 +<<< Sequence is too short: 6yo8-1 +<<< Sequence is too short: 6yx0-2 +<<< Some chains in the PDB do not appear in the fasta file: 6z3n-1 +<<< Some chains in the PDB do not appear in the fasta file: 6z66-1 +<<< Sequence is too short: 6z7w-4 +<<< Some chains in the PDB do not appear in the fasta file: 6ziv-3 +<<< Too many missing values in the ends: 6yn0-1 +<<< Some chains in the PDB do not appear in the fasta file: 6zrx-4 +<<< Sequence is too short: 6zuw-1 +<<< Too many missing values in total: 6zwk-6 +<<< Too many missing values in total: 7ahc-1 +<<< Too many missing values in total: 7age-2 +<<< Too many missing values in total: 7azd-2 +<<< Too many missing values in the ends: 7b5g-3 +<<< Unexpected atoms (D): 7bbi-1 +<<< Too many missing values in the middle: 7bh9-1 +<<< Too many missing values in the ends: 7bos-1 +<<< Too many missing values in total: 7bqy-1 +<<< Too many missing values in total: 7bsd-2 +<<< Too many missing values in total: 7c8e-1 +<<< Too many missing values in total: 7cfd-1 +<<< Too many missing values in total: 7ciz-2 +<<< Too many missing values in total: 7ci2-2 +<<< Too many missing values in the middle: 7cva-1 +<<< Too many missing values in total: 7d0r-1 +<<< Too many missing values in total: 7d2p-1 +<<< Too many missing values in the middle: 7dfb-1 +<<< Too many missing values in the ends: 7dmw-2 +<<< Too many missing values in the middle: 7dq6-1 +<<< Too many missing values in total: 7drp-1 +<<< Too many missing values in total: 7dvp-1 +<<< Too many missing values in the middle: 7dad-1 +<<< Too many missing values in the middle: 7efy-1 +<<< Sequence is too short: 7egu-1 +<<< Sequence is too short: 7etu-1 +<<< Too many missing values in the ends: 7f2m-2 +<<< Sequence is too short: 7fb5-1 +<<< Unexpected atoms (D1): 7fg8-1 +<<< Too many missing values in the ends: 7fho-1 +<<< Too many missing values in the middle: 7jsd-4 +<<< Too many missing values in total: 7jn8-1 +<<< Sequence is too short: 7jwi-1 +<<< Too many missing values in the middle: 7k90-1 +<<< Too many missing values in the middle: 7kji-1 +<<< Too many missing values in total: 7kue-1 +<<< Too many missing values in total: 7kdt-1 +<<< Too many missing values in total: 7l7g-1 +<<< Too many missing values in the ends: 7law-1 +<<< Unnatural amino acids found: 7ln3-1 +<<< Too many missing values in the middle: 7lwl-1 +<<< Too many missing values in the ends: 7m53-1 +<<< Too many missing values in total: 7m71-1 +<<< Too many missing values in the middle: 7mvv-1 +<<< Too many missing values in the middle: 7n56-4 +<<< Too many missing values in total: 7n8i-1 +<<< Sequence is too short: 7nab-2 +<<< Some chains in the PDB do not appear in the fasta file: 7ne9-1 +<<< Too many missing values in total: 7ni4-1 +<<< Some chains in the PDB do not appear in the fasta file: 7nqg-1 +<<< Too many missing values in total: 7nrv-2 +<<< Sequence is too short: 7ntk-3 +<<< Some chains in the PDB do not appear in the fasta file: 7nm8-1 +<<< Too many missing values in the ends: 7nvi-1 +<<< Some chains in the PDB do not appear in the fasta file: 7od0-3 +<<< Some chains in the PDB do not appear in the fasta file: 7oet-1 +<<< Too many missing values in total: 7obl-1 +<<< Some chains in the PDB do not appear in the fasta file: 7olu-1 +<<< Some chains in the PDB do not appear in the fasta file: 7orp-1 +<<< Unnatural amino acids found: 7oxj-1 +<<< Some chains in the PDB do not appear in the fasta file: 7oz9-2 +<<< Some chains in the PDB do not appear in the fasta file: 7pgz-1 +<<< Unknown: 7pe5-1 +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert + for (chain,) in pdb_entry.get_chains(): +ValueError: too many values to unpack (expected 1) + +<<< Some chains in the PDB do not appear in the fasta file: 7p7n-1 +<<< Too many missing values in the middle: 7pqu-1 +<<< Sequence is too short: 7q1s-4 +<<< Unknown: 7q8i-2 +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert + for (chain,) in pdb_entry.get_chains(): +ValueError: too many values to unpack (expected 1) + +<<< Too many missing values in the middle: 7qie-1 +<<< Sequence is too short: 7qpj-1 +<<< Too many missing values in total: 7qqn-1 +<<< Too many missing values in the middle: 7rg7-1 +<<< Too many missing values in total: 7nkh-1 +<<< Sequence is too short: 7rly-3 +<<< Too many missing values in the middle: 7rn8-1 +<<< Sequence is too short: 7r1r-8 +<<< Too many missing values in total: 7rhk-1 +<<< Too many missing values in the middle: 7rxb-1 +<<< Too many missing values in the middle: 7s1t-3 +<<< Sequence is too short: 7s4g-1 +<<< Sequence is too short: 7s8q-1 +<<< Too many missing values in the middle: 7s7d-1 +<<< Too many missing values in the middle: 7st3-4 +<<< Too many missing values in the middle: 7t7t-2 +<<< Too many missing values in the middle: 7srr-1 +<<< Unknown: 7t66-2 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in the middle: 7tw9-1 +<<< Too many missing values in total: 7ue9-1 +<<< Sequence is too short: 7uyk-1 +<<< Too many missing values in total: 7v0m-1 +<<< Too many missing values in the middle: 7v7x-1 +<<< Too many missing values in the ends: 7vf2-1 +<<< Too many missing values in total: 7vph-1 +<<< Too many missing values in the middle: 7vvj-1 +<<< Too many missing values in the middle: 7wf7-1 +<<< Too many missing values in total: 7wy0-1 +<<< Too many missing values in the middle: 7x9s-1 +<<< Too many missing values in the middle: 7xdt-1 +<<< Too many missing values in the middle: 7xox-1 +<<< Too many missing values in the middle: 7xwi-1 +<<< Sequence is too short: 7yxd-4 +<<< Too many missing values in total: 7xsj-1 +<<< Too many missing values in total: 7z8m-1 +<<< Too many missing values in total: 8a5a-1 +<<< Too many missing values in the middle: 8bfe-4 +<<< Too many missing values in the middle: 8da2-1 +<<< Too many missing values in total: 8do8-1 +<<< Too many missing values in total: 8efu-1 +<<< Too many missing values in total: 8d7z-1 +<<< Too many missing values in the middle: 1pyy-1 +<<< Sequence is too short: 2g5b-1 +<<< Too many missing values in total: 2vdq-1 +<<< Too many missing values in the middle: 8f5o-1 +<<< Sequence is too short: 3hus-1 +<<< Sequence is too short: 3pma-3 +<<< Too many missing values in the middle: 3s88-1 +<<< Sequence is too short: 4bao-1 +<<< Too many missing values in total: 4kbb-2 +<<< Too many missing values in the middle: 4ui2-1 +<<< Too many missing values in the ends: 4yci-1 +<<< Sequence is too short: 5djx-1 +<<< Too many missing values in the middle: 5es4-3 +<<< Sequence is too short: 5j4x-2 +<<< Unnatural amino acids found: 5jq7-1 +<<< Sequence is too short: 5ujt-2 +<<< Too many missing values in total: 5w5u-1 +<<< Too many missing values in the middle: 6ht9-1 +<<< Too many missing values in total: 5hcc-1 +<<< Too many missing values in the middle: 6oej-1 +<<< Too many missing values in the middle: 6idf-1 +<<< Too many missing values in the middle: 6ply-1 +<<< Unknown: 6m8p-5 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in total: 6wdq-1 +<<< Too many missing values in total: 6xp6-1 +<<< Some chains in the PDB do not appear in the fasta file: 6ytp-2 +<<< Some chains in the PDB do not appear in the fasta file: 7b6t-2 +<<< Too many missing values in total: 6x3z-1 +<<< Too many missing values in total: 7la4-1 +<<< Too many missing values in total: 7lkh-1 +<<< Too many missing values in the middle: 7mwx-1 +<<< Too many missing values in the middle: 7m6m-1 +<<< Sequence is too short: 7o50-1 +<<< Too many missing values in the middle: 7rhr-1 +<<< Too many missing values in the middle: 7scj-1 +<<< Too many missing values in total: 7kmb-1 +<<< Too many missing values in the middle: 7uwn-1 +<<< Too many missing values in the ends: 8as0-8 +<<< Too many missing values in the middle: 16vp-1 +<<< Too many missing values in total: 1a09-3 +<<< Unknown: 8dli-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in the middle: 1aya-1 +<<< Sequence is too short: 1awq-1 +<<< Sequence is too short: 1bbr-1 +<<< Too many missing values in total: 1bm2-2 +<<< Sequence is too short: 1c9i-1 +<<< Sequence is too short: 1cmi-2 +<<< Too many missing values in the middle: 1dla-4 +<<< Too many missing values in the middle: 1dvk-1 +<<< Too many missing values in the middle: 1etk-1 +<<< Too many missing values in the middle: 1f32-1 +<<< Sequence is too short: 1ffo-2 +<<< Too many missing values in total: 1gi7-1 +<<< Unnatural amino acids found: 1h0h-1 +<<< Sequence is too short: 1hbt-1 +<<< Sequence is too short: 1him-1 +<<< Sequence is too short: 1hxz-1 +<<< Too many missing values in total: 1i7x-1 +<<< Too many missing values in total: 1iql-1 +<<< Sequence is too short: 1jbu-1 +<<< Too many missing values in the middle: 1jq6-1 +<<< Too many missing values in the ends: 1jp5-1 +<<< Sequence is too short: 1k8d-1 +<<< Unnatural amino acids found: 1kp0-1 +<<< Sequence is too short: 1m7e-3 +<<< Too many missing values in the middle: 1ml9-1 +<<< Sequence is too short: 1n5z-4 +<<< Too many missing values in total: 1n4r-6 +<<< Sequence is too short: 1nrr-1 +<<< Too many missing values in the middle: 1nju-3 +<<< Sequence is too short: 1nvq-1 +<<< Too many missing values in the ends: 1o5d-1 +<<< Sequence is too short: 1o6l-1 +<<< Sequence is too short: 1oqn-3 +<<< Too many missing values in the middle: 1ozu-1 +<<< Too many missing values in the middle: 1p13-2 +<<< Too many missing values in the ends: 1p4u-2 +<<< Too many missing values in the middle: 1pdg-1 +<<< Sequence is too short: 1pfb-2 +<<< Sequence is too short: 1p9u-1 +<<< Too many missing values in total: 1q4q-10 +<<< Too many missing values in the middle: 1q67-1 +<<< Sequence is too short: 1qd6-1 +<<< Too many missing values in the middle: 1qqg-1 +<<< Sequence is too short: 1r5v-1 +<<< Sequence is too short: 1rbf-1 +<<< Sequence is too short: 1s2k-1 +<<< Too many missing values in the ends: 1s94-1 +<<< Sequence is too short: 1sb1-1 +<<< Sequence is too short: 1s7r-1 +<<< Too many missing values in the middle: 1t2v-2 +<<< Sequence is too short: 1t5w-2 +<<< Sequence is too short: 1ta2-1 +<<< Sequence is too short: 1t08-1 +<<< Too many missing values in total: 1tu3-1 +<<< Sequence is too short: 1tvb-2 +<<< Too many missing values in total: 1tno-1 +<<< Sequence is too short: 1u9f-2 +<<< Too many missing values in the ends: 1ud0-4 +<<< Sequence is too short: 1unv-1 +<<< Too many missing values in the ends: 1vzq-1 +<<< Too many missing values in total: 1w7q-3 +<<< Too many missing values in the middle: 1xc4-1 +<<< Sequence is too short: 1xda-10 +<<< Too many missing values in the ends: 1x78-1 +<<< Too many missing values in total: 1xhm-1 +<<< Sequence is too short: 1ypk-1 +<<< Sequence is too short: 1zmi-5 +<<< Too many missing values in the middle: 1zw0-14 +<<< Too many missing values in the middle: 1zyd-1 +<<< Sequence is too short: 1zuz-2 +<<< Sequence is too short: 2ak4-4 +<<< Too many missing values in the ends: 2avu-1 +<<< Too many missing values in the middle: 2anc-1 +<<< Too many missing values in total: 2bd3-1 +<<< Unknown: 2c2m-1 +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1334, in get_coordinates_array + chain_crd[informative_mask]["unique_residue_number"].astype(int), + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/generic.py", line 6324, in astype + new_data = self._mgr.astype(dtype=dtype, copy=copy, errors=errors) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/internals/managers.py", line 451, in astype + return self.apply( + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/internals/managers.py", line 352, in apply + applied = getattr(b, f)(**kwargs) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/internals/blocks.py", line 511, in astype + new_values = astype_array_safe(values, dtype, copy=copy, errors=errors) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/dtypes/astype.py", line 242, in astype_array_safe + new_values = astype_array(values, dtype, copy=copy) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/dtypes/astype.py", line 187, in astype_array + values = _astype_nansafe(values, dtype, copy=copy) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/dtypes/astype.py", line 138, in _astype_nansafe + return arr.astype(dtype, copy=True) +ValueError: invalid literal for int() with base 10: '277_' + +<<< Sequence is too short: 2br8-1 +<<< Too many missing values in the middle: 2c8t-2 +<<< Too many missing values in the ends: 2d11-3 +<<< Too many missing values in total: 2dm9-1 +<<< Too many missing values in the middle: 2egu-3 +<<< Too many missing values in the middle: 2f0a-5 +<<< Too many missing values in the middle: 2fd4-1 +<<< Too many missing values in total: 2fo5-4 +<<< Sequence is too short: 2fx7-1 +<<< Too many missing values in total: 2g66-1 +<<< Sequence is too short: 2fym-3 +<<< Too many missing values in the middle: 2h2d-1 +<<< Too many missing values in the middle: 2hlr-1 +<<< Sequence is too short: 2hnt-1 +<<< Too many missing values in the middle: 2hww-2 +<<< Too many missing values in the middle: 2i0i-2 +<<< Sequence is too short: 2hpc-3 +<<< Sequence is too short: 2ins-3 +<<< Sequence is too short: 2iwb-1 +<<< Too many missing values in the middle: 2j1l-1 +<<< Too many missing values in the middle: 2o1w-5 +<<< Sequence is too short: 2o4j-1 +<<< Too many missing values in the middle: 2o97-2 +<<< Sequence is too short: 2pcu-1 +<<< Too many missing values in total: 2pbk-1 +<<< Sequence is too short: 2pm5-4 +<<< Sequence is too short: 2pv9-2 +<<< Too many missing values in the middle: 2q3v-1 +<<< Too many missing values in the middle: 2q7t-2 +<<< Too many missing values in the ends: 2qa7-2 +<<< Sequence is too short: 2qbw-1 +<<< Too many missing values in the ends: 2qja-1 +<<< Too many missing values in total: 2qqs-2 +<<< Too many missing values in the middle: 2r5f-1 +<<< Sequence is too short: 2qxm-1 +<<< Too many missing values in the middle: 2rfl-6 +<<< Too many missing values in the middle: 2rgo-3 +<<< Too many missing values in the middle: 2vgc-3 +<<< Sequence is too short: 2vo7-1 +<<< Too many missing values in the middle: 2vvg-1 +<<< Too many missing values in total: 2w2w-12 +<<< Too many missing values in the ends: 2wax-1 +<<< Too many missing values in the middle: 2woj-1 +<<< Too many missing values in the ends: 2wpi-1 +<<< Too many missing values in the middle: 2wqo-1 +<<< Sequence is too short: 2ws6-4 +<<< Too many missing values in the middle: 2xbx-1 +<<< Sequence is too short: 2xni-1 +<<< Too many missing values in total: 2xze-1 +<<< Sequence is too short: 2xum-2 +<<< Too many missing values in total: 2y5t-1 +<<< Too many missing values in total: 2ygv-4 +<<< Too many missing values in total: 2yvc-1 +<<< Too many missing values in total: 2z3c-1 +<<< Sequence is too short: 2zdv-1 +<<< Too many missing values in the middle: 2ztt-2 +<<< Too many missing values in the middle: 3a60-1 +<<< Too many missing values in total: 3ai6-1 +<<< Too many missing values in the middle: 3alo-1 +<<< Too many missing values in total: 3bbp-7 +<<< Too many missing values in total: 3bzx-3 +<<< Sequence is too short: 3c3q-1 +<<< Too many missing values in total: 3chf-1 +<<< Too many missing values in the middle: 3crc-1 +<<< Too many missing values in the middle: 3cwv-2 +<<< Sequence is too short: 3cvl-1 +<<< Too many missing values in the middle: 3d4b-1 +<<< Too many missing values in the middle: 3d8e-2 +<<< Too many missing values in the ends: 3d1e-1 +<<< Too many missing values in the middle: 3dcy-1 +<<< Sequence is too short: 3dux-1 +<<< Too many missing values in the middle: 3e1k-1 +<<< Unnatural amino acids found: 3e2o-1 +<<< Sequence is too short: 3e8c-3 +<<< Too many missing values in the middle: 3edm-1 +<<< Too many missing values in total: 3egh-1 +<<< Too many missing values in total: 3eul-4 +<<< Too many missing values in the middle: 3f86-2 +<<< Too many missing values in the middle: 3f9x-4 +<<< Too many missing values in the middle: 3eoe-1 +<<< Sequence is too short: 3fif-9 +<<< Sequence is too short: 3fpo-1 +<<< Sequence is too short: 3fod-4 +<<< Sequence is too short: 3fqr-1 +<<< Sequence is too short: 3fy2-1 +<<< Sequence is too short: 3ggw-2 +<<< Too many missing values in total: 3gj8-1 +<<< Unnatural amino acids found: 3gnn-1 +<<< Too many missing values in the middle: 3h2q-2 +<<< Too many missing values in the ends: 3h1p-1 +<<< Too many missing values in total: 3hqm-2 +<<< Too many missing values in the middle: 3hyh-3 +<<< Sequence is too short: 3i6k-2 +<<< Too many missing values in the middle: 3iep-1 +<<< Too many missing values in the middle: 3ihp-1 +<<< Too many missing values in the middle: 3ka0-1 +<<< Sequence is too short: 3i7p-1 +<<< Sequence is too short: 3kf9-2 +<<< Unknown: 3kp3-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Sequence is too short: 3l3d-1 +<<< Too many missing values in the middle: 3khd-1 +<<< Unknown: 3l9v-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3l8r-2 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3laz-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3ld2-2 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3le5-2 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lc0-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lha-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lf7-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3li8-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lir-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3ljy-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3llr-5 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lga-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lko-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in the ends: 3luo-1 +<<< Too many missing values in total: 3mbu-4 +<<< Sequence is too short: 3m1f-1 +<<< Too many missing values in total: 3mh5-2 +<<< Too many missing values in total: 3m4w-2 +<<< Too many missing values in total: 3meu-1 +<<< Too many missing values in the middle: 3mks-3 +<<< Sequence is too short: 3mls-3 +<<< Sequence is too short: 3mrp-1 +<<< Sequence is too short: 3mvj-2 +<<< Incorrect alignment: 3nbj-3 +<<< Too many missing values in the middle: 3ngq-1 +<<< Too many missing values in total: 3nfk-2 +<<< Too many missing values in total: 3nmx-3 +<<< Too many missing values in the middle: 3nru-6 +<<< Too many missing values in total: 3o35-1 +<<< Too many missing values in the ends: 3o45-1 +<<< Too many missing values in the middle: 3odn-1 +<<< Too many missing values in the ends: 3oj3-1 +<<< Too many missing values in the ends: 3oq0-8 +<<< Sequence is too short: 3omk-2 +<<< Unnatural amino acids found: 3ou0-3 +<<< Too many missing values in the middle: 3p27-1 +<<< Too many missing values in the middle: 3p34-1 +<<< Sequence is too short: 3ogl-5 +<<< Too many missing values in the ends: 3pcx-1 +<<< Sequence is too short: 3pk1-2 +<<< Too many missing values in the middle: 3pqj-1 +<<< Sequence is too short: 3q6s-2 +<<< Too many missing values in the middle: 3q9i-2 +<<< Sequence is too short: 3qjn-4 +<<< Too many missing values in the middle: 3qku-2 +<<< Too many missing values in the middle: 3rbw-3 +<<< Sequence is too short: 3rew-2 +<<< Sequence is too short: 3rwd-2 +<<< Too many missing values in the middle: 3shw-1 +<<< Too many missing values in the middle: 3sl1-1 +<<< Too many missing values in total: 3sow-2 +<<< Sequence is too short: 3so6-1 +<<< Too many missing values in the middle: 3sti-1 +<<< Too many missing values in total: 3r1r-7 +<<< Too many missing values in total: 3swc-2 +<<< Sequence is too short: 3tcg-7 +<<< Too many missing values in the middle: 3tsw-1 +<<< Too many missing values in the middle: 3tvz-2 +<<< Unnatural amino acids found: 3tuv-1 +<<< Sequence is too short: 3uq3-1 +<<< Too many missing values in the ends: 3uua-1 +<<< Sequence is too short: 3uvl-1 +<<< Too many missing values in the middle: 3v6m-3 +<<< Too many missing values in the ends: 3vb4-1 +<<< Too many missing values in the middle: 3vrq-3 +<<< Sequence is too short: 3vt7-1 +<<< Too many missing values in the middle: 3w21-1 +<<< Too many missing values in the middle: 3wv5-2 +<<< Too many missing values in total: 3w3x-1 +<<< Too many missing values in the middle: 3zfm-1 +<<< Too many missing values in the middle: 3zkj-2 +<<< Sequence is too short: 3zin-1 +<<< Too many missing values in the ends: 3zrk-2 +<<< Too many missing values in total: 3wgu-2 +<<< Too many missing values in the ends: 4a9i-2 +<<< Sequence is too short: 4aif-1 +<<< Too many missing values in the middle: 4an4-2 +<<< Too many missing values in the middle: 4b95-4 +<<< Too many missing values in the ends: 4b3b-1 +<<< Too many missing values in the middle: 4bpu-3 +<<< Too many missing values in the middle: 4by2-1 +<<< Too many missing values in the ends: 4bwq-2 +<<< Too many missing values in total: 4c5i-1 +<<< Too many missing values in the middle: 4ckw-1 +<<< Too many missing values in total: 4chg-3 +<<< Too many missing values in the ends: 4cco-1 +<<< Too many missing values in the middle: 4dor-2 +<<< Sequence is too short: 4d11-2 +<<< Sequence is too short: 4ds1-1 +<<< Too many missing values in the middle: 4dyv-2 +<<< Too many missing values in the middle: 4e18-1 +<<< Too many missing values in the ends: 4ec6-1 +<<< Too many missing values in total: 4edn-1 +<<< Too many missing values in the middle: 4etv-1 +<<< Too many missing values in the middle: 4ezq-3 +<<< Too many missing values in total: 4fbw-1 +<<< Too many missing values in the middle: 4fo0-2 +<<< Too many missing values in the middle: 4fr3-1 +<<< Sequence is too short: 4g0d-4 +<<< Too many missing values in total: 4g69-1 +<<< Too many missing values in the ends: 4gi3-1 +<<< Too many missing values in the middle: 4go6-2 +<<< Too many missing values in the ends: 4gw8-1 +<<< Sequence is too short: 4ht6-1 +<<< Too many missing values in the middle: 4hxz-2 +<<< Sequence is too short: 4i31-1 +<<< Sequence is too short: 4ie9-1 +<<< Too many missing values in the middle: 4iao-2 +<<< Sequence is too short: 4ins-5 +<<< Too many missing values in the middle: 4iu9-2 +<<< Sequence is too short: 4iyf-1 +<<< Too many missing values in the middle: 4iv5-1 +<<< Sequence is too short: 4j2l-1 +<<< Sequence is too short: 4j9g-1 +<<< Too many missing values in total: 4j83-1 +<<< Sequence is too short: 4j79-1 +<<< Too many missing values in the middle: 4jcq-4 +<<< Too many missing values in total: 4jj8-2 +<<< Too many missing values in total: 4jol-1 +<<< Sequence is too short: 4jrx-1 +<<< Sequence is too short: 4k6y-1 +<<< Sequence is too short: 4jzw-2 +<<< Too many missing values in the middle: 4kv1-1 +<<< Sequence is too short: 4kts-1 +<<< Sequence is too short: 4laj-2 +<<< Too many missing values in the middle: 4lei-1 +<<< Too many missing values in the middle: 4lj2-1 +<<< Too many missing values in total: 4lka-1 +<<< Sequence is too short: 4ln2-1 +<<< Too many missing values in the middle: 4m6e-1 +<<< Sequence is too short: 4mj6-1 +<<< Too many missing values in the ends: 4mpz-1 +<<< Sequence is too short: 4mnx-1 +<<< Too many missing values in the middle: 4mzm-1 +<<< Unexpected atoms (D): 4n9s-1 +<<< Too many missing values in the middle: 4nim-1 +<<< Sequence is too short: 4nms-2 +<<< Too many missing values in the middle: 4nnx-1 +<<< Too many missing values in the middle: 4ob9-1 +<<< Too many missing values in total: 4oiu-1 +<<< Unnatural amino acids found: 4our-1 +<<< Too many missing values in total: 4p0a-2 +<<< Too many missing values in the ends: 4p30-2 +<<< Too many missing values in the middle: 4p3v-1 +<<< Too many missing values in the ends: 4pa6-2 +<<< Too many missing values in the middle: 4pk1-1 +<<< Sequence is too short: 4pp5-1 +<<< Too many missing values in the middle: 4pw8-2 +<<< Too many missing values in total: 4q13-1 +<<< Sequence is too short: 4qbr-1 +<<< Too many missing values in the middle: 4qts-1 +<<< Too many missing values in the ends: 4qx8-2 +<<< Too many missing values in the middle: 4r3p-1 +<<< Too many missing values in total: 4rcp-1 +<<< Too many missing values in total: 4roj-1 +<<< Too many missing values in total: 4rwd-2 +<<< Sequence is too short: 4tky-4 +<<< Too many missing values in total: 4tot-4 +<<< Too many missing values in the middle: 4uro-3 +<<< Too many missing values in total: 4uw2-4 +<<< Sequence is too short: 4ux6-1 +<<< Too many missing values in the middle: 4v0m-1 +<<< Unknown: 4v7n-14 +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert + for (chain,) in pdb_entry.get_chains(): +ValueError: too many values to unpack (expected 1) + +<<< Too many missing values in the ends: 4w2o-1 +<<< Sequence is too short: 4w50-2 +<<< Too many missing values in the middle: 4w9l-1 +<<< Too many missing values in total: 4uv8-1 +<<< Sequence is too short: 4wb5-1 +<<< Sequence is too short: 4wjq-2 +<<< Unknown: 4v45-4 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in total: 4wx8-2 +<<< Too many missing values in total: 4xup-3 +<<< Too many missing values in total: 4z8m-2 +<<< Too many missing values in the ends: 4zhw-1 +<<< Too many missing values in the middle: 4zp4-1 +<<< Too many missing values in total: 4zrt-1 +<<< Sequence is too short: 5a0x-1 +<<< Unexpected atoms (DA): 5a93-1 +<<< Sequence is too short: 5ax3-1 +<<< Sequence is too short: 5bxu-1 +<<< Too many missing values in the middle: 5c01-2 +<<< Too many missing values in total: 5c13-2 +<<< Too many missing values in the middle: 5c59-7 +<<< Too many missing values in the ends: 5cos-1 +<<< Too many missing values in total: 5csi-1 +<<< Too many missing values in total: 5cxt-7 +<<< Too many missing values in the middle: 5d3w-2 +<<< Too many missing values in the ends: 5d56-2 +<<< Too many missing values in the middle: 5d6h-1 +<<< Too many missing values in the middle: 5dcf-1 +<<< Sequence is too short: 5ddh-1 +<<< Sequence is too short: 5dmg-1 +<<< Sequence is too short: 5dow-4 +<<< Too many missing values in the middle: 5dsc-3 +<<< Sequence is too short: 5e8f-1 +<<< Too many missing values in the ends: 5e0x-1 +<<< Too many missing values in the middle: 5f51-1 +<<< Too many missing values in the middle: 5f7c-2 +<<< Too many missing values in total: 5fc8-1 +<<< Too many missing values in the middle: 5feh-1 +<<< Too many missing values in the middle: 5frt-4 +<<< Too many missing values in total: 5ft1-1 +<<< Too many missing values in the middle: 5go3-2 +<<< Too many missing values in the middle: 5h5a-4 +<<< Too many missing values in the middle: 5hfj-4 +<<< Sequence is too short: 5hox-3 +<<< Sequence is too short: 5hho-1 +<<< Too many missing values in total: 5hyp-1 +<<< Too many missing values in the middle: 5hq8-1 +<<< Sequence is too short: 5icz-2 +<<< Sequence is too short: 5iqo-1 +<<< Sequence is too short: 5iop-2 +<<< Sequence is too short: 5ivn-1 +<<< Too many missing values in total: 5iue-1 +<<< Sequence is too short: 5izu-1 +<<< Too many missing values in the middle: 5jaa-1 +<<< Sequence is too short: 5fq6-2 +<<< Too many missing values in total: 5jer-4 +<<< Sequence is too short: 5jhc-1 +<<< Too many missing values in total: 5jja-2 +<<< Sequence is too short: 5jwe-1 +<<< Too many missing values in the middle: 5k19-2 +<<< Too many missing values in total: 5kc1-1 +<<< Sequence is too short: 5kr9-1 +<<< Too many missing values in the middle: 5kxj-3 +<<< Sequence is too short: 5l83-1 +<<< Incorrect alignment: 5l9w-2 +<<< Sequence is too short: 5leo-1 +<<< Too many missing values in the middle: 5ltv-7 +<<< Too many missing values in the middle: 5ls6-4 +<<< Sequence is too short: 5m5r-1 +<<< Unnatural amino acids found: 5me3-2 +<<< Sequence is too short: 5m71-1 +<<< Sequence is too short: 5mlw-3 +<<< Too many missing values in the ends: 5mk1-4 +<<< Too many missing values in total: 5mst-2 +<<< Too many missing values in total: 5mu0-4 +<<< Too many missing values in total: 5mub-6 +<<< Too many missing values in total: 5n74-2 +<<< Sequence is too short: 5n85-1 +<<< Sequence is too short: 5n1y-1 +<<< Sequence is too short: 5nc7-4 +<<< Too many missing values in the ends: 5ndt-1 +<<< Sequence is too short: 5n32-1 +<<< Too many missing values in the middle: 5nnf-1 +<<< Too many missing values in the middle: 5o3p-1 +<<< Too many missing values in total: 5npw-1 +<<< Too many missing values in the middle: 5o7b-1 +<<< Too many missing values in the middle: 5n4e-1 +<<< Too many missing values in the middle: 5oi2-1 +<<< Sequence is too short: 5o9u-1 +<<< Sequence is too short: 5ous-1 +<<< Too many missing values in the middle: 5ow9-1 +<<< Too many missing values in total: 5oo6-5 +<<< Sequence is too short: 5q0l-1 +<<< Sequence is too short: 5q1f-1 +<<< Too many missing values in the ends: 5qu1-1 +<<< Too many missing values in total: 5oqq-1 +<<< Too many missing values in the middle: 5r49-1 +<<< Unexpected atoms (D1): 5rsa-1 +<<< Too many missing values in the middle: 5s5x-1 +<<< Too many missing values in the middle: 5sba-1 +<<< Sequence is too short: 5t1l-1 +<<< Sequence is too short: 5t7g-2 +<<< Too many missing values in total: 5twh-1 +<<< Sequence is too short: 5u62-2 +<<< Too many missing values in the middle: 5un5-1 +<<< Sequence is too short: 5urt-2 +<<< Sequence is too short: 5uwm-2 +<<< Too many missing values in the middle: 5vlq-2 +<<< Sequence is too short: 5vud-1 +<<< Sequence is too short: 5vvp-1 +<<< Too many missing values in the middle: 5w5o-7 +<<< Too many missing values in the middle: 5wax-2 +<<< Too many missing values in total: 5w4f-1 +<<< Too many missing values in the middle: 5wer-2 +<<< Sequence is too short: 5wli-3 +<<< Sequence is too short: 5x54-2 +<<< Too many missing values in total: 5ve8-2 +<<< Too many missing values in the middle: 5xjl-1 +<<< Too many missing values in total: 5xxk-1 +<<< Too many missing values in total: 5xw8-1 +<<< Too many missing values in total: 5y26-1 +<<< Too many missing values in the middle: 5yc3-1 +<<< Sequence is too short: 5yd4-4 +<<< Too many missing values in the middle: 5yj1-13 +<<< Too many missing values in the middle: 5yvb-1 +<<< Too many missing values in total: 5z8n-3 +<<< Sequence is too short: 5zgc-1 +<<< Too many missing values in the middle: 5zia-3 +<<< Too many missing values in the middle: 5xlt-1 +<<< Too many missing values in the middle: 6awf-2 +<<< Too many missing values in the middle: 6b4c-11 +<<< Too many missing values in total: 6b67-2 +<<< Sequence is too short: 6bcy-1 +<<< Too many missing values in the middle: 6bqr-1 +<<< Too many missing values in the middle: 6c1o-2 +<<< Too many missing values in the middle: 6c4u-2 +<<< Too many missing values in the middle: 6bro-1 +<<< Too many missing values in the middle: 6cqo-4 +<<< Too many missing values in total: 6czo-1 +<<< Too many missing values in total: 6dca-3 +<<< Sequence is too short: 6dth-1 +<<< Too many missing values in total: 6ecf-4 +<<< Too many missing values in the middle: 6ffj-4 +<<< Too many missing values in the middle: 6fel-2 +<<< Too many missing values in total: 6ft5-1 +<<< Too many missing values in the middle: 6fy1-2 +<<< Too many missing values in total: 6g07-2 +<<< Too many missing values in the middle: 6g30-1 +<<< Too many missing values in total: 6g8p-1 +<<< Too many missing values in the middle: 6gmn-4 +<<< Too many missing values in total: 6grh-1 +<<< Too many missing values in total: 6h06-2 +<<< Sequence is too short: 6i2g-1 +<<< Incorrect alignment: 6ikm-9 +<<< Too many missing values in the middle: 6iqn-1 +<<< Unknown: 6igc-7 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in total: 6j91-1 +<<< Sequence is too short: 6j2e-1 +<<< Too many missing values in the middle: 6jm4-1 +<<< Sequence is too short: 6jp3-1 +<<< Too many missing values in the ends: 6k3a-1 +<<< Too many missing values in the middle: 6kgw-1 +<<< Sequence is too short: 6kds-1 +<<< Too many missing values in the middle: 6kmt-1 +<<< Sequence is too short: 6knu-1 +<<< Too many missing values in total: 6kzh-1 +<<< Too many missing values in the middle: 6kr4-4 +<<< Too many missing values in the middle: 6lol-1 +<<< Too many missing values in total: 6lrq-1 +<<< Too many missing values in total: 6lmw-1 +<<< Too many missing values in the middle: 6lzk-3 +<<< Too many missing values in the middle: 6lhx-1 +<<< Sequence is too short: 6mbk-1 +<<< Too many missing values in total: 6m8w-1 +<<< Too many missing values in the middle: 6mki-1 +<<< Too many missing values in total: 6mj8-1 +<<< Sequence is too short: 6mpn-1 +<<< Too many missing values in the middle: 6mxg-1 +<<< Too many missing values in the middle: 6mzw-2 +<<< Sequence is too short: 6n5w-1 +<<< Sequence is too short: 6nca-12 +<<< Too many missing values in total: 6o3x-1 +<<< Sequence is too short: 6o9c-1 +<<< Sequence is too short: 6oi4-1 +<<< Too many missing values in the ends: 6op8-1 +<<< Too many missing values in total: 6osl-1 +<<< Too many missing values in the ends: 6p8h-1 +<<< Sequence is too short: 6pdi-1 +<<< Too many missing values in total: 6phm-1 +<<< Too many missing values in total: 6pln-1 +<<< Too many missing values in total: 6psd-4 +<<< Sequence is too short: 6q0n-1 +<<< Sequence is too short: 6pyv-1 +<<< Sequence is too short: 6q5n-2 +<<< Sequence is too short: 6on2-1 +<<< Too many missing values in total: 6qsz-3 +<<< Sequence is too short: 6r50-2 +<<< Sequence is too short: 6r7j-1 +<<< Too many missing values in the middle: 6rxm-4 +<<< Sequence is too short: 6s7g-1 +<<< Too many missing values in the ends: 6sb1-1 +<<< Too many missing values in the middle: 6s6a-1 +<<< Too many missing values in the middle: 6suo-1 +<<< Too many missing values in the middle: 6t2m-1 +<<< Some chains in the PDB do not appear in the fasta file: 6sx4-3 +<<< Some chains in the PDB do not appear in the fasta file: 6sl9-1 +<<< Sequence is too short: 6t4a-1 +<<< Some chains in the PDB do not appear in the fasta file: 6t9m-2 +<<< Some chains in the PDB do not appear in the fasta file: 6tkq-1 +<<< Sequence is too short: 6tq0-5 +<<< Some chains in the PDB do not appear in the fasta file: 6tlu-1 +<<< Some chains in the PDB do not appear in the fasta file: 6tnl-3 +<<< Too many missing values in the middle: 6tz7-1 +<<< Sequence is too short: 6u39-2 +<<< Too many missing values in the middle: 6u8g-2 +<<< Sequence is too short: 6uai-1 +<<< Too many missing values in the middle: 6ubw-1 +<<< Too many missing values in the middle: 6ug3-2 +<<< Too many missing values in the middle: 6uek-2 +<<< Too many missing values in the middle: 6v6q-1 +<<< Sequence is too short: 6uz1-1 +<<< Too many missing values in the middle: 6vbu-1 +<<< Too many missing values in total: 6vil-5 +<<< Too many missing values in the middle: 6vxo-1 +<<< Too many missing values in total: 6vrh-1 +<<< Unknown: 6wat-4 +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert + for (chain,) in pdb_entry.get_chains(): +ValueError: too many values to unpack (expected 1) + +<<< Too many missing values in the middle: 6wc9-1 +<<< Too many missing values in the middle: 6wkj-1 +<<< Too many missing values in the ends: 6wfy-1 +<<< Too many missing values in total: 6wqk-1 +<<< Too many missing values in total: 6wi3-3 +<<< Too many missing values in the middle: 6wnx-1 +<<< Incorrect alignment: 6x0a-2 +<<< Too many missing values in total: 6y73-1 +<<< Some chains in the PDB do not appear in the fasta file: 6yab-1 +<<< Too many missing values in total: 6yif-1 +<<< Some chains in the PDB do not appear in the fasta file: 6ylz-1 +<<< Incorrect alignment: 6yn1-1 +<<< Some chains in the PDB do not appear in the fasta file: 6yqr-1 +<<< Sequence is too short: 6yo8-2 +<<< Too many missing values in the middle: 6yvt-5 +<<< Some chains in the PDB do not appear in the fasta file: 6z3n-2 +<<< Sequence is too short: 6z7w-5 +<<< Some chains in the PDB do not appear in the fasta file: 6ziv-4 +<<< Some chains in the PDB do not appear in the fasta file: 6zry-1 +<<< Sequence is too short: 6zux-1 +<<< Too many missing values in the middle: 6zwm-1 +<<< Unknown: 7a8y-1 +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert + for (chain,) in pdb_entry.get_chains(): +ValueError: too many values to unpack (expected 1) + +<<< Some chains in the PDB do not appear in the fasta file: 7ael-1 +<<< Too many missing values in the middle: 7ahd-1 +<<< Too many missing values in the middle: 7alv-1 +<<< Too many missing values in total: 7age-3 +<<< Too many missing values in total: 7asu-1 +<<< Too many missing values in the ends: 7b5g-4 +<<< Some chains in the PDB do not appear in the fasta file: 7b6w-1 +<<< Too many missing values in total: 7aze-1 +<<< Too many missing values in the ends: 7bji-1 +<<< Too many missing values in the middle: 7bqz-1 +<<< Too many missing values in total: 7bot-1 +<<< Too many missing values in total: 7cfd-2 +<<< Too many missing values in total: 7ciz-3 +<<< Too many missing values in total: 7cla-1 +<<< Too many missing values in total: 7cmr-1 +<<< Too many missing values in total: 7crh-1 +<<< Too many missing values in total: 7d2q-1 +<<< Too many missing values in total: 7d0s-1 +<<< Too many missing values in total: 7dfc-1 +<<< Too many missing values in the ends: 7dmw-3 +<<< Too many missing values in the middle: 7dys-1 +<<< Too many missing values in the middle: 7drp-2 +<<< Too many missing values in total: 7cyl-1 +<<< Too many missing values in the middle: 7dae-1 +<<< Sequence is too short: 7etv-1 +<<< Too many missing values in the ends: 7f2n-1 +<<< Too many missing values in total: 7f5x-1 +<<< Sequence is too short: 7jl7-1 +<<< Too many missing values in total: 7jn9-1 +<<< Too many missing values in the middle: 7jsj-1 +<<< Sequence is too short: 7jwj-1 +<<< Too many missing values in the middle: 7k7q-1 +<<< Sequence is too short: 7k2s-2 +<<< Too many missing values in the middle: 7kfl-2 +<<< Unknown: 7kp5-1 +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert + for (chain,) in pdb_entry.get_chains(): +ValueError: too many values to unpack (expected 1) + +<<< Too many missing values in the ends: 7law-2 +<<< Too many missing values in the middle: 7jfr-1 +<<< Unnatural amino acids found: 7ln4-1 +<<< Too many missing values in the middle: 7lwp-1 +<<< Sequence is too short: 7m55-1 +<<< Too many missing values in the middle: 7l7i-1 +<<< Some chains in the PDB do not appear in the fasta file: 7mqt-1 +<<< Too many missing values in total: 7n27-1 +<<< Too many missing values in total: 7nm9-1 +<<< Sequence is too short: 7n8j-1 +<<< Sequence is too short: 7ntk-4 +<<< Some chains in the PDB do not appear in the fasta file: 7nvj-1 +<<< Too many missing values in the middle: 7o2e-1 +<<< Too many missing values in the middle: 7o49-2 +<<< Some chains in the PDB do not appear in the fasta file: 7o76-1 +<<< Some chains in the PDB do not appear in the fasta file: 7od0-4 +<<< Too many missing values in total: 7oeu-1 +<<< Too many missing values in total: 7ot9-1 +<<< Some chains in the PDB do not appear in the fasta file: 7orq-1 +<<< Sequence is too short: 7oxk-1 +<<< Some chains in the PDB do not appear in the fasta file: 7oza-1 +<<< Some chains in the PDB do not appear in the fasta file: 7p7o-1 +<<< Some chains in the PDB do not appear in the fasta file: 7ph0-1 +<<< Unknown: 7pe6-1 +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert + for (chain,) in pdb_entry.get_chains(): +ValueError: too many values to unpack (expected 1) + +<<< Too many missing values in total: 7nkj-1 +<<< Unknown: 7q8j-1 +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert + for (chain,) in pdb_entry.get_chains(): +ValueError: too many values to unpack (expected 1) + +<<< Too many missing values in the middle: 7qie-2 +<<< Too many missing values in the ends: 7qqn-2 +<<< Too many missing values in total: 7rlz-1 +<<< Sequence is too short: 7rn9-1 +<<< Too many missing values in total: 7rhl-1 +<<< Too many missing values in the middle: 7s1t-4 +<<< Sequence is too short: 7s4g-2 +<<< Sequence is too short: 7s8q-2 +<<< Too many missing values in total: 7srs-1 +<<< Too many missing values in total: 7sxy-1 +<<< Too many missing values in the middle: 7st3-5 +<<< Too many missing values in the middle: 7t1g-1 +<<< Unknown: 7t68-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in total: 7tyf-1 +<<< Too many missing values in the middle: 7ukv-1 +<<< Too many missing values in total: 7uve-1 +<<< Sequence is too short: 7uyk-2 +<<< Too many missing values in the ends: 7vec-1 +<<< Too many missing values in total: 7uea-1 +<<< Too many missing values in total: 7vf3-1 +<<< Too many missing values in the middle: 7vph-2 +<<< Too many missing values in the middle: 7vvk-1 +<<< Sequence is too short: 7vlz-1 +<<< Too many missing values in the middle: 7w1r-1 +<<< Too many missing values in total: 7wcu-1 +<<< Sequence is too short: 7wlx-1 +<<< Too many missing values in total: 7wri-1 +<<< Too many missing values in the middle: 7x9s-2 +<<< Too many missing values in the middle: 7xwi-2 +<<< Too many missing values in the middle: 7ye7-1 +<<< Some chains in the PDB do not appear in the fasta file: 7zad-1 +<<< Too many missing values in the middle: 7zfg-1 +<<< Too many missing values in total: 7zh3-1 +<<< Too many missing values in the middle: 8bfe-5 +<<< Too many missing values in total: 8do8-2 +<<< Unnatural amino acids found: 8eio-1 +<<< Too many missing values in total: 8f5p-1 +<<< Too many missing values in total: 7zbn-1 +<<< Too many missing values in total: 1hh3-1 +<<< Too many missing values in total: 1lgc-1 +<<< Sequence is too short: 1lwu-1 +<<< Unnatural amino acids found: 2h26-1 +<<< Sequence is too short: 2g5b-2 +<<< Sequence is too short: 2vdr-1 +<<< Unknown: 3d7w-1 +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1334, in get_coordinates_array + chain_crd[informative_mask]["unique_residue_number"].astype(int), + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/generic.py", line 6324, in astype + new_data = self._mgr.astype(dtype=dtype, copy=copy, errors=errors) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/internals/managers.py", line 451, in astype + return self.apply( + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/internals/managers.py", line 352, in apply + applied = getattr(b, f)(**kwargs) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/internals/blocks.py", line 511, in astype + new_values = astype_array_safe(values, dtype, copy=copy, errors=errors) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/dtypes/astype.py", line 242, in astype_array_safe + new_values = astype_array(values, dtype, copy=copy) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/dtypes/astype.py", line 187, in astype_array + values = _astype_nansafe(values, dtype, copy=copy) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/dtypes/astype.py", line 138, in _astype_nansafe + return arr.astype(dtype, copy=True) +ValueError: invalid literal for int() with base 10: '510_' + +<<< Sequence is too short: 3hus-2 +<<< Sequence is too short: 3pma-4 +<<< Too many missing values in the ends: 4aa1-1 +<<< Too many missing values in the ends: 4fqx-3 +<<< Sequence is too short: 5djx-2 +<<< Too many missing values in the middle: 5es4-4 +<<< Sequence is too short: 5j50-1 +<<< Unnatural amino acids found: 5jqb-1 +<<< Sequence is too short: 5ujt-3 +<<< Too many missing values in the middle: 5vgj-1 +<<< Too many missing values in the ends: 5w6i-1 +<<< Too many missing values in the ends: 5hcd-1 +<<< Too many missing values in total: 6fyw-1 +<<< Too many missing values in the middle: 6ht9-2 +<<< Too many missing values in the middle: 6np0-1 +<<< Unknown: 6m8p-6 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in the middle: 6oej-2 +<<< Too many missing values in the middle: 6plz-1 +<<< Too many missing values in the middle: 6uyg-1 +<<< Too many missing values in the middle: 6vkf-2 +<<< Too many missing values in total: 6xp6-2 +<<< Some chains in the PDB do not appear in the fasta file: 6ytr-1 +<<< Too many missing values in the middle: 7ad1-1 +<<< Too many missing values in the ends: 7cq5-1 +<<< Some chains in the PDB do not appear in the fasta file: 7b6u-1 +<<< Unknown: 7drb-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in total: 6x40-1 +<<< Too many missing values in the middle: 7lkp-1 +<<< Too many missing values in the middle: 7mwx-2 +<<< Unnatural amino acids found: 7ne0-1 +<<< Sequence is too short: 7o50-2 +<<< Too many missing values in total: 7tti-1 +<<< Too many missing values in the ends: 7qzr-1 +<<< Too many missing values in the middle: 7sxx-1 +<<< Too many missing values in total: 7x8w-1 +<<< Too many missing values in the middle: 8dlj-1 +<<< Sequence is too short: 1a6a-1 +<<< Sequence is too short: 1awr-1 +<<< Too many missing values in the middle: 1aya-2 +<<< Sequence is too short: 1b17-1 +<<< Too many missing values in the middle: 1b8k-1 +<<< Sequence is too short: 1b05-1 +<<< Too many missing values in total: 1bdw-1 +<<< Sequence is too short: 1bbr-2 +<<< Too many missing values in the middle: 1bpe-1 +<<< Sequence is too short: 1d4w-1 +<<< Sequence is too short: 1dph-1 +<<< Too many missing values in the middle: 1du3-1 +<<< Too many missing values in total: 1efm-1 +<<< Too many missing values in the middle: 1ejf-1 +<<< Sequence is too short: 1etl-1 +<<< Sequence is too short: 1ffp-1 +<<< Too many missing values in total: 1fm9-1 +<<< Sequence is too short: 1g39-3 +<<< Too many missing values in total: 1gi8-1 +<<< Unnatural amino acids found: 1h0h-2 +<<< Too many missing values in the middle: 1grl-2 +<<< Sequence is too short: 1hlt-1 +<<< Too many missing values in the middle: 1hnk-1 +<<< Sequence is too short: 1him-2 +<<< Too many missing values in the middle: 1huu-1 +<<< Sequence is too short: 1i1f-1 +<<< Too many missing values in total: 1iqm-1 +<<< Too many missing values in the middle: 1jkf-1 +<<< Too many missing values in the middle: 1jq7-1 +<<< Too many missing values in the ends: 1jp5-2 +<<< Too many missing values in the middle: 1kn9-4 +<<< Too many missing values in the middle: 1l8w-2 +<<< Sequence is too short: 1mk9-1 +<<< Too many missing values in total: 1muj-1 +<<< Sequence is too short: 1nrs-1 +<<< Sequence is too short: 1nx0-1 +<<< Sequence is too short: 1nvr-1 +<<< Too many missing values in total: 1o6o-1 +<<< Sequence is too short: 1ou8-1 +<<< Too many missing values in the middle: 1pdg-2 +<<< Too many missing values in the middle: 1pm3-1 +<<< Sequence is too short: 1ppe-1 +<<< Too many missing values in total: 1q4q-2 +<<< Sequence is too short: 1qd6-2 +<<< Sequence is too short: 1qls-1 +<<< Sequence is too short: 1qxa-1 +<<< Sequence is too short: 1rbg-1 +<<< Sequence is too short: 1r5v-2 +<<< Too many missing values in the ends: 1rh5-1 +<<< Too many missing values in total: 1rrv-1 +<<< Too many missing values in the ends: 1s94-2 +<<< Sequence is too short: 1s7r-2 +<<< Too many missing values in the middle: 1t2v-3 +<<< Sequence is too short: 1t5x-1 +<<< Sequence is too short: 1tjg-1 +<<< Too many missing values in total: 1tu3-2 +<<< Too many missing values in total: 1tno-2 +<<< Too many missing values in the ends: 1tzy-1 +<<< Too many missing values in the middle: 1ud1-1 +<<< Too many missing values in total: 1tyq-1 +<<< Sequence is too short: 1uhb-1 +<<< Unnatural amino acids found: 1w5c-1 +<<< Too many missing values in total: 1w7r-1 +<<< Too many missing values in the middle: 1wr6-1 +<<< Sequence is too short: 1xda-11 +<<< Too many missing values in the middle: 1xqb-1 +<<< Sequence is too short: 1y2a-1 +<<< Sequence is too short: 1ypl-1 +<<< Sequence is too short: 1yn6-1 +<<< Sequence is too short: 1zmi-6 +<<< Sequence is too short: 1zni-1 +<<< Too many missing values in the middle: 1ztm-1 +<<< Too many missing values in the middle: 1zw0-15 +<<< Too many missing values in the middle: 1zxe-1 +<<< Too many missing values in the middle: 2a33-1 +<<< Sequence is too short: 2ak5-1 +<<< Sequence is too short: 2aq9-1 +<<< Sequence is too short: 2b1f-1 +<<< Too many missing values in the middle: 2bbh-1 +<<< Too many missing values in total: 2bd4-1 +<<< Too many missing values in total: 2bdx-1 +<<< Too many missing values in the middle: 2br9-1 +<<< Sequence is too short: 2bvx-1 +<<< Too many missing values in the middle: 2c1n-1 +<<< Too many missing values in the middle: 2c8t-3 +<<< Too many missing values in the middle: 2d5h-1 +<<< Too many missing values in the middle: 2d2r-1 +<<< Too many missing values in the ends: 2d11-4 +<<< Too many missing values in the middle: 2di4-1 +<<< Too many missing values in total: 2dma-1 +<<< Sequence is too short: 2fmk-1 +<<< Too many missing values in the middle: 2fvu-1 +<<< Sequence is too short: 2fx8-1 +<<< Sequence is too short: 2gph-1 +<<< Too many missing values in total: 2gl7-1 +<<< Sequence is too short: 2h1c-1 +<<< Too many missing values in the ends: 2h65-1 +<<< Too many missing values in the middle: 2hww-3 +<<< Too many missing values in the middle: 2hy1-1 +<<< Too many missing values in the middle: 2i0i-3 +<<< Sequence is too short: 2hpc-4 +<<< Too many missing values in the middle: 2ihe-1 +<<< Sequence is too short: 2ins-4 +<<< Sequence is too short: 2jdr-1 +<<< Too many missing values in the middle: 2nyd-1 +<<< Sequence is too short: 2o4j-2 +<<< Sequence is too short: 2os2-1 +<<< Too many missing values in the middle: 2p22-1 +<<< Too many missing values in the middle: 2p9b-1 +<<< Sequence is too short: 2pm5-5 +<<< Sequence is too short: 2p6a-1 +<<< Too many missing values in the middle: 2pf4-2 +<<< Too many missing values in the middle: 2q3v-2 +<<< Too many missing values in the middle: 2q6r-1 +<<< Too many missing values in the middle: 2q7u-1 +<<< Sequence is too short: 2qbx-1 +<<< Sequence is too short: 2qa8-1 +<<< Too many missing values in the ends: 2qjb-1 +<<< Unexpected atoms (D1): 2r24-1 +<<< Too many missing values in total: 2uwl-1 +<<< Too many missing values in the middle: 2v92-1 +<<< Too many missing values in the middle: 2vvg-2 +<<< Too many missing values in the middle: 2vso-1 +<<< Incorrect alignment: 2w8s-1 +<<< Too many missing values in the ends: 2wax-2 +<<< Too many missing values in the middle: 2woj-2 +<<< Too many missing values in the ends: 2wpj-1 +<<< Sequence is too short: 2ws6-5 +<<< Too many missing values in the middle: 2xby-1 +<<< Too many missing values in the middle: 2xk3-1 +<<< Too many missing values in total: 2xze-2 +<<< Too many missing values in the middle: 2ybx-1 +<<< Too many missing values in the middle: 2yqy-1 +<<< Too many missing values in total: 2yvc-2 +<<< Unnatural amino acids found: 2z5o-2 +<<< Too many missing values in the ends: 2z3d-1 +<<< Too many missing values in the middle: 2ztu-1 +<<< Too many missing values in total: 3a2h-1 +<<< Too many missing values in the middle: 3a61-1 +<<< Too many missing values in total: 3ai6-2 +<<< Too many missing values in the middle: 3alo-2 +<<< Too many missing values in total: 3atw-1 +<<< Too many missing values in total: 3bzx-4 +<<< Too many missing values in the middle: 3bow-1 +<<< Sequence is too short: 3c3r-1 +<<< Too many missing values in the middle: 3cbr-1 +<<< Too many missing values in total: 3chf-2 +<<< Too many missing values in the middle: 3cjq-1 +<<< Sequence is too short: 3d1f-1 +<<< Too many missing values in the middle: 3d8e-3 +<<< Too many missing values in the middle: 3dcz-1 +<<< Too many missing values in the middle: 3ddq-1 +<<< Too many missing values in the middle: 3e1k-2 +<<< Sequence is too short: 3e8c-4 +<<< Sequence is too short: 3e0m-1 +<<< Too many missing values in total: 3egh-2 +<<< Too many missing values in the middle: 3eul-5 +<<< Sequence is too short: 3cww-1 +<<< Too many missing values in the middle: 3f87-1 +<<< Too many missing values in the middle: 3f9y-1 +<<< Too many missing values in the middle: 3fog-1 +<<< Sequence is too short: 3ftr-1 +<<< Sequence is too short: 3fwv-1 +<<< Too many missing values in the middle: 3gbx-1 +<<< Too many missing values in total: 3gj8-2 +<<< Sequence is too short: 3h9s-1 +<<< Too many missing values in the middle: 3i5p-1 +<<< Sequence is too short: 3i6l-1 +<<< Too many missing values in the middle: 3ihp-2 +<<< Too many missing values in the middle: 3jq7-1 +<<< Too many missing values in the middle: 3kbe-1 +<<< Too many missing values in total: 3kqi-1 +<<< Unknown: 3kp4-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Sequence is too short: 3kkv-1 +<<< Too many missing values in the middle: 3khd-2 +<<< Too many missing values in the middle: 3l6v-1 +<<< Unknown: 3l9v-2 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3l8r-3 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3ld2-3 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3laz-2 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3le6-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lha-2 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lgb-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lis-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lc1-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3li8-2 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3ljy-2 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lf7-2 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lkp-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lls-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in the middle: 3lt0-1 +<<< Too many missing values in the ends: 3luo-2 +<<< Too many missing values in the middle: 3m1g-1 +<<< Too many missing values in total: 3mev-1 +<<< Sequence is too short: 3mls-4 +<<< Sequence is too short: 3mrq-1 +<<< Sequence is too short: 3mvj-3 +<<< Sequence is too short: 3nco-3 +<<< Sequence is too short: 3nfk-3 +<<< Incorrect alignment: 3nbj-4 +<<< Too many missing values in the middle: 3ngr-1 +<<< Sequence is too short: 3o17-1 +<<< Too many missing values in total: 3o45-2 +<<< Too many missing values in the ends: 3oj3-2 +<<< Too many missing values in the ends: 3oq0-9 +<<< Sequence is too short: 3ou1-1 +<<< Too many missing values in total: 3p0g-1 +<<< Sequence is too short: 3ogl-6 +<<< Too many missing values in the middle: 3p35-1 +<<< Too many missing values in the ends: 3pcx-2 +<<< Too many missing values in the middle: 3pfy-1 +<<< Sequence is too short: 3ppd-1 +<<< Sequence is too short: 3pwl-1 +<<< Too many missing values in the middle: 3q9i-3 +<<< Too many missing values in the middle: 3qbn-1 +<<< Sequence is too short: 3qjn-5 +<<< Sequence is too short: 3qg6-1 +<<< Sequence is too short: 3qn7-1 +<<< Too many missing values in total: 3qzv-1 +<<< Too many missing values in the middle: 3rbw-4 +<<< Too many missing values in the middle: 3rpg-1 +<<< Sequence is too short: 3rwe-1 +<<< Too many missing values in the middle: 3rz3-3 +<<< Too many missing values in the middle: 3sl1-2 +<<< Too many missing values in total: 3sow-3 +<<< Unnatural amino acids found: 3stj-1 +<<< Too many missing values in the middle: 3swc-3 +<<< Too many missing values in the middle: 3tau-1 +<<< Sequence is too short: 3tbs-1 +<<< Too many missing values in the ends: 3tjg-1 +<<< Sequence is too short: 3tcg-8 +<<< Too many missing values in total: 3tsw-2 +<<< Too many missing values in the middle: 3tvz-3 +<<< Too many missing values in total: 3u1i-1 +<<< Sequence is too short: 3u3f-1 +<<< Too many missing values in total: 3ul5-1 +<<< Too many missing values in the ends: 3uua-2 +<<< Sequence is too short: 3uvm-1 +<<< Sequence is too short: 3v2x-1 +<<< Too many missing values in the middle: 3v6m-4 +<<< Sequence is too short: 3v3v-1 +<<< Sequence is too short: 3vfm-1 +<<< Too many missing values in the ends: 3vb5-1 +<<< Too many missing values in total: 3vrr-1 +<<< Too many missing values in total: 3wht-1 +<<< Too many missing values in the ends: 3wtf-1 +<<< Too many missing values in total: 3w3y-1 +<<< Too many missing values in total: 3wgv-1 +<<< Too many missing values in the middle: 3zqj-6 +<<< Sequence is too short: 3zio-1 +<<< Too many missing values in the middle: 4a2p-1 +<<< Too many missing values in the ends: 4a9j-1 +<<< Sequence is too short: 3zrl-1 +<<< Sequence is too short: 4aif-2 +<<< Too many missing values in the middle: 4bj5-1 +<<< Too many missing values in the ends: 4brr-1 +<<< Too many missing values in the ends: 4bwq-3 +<<< Too many missing values in the middle: 4by2-2 +<<< Too many missing values in the middle: 4cbt-1 +<<< Too many missing values in the middle: 4cfe-1 +<<< Too many missing values in the middle: 4ckw-2 +<<< Sequence is too short: 4cxn-1 +<<< Too many missing values in the middle: 4d11-3 +<<< Too many missing values in the middle: 4da9-1 +<<< Sequence is too short: 4dor-3 +<<< Sequence is too short: 4dqm-1 +<<< Too many missing values in the middle: 4dyv-3 +<<< Too many missing values in the ends: 4e19-1 +<<< Too many missing values in the middle: 4e2h-1 +<<< Too many missing values in the ends: 4ec6-2 +<<< Too many missing values in the middle: 4etv-2 +<<< Too many missing values in the middle: 4eyt-2 +<<< Too many missing values in the middle: 4ezq-4 +<<< Too many missing values in the middle: 4fa0-1 +<<< Too many missing values in total: 4fbw-2 +<<< Sequence is too short: 4fi9-1 +<<< Too many missing values in total: 4fj3-1 +<<< Sequence is too short: 4g6a-1 +<<< Too many missing values in the middle: 4go6-3 +<<< Too many missing values in total: 4gxb-1 +<<< Too many missing values in the middle: 4hou-2 +<<< Sequence is too short: 4ht6-2 +<<< Sequence is too short: 4hw4-1 +<<< Sequence is too short: 4i31-2 +<<< Too many missing values in the middle: 4iea-1 +<<< Too many missing values in the middle: 4igk-1 +<<< Sequence is too short: 4ins-6 +<<< Too many missing values in the middle: 4iw4-1 +<<< Sequence is too short: 4j2l-2 +<<< Sequence is too short: 4j9g-2 +<<< Too many missing values in total: 4j83-2 +<<< Too many missing values in total: 4jol-2 +<<< Sequence is too short: 4jry-1 +<<< Sequence is too short: 4k6y-2 +<<< Too many missing values in total: 4k38-1 +<<< Too many missing values in the middle: 4kv1-2 +<<< Sequence is too short: 4laj-3 +<<< Too many missing values in the middle: 4lle-2 +<<< Too many missing values in the middle: 4loo-1 +<<< Too many missing values in the middle: 4mcn-1 +<<< Sequence is too short: 4mny-1 +<<< Too many missing values in the middle: 4mzm-2 +<<< Too many missing values in total: 4n3g-1 +<<< Too many missing values in total: 4nft-3 +<<< Too many missing values in the middle: 4nim-2 +<<< Too many missing values in the middle: 4nmt-1 +<<< Sequence is too short: 4nny-1 +<<< Too many missing values in total: 4p0b-1 +<<< Too many missing values in the ends: 4p3w-1 +<<< Too many missing values in the ends: 4pa7-1 +<<< Too many missing values in the middle: 4pdp-1 +<<< Too many missing values in the middle: 4pl7-1 +<<< Too many missing values in total: 4pk2-1 +<<< Sequence is too short: 4pra-1 +<<< Sequence is too short: 4pp6-1 +<<< Sequence is too short: 4qbr-2 +<<< Too many missing values in total: 4qmf-1 +<<< Sequence is too short: 4pes-1 +<<< Too many missing values in the middle: 4qts-2 +<<< Too many missing values in the middle: 4qxa-1 +<<< Sequence is too short: 4r0i-1 +<<< Too many missing values in total: 4roj-2 +<<< Too many missing values in the middle: 4rt7-1 +<<< Too many missing values in total: 4ryd-1 +<<< Too many missing values in the middle: 4tzj-1 +<<< Too many missing values in total: 4twi-1 +<<< Too many missing values in the middle: 4up5-1 +<<< Too many missing values in the middle: 4uro-4 +<<< Sequence is too short: 4uu8-1 +<<< Too many missing values in the middle: 4uya-1 +<<< Too many missing values in the middle: 4v0m-2 +<<< Too many missing values in the middle: 4tv8-1 +<<< Too many missing values in the ends: 4w2o-2 +<<< Sequence is too short: 4w50-3 +<<< Unknown: 4v7n-15 +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert + for (chain,) in pdb_entry.get_chains(): +ValueError: too many values to unpack (expected 1) + +<<< Unknown: 4v4c-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Sequence is too short: 4wb6-1 +<<< Too many missing values in total: 4uv9-1 +<<< Too many missing values in total: 4wx8-3 +<<< Too many missing values in total: 4wyb-1 +<<< Too many missing values in the middle: 4x7h-1 +<<< Too many missing values in total: 4x9r-1 +<<< Too many missing values in the middle: 4xi8-2 +<<< Too many missing values in the middle: 4y66-3 +<<< Too many missing values in the middle: 4y3b-1 +<<< Sequence is too short: 4yo0-1 +<<< Too many missing values in the middle: 4z9m-7 +<<< Too many missing values in the middle: 4zhx-1 +<<< Too many missing values in the middle: 4zp4-2 +<<< Sequence is too short: 5a0x-2 +<<< Too many missing values in total: 5ah2-1 +<<< Sequence is too short: 5ajn-1 +<<< Unnatural amino acids found: 5azz-1 +<<< Too many missing values in the middle: 5bop-1 +<<< Sequence is too short: 5b4w-1 +<<< Sequence is too short: 5c02-1 +<<< Sequence is too short: 5c7e-1 +<<< Too many missing values in the ends: 5cos-2 +<<< Too many missing values in total: 5csj-1 +<<< Too many missing values in total: 5cxt-8 +<<< Too many missing values in total: 5da7-1 +<<< Too many missing values in the ends: 5dpw-1 +<<< Too many missing values in total: 5dmg-2 +<<< Too many missing values in the middle: 5dsc-4 +<<< Sequence is too short: 5e8f-2 +<<< Too many missing values in the middle: 5f51-2 +<<< Sequence is too short: 5f67-1 +<<< Too many missing values in the middle: 5feh-2 +<<< Too many missing values in total: 5ft1-2 +<<< Too many missing values in the middle: 5fuc-2 +<<< Sequence is too short: 5grg-1 +<<< Sequence is too short: 5gsv-1 +<<< Too many missing values in the middle: 5h98-2 +<<< Sequence is too short: 5hhp-1 +<<< Sequence is too short: 5hox-4 +<<< Sequence is too short: 5hvz-1 +<<< Too many missing values in total: 5hq8-2 +<<< Sequence is too short: 5hyq-1 +<<< Too many missing values in total: 5i70-1 +<<< Sequence is too short: 5id0-1 +<<< Sequence is too short: 5iqo-2 +<<< Too many missing values in total: 5iue-2 +<<< Too many missing values in total: 5fq7-1 +<<< Too many missing values in the middle: 5j71-1 +<<< Too many missing values in total: 5jer-5 +<<< Sequence is too short: 5jhc-10 +<<< Sequence is too short: 5jwe-2 +<<< Too many missing values in the middle: 5k19-3 +<<< Too many missing values in the middle: 5k86-1 +<<< Too many missing values in total: 5kc1-2 +<<< Too many missing values in the middle: 5keu-1 +<<< Sequence is too short: 5kra-1 +<<< Sequence is too short: 5l83-2 +<<< Sequence is too short: 5leo-2 +<<< Too many missing values in total: 5lm1-1 +<<< Too many missing values in total: 5m72-1 +<<< Sequence is too short: 5m5s-1 +<<< Sequence is too short: 5mlw-4 +<<< Too many missing values in the middle: 5mph-1 +<<< Too many missing values in total: 5msu-1 +<<< Too many missing values in the middle: 5mvi-1 +<<< Too many missing values in total: 5mu0-5 +<<< Too many missing values in total: 5mub-7 +<<< Too many missing values in the ends: 5n74-3 +<<< Too many missing values in the ends: 5nc8-1 +<<< Too many missing values in the middle: 5nla-1 +<<< Too many missing values in the middle: 5nng-1 +<<< Too many missing values in the middle: 5nr7-1 +<<< Too many missing values in the middle: 5nud-1 +<<< Too many missing values in the ends: 5n33-1 +<<< Too many missing values in the middle: 5o3q-1 +<<< Too many missing values in total: 5npw-2 +<<< Sequence is too short: 5nw8-1 +<<< Too many missing values in the middle: 5oi3-1 +<<< Sequence is too short: 5o9u-2 +<<< Too many missing values in total: 5oo6-6 +<<< Sequence is too short: 5q0l-2 +<<< Sequence is too short: 5q1f-2 +<<< Too many missing values in the middle: 5oqq-2 +<<< Too many missing values in the ends: 5qu1-2 +<<< Too many missing values in the middle: 5r4a-1 +<<< Sequence is too short: 5r1r-1 +<<< Too many missing values in the middle: 5s5y-1 +<<< Too many missing values in the middle: 5sbb-1 +<<< Too many missing values in the middle: 5t27-1 +<<< Sequence is too short: 5t1l-2 +<<< Too many missing values in the middle: 5tf2-1 +<<< Too many missing values in the middle: 5uly-2 +<<< Too many missing values in the middle: 5un6-1 +<<< Too many missing values in the middle: 5uq0-1 +<<< Too many missing values in the middle: 5ur1-2 +<<< Sequence is too short: 5va9-1 +<<< Too many missing values in the middle: 5vmt-2 +<<< Too many missing values in the middle: 5vvt-1 +<<< Sequence is too short: 5vue-1 +<<< Too many missing values in the middle: 5w5o-8 +<<< Too many missing values in the middle: 5w8f-1 +<<< Too many missing values in total: 5w4g-1 +<<< Sequence is too short: 5wa1-1 +<<< Sequence is too short: 5wha-2 +<<< Too many missing values in the middle: 5wer-3 +<<< Sequence is too short: 5wli-4 +<<< Sequence is too short: 5wzx-1 +<<< Too many missing values in the middle: 5x83-1 +<<< Sequence is too short: 5xjm-1 +<<< Too many missing values in the middle: 5xxk-2 +<<< Too many missing values in total: 5xw9-1 +<<< Too many missing values in total: 5y27-1 +<<< Sequence is too short: 5xzf-1 +<<< Too many missing values in the middle: 5yc4-1 +<<< Too many missing values in the middle: 5yek-1 +<<< Too many missing values in the ends: 5yb0-6 +<<< Too many missing values in the middle: 5yhi-1 +<<< Sequence is too short: 5yd5-1 +<<< Too many missing values in the middle: 5yj1-14 +<<< Sequence is too short: 5yip-1 +<<< Too many missing values in the middle: 5yvc-1 +<<< Too many missing values in the middle: 5zgc-2 +<<< Too many missing values in the middle: 5zod-1 +<<< Too many missing values in the middle: 5zia-4 +<<< Too many missing values in the middle: 6a2k-1 +<<< Sequence is too short: 6a9c-1 +<<< Sequence is too short: 6au5-1 +<<< Too many missing values in the middle: 6b1l-2 +<<< Too many missing values in the middle: 6b4c-12 +<<< Too many missing values in total: 6b67-3 +<<< Sequence is too short: 6bcy-2 +<<< Too many missing values in total: 6bqt-1 +<<< Too many missing values in the middle: 6c4u-3 +<<< Too many missing values in the middle: 6c08-1 +<<< Too many missing values in the middle: 6bro-2 +<<< Sequence is too short: 6cbi-1 +<<< Too many missing values in the middle: 6cpg-1 +<<< Too many missing values in the middle: 6cxo-2 +<<< Too many missing values in total: 6czo-2 +<<< Too many missing values in total: 6dca-4 +<<< Too many missing values in the middle: 6dfs-1 +<<< Too many missing values in the middle: 6dr4-1 +<<< Sequence is too short: 6e3g-1 +<<< Too many missing values in total: 6ecf-5 +<<< Too many missing values in total: 6ehp-1 +<<< Sequence is too short: 6eqa-1 +<<< Unnatural amino acids found: 6f6s-1 +<<< Too many missing values in the middle: 6fit-1 +<<< Too many missing values in the middle: 6fyz-3 +<<< Too many missing values in total: 6g07-3 +<<< Unknown: 6g5k-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in the middle: 6g6e-1 +<<< Too many missing values in total: 6fy2-1 +<<< Too many missing values in the middle: 6g31-1 +<<< Too many missing values in the middle: 6gek-1 +<<< Too many missing values in total: 6g8q-1 +<<< Sequence is too short: 6gh1-1 +<<< Too many missing values in total: 6gum-1 +<<< Too many missing values in total: 6h06-3 +<<< Sequence is too short: 6hby-1 +<<< Too many missing values in the middle: 6gxc-1 +<<< Too many missing values in the middle: 6hr5-1 +<<< Some chains in the PDB do not appear in the fasta file: 6i46-1 +<<< Sequence is too short: 6i2h-1 +<<< Too many missing values in the middle: 6ija-3 +<<< Too many missing values in the middle: 6im9-1 +<<< Unknown: 6igc-8 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Sequence is too short: 6j2e-2 +<<< Too many missing values in the middle: 6jm4-2 +<<< Too many missing values in the ends: 6jzb-1 +<<< Too many missing values in the middle: 6ki9-3 +<<< Too many missing values in the middle: 6kmt-2 +<<< Sequence is too short: 6knv-1 +<<< Too many missing values in the middle: 6l30-1 +<<< Too many missing values in total: 6ldv-1 +<<< Too many missing values in the middle: 6lol-2 +<<< Too many missing values in the middle: 6m1u-1 +<<< Sequence is too short: 6mbk-2 +<<< Too many missing values in total: 6maj-1 +<<< Too many missing values in total: 6m8y-1 +<<< Too many missing values in the ends: 6m32-1 +<<< Too many missing values in the middle: 6mha-1 +<<< Sequence is too short: 6mpn-2 +<<< Sequence is too short: 6nca-13 +<<< Sequence is too short: 6nv1-1 +<<< Too many missing values in total: 6o3x-2 +<<< Too many missing values in total: 6nt9-1 +<<< Too many missing values in the ends: 6oau-1 +<<< Sequence is too short: 6oi4-2 +<<< Too many missing values in total: 6osm-1 +<<< Sequence is too short: 6oqx-1 +<<< Sequence is too short: 6oyy-1 +<<< Sequence is too short: 6p2s-1 +<<< Too many missing values in total: 6phn-1 +<<< Too many missing values in total: 6pln-2 +<<< Too many missing values in the ends: 6psd-5 +<<< Too many missing values in the middle: 6ptl-1 +<<< Sequence is too short: 6q0n-2 +<<< Sequence is too short: 6pyw-1 +<<< Sequence is too short: 6qiu-1 +<<< Too many missing values in the ends: 6qsz-4 +<<< Too many missing values in total: 6q9i-1 +<<< Sequence is too short: 6r51-1 +<<< Sequence is too short: 6r7k-1 +<<< Too many missing values in the middle: 6rix-1 +<<< Too many missing values in the middle: 6rxm-5 +<<< Sequence is too short: 6ruj-1 +<<< Too many missing values in the middle: 6s6a-2 +<<< Too many missing values in the ends: 6sb1-2 +<<< Some chains in the PDB do not appear in the fasta file: 6sqv-1 +<<< Some chains in the PDB do not appear in the fasta file: 6sla-1 +<<< Too many missing values in the middle: 6szw-1 +<<< Some chains in the PDB do not appear in the fasta file: 6sx4-4 +<<< Some chains in the PDB do not appear in the fasta file: 6t2n-1 +<<< Some chains in the PDB do not appear in the fasta file: 6tkq-2 +<<< Sequence is too short: 6tq0-6 +<<< Some chains in the PDB do not appear in the fasta file: 6tnl-4 +<<< Too many missing values in the ends: 6u39-3 +<<< Sequence is too short: 6u8h-1 +<<< Sequence is too short: 6uk4-1 +<<< Sequence is too short: 6uln-1 +<<< Sequence is too short: 6uz1-2 +<<< Too many missing values in the middle: 6v6q-2 +<<< Too many missing values in the middle: 6vbv-1 +<<< Sequence is too short: 6vjn-1 +<<< Too many missing values in the ends: 6vxp-1 +<<< Sequence is too short: 6w05-1 +<<< Unknown: 6wat-5 +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert + for (chain,) in pdb_entry.get_chains(): +ValueError: too many values to unpack (expected 1) + +<<< Too many missing values in the middle: 6wca-1 +<<< Sequence is too short: 6wfz-1 +<<< Sequence is too short: 6wi4-1 +<<< Too many missing values in total: 6wmd-1 +<<< Too many missing values in the middle: 6wnx-2 +<<< Too many missing values in total: 6wsj-1 +<<< Too many missing values in the middle: 6wvv-2 +<<< Incorrect alignment: 6x0a-3 +<<< Too many missing values in total: 6x1s-1 +<<< Too many missing values in total: 6xxr-1 +<<< Too many missing values in total: 6y73-2 +<<< Some chains in the PDB do not appear in the fasta file: 6yab-2 +<<< Incorrect alignment: 6yn1-2 +<<< Too many missing values in the ends: 6ypl-1 +<<< Some chains in the PDB do not appear in the fasta file: 6yqs-1 +<<< Some chains in the PDB do not appear in the fasta file: 6z3o-1 +<<< Sequence is too short: 6z7w-6 +<<< Some chains in the PDB do not appear in the fasta file: 6zi0-1 +<<< Some chains in the PDB do not appear in the fasta file: 6ziv-5 +<<< Sequence is too short: 6zv7-1 +<<< Some chains in the PDB do not appear in the fasta file: 6zry-2 +<<< Too many missing values in the ends: 6zwo-1 +<<< Sequence is too short: 7a2w-1 +<<< Too many missing values in the middle: 7a8z-1 +<<< Too many missing values in total: 7age-4 +<<< Some chains in the PDB do not appear in the fasta file: 7alx-1 +<<< Too many missing values in total: 7asv-1 +<<< Sequence is too short: 7b13-1 +<<< Too many missing values in total: 7azf-1 +<<< Too many missing values in the ends: 7bji-2 +<<< Too many missing values in total: 7bcy-1 +<<< Too many missing values in total: 7bqz-2 +<<< Too many missing values in total: 7cfd-3 +<<< Sequence is too short: 7co1-1 +<<< Too many missing values in the middle: 7dmx-1 +<<< Too many missing values in the middle: 7cbz-1 +<<< Sequence is too short: 7duu-1 +<<< Too many missing values in the middle: 7daf-1 +<<< Too many missing values in the middle: 7cld-1 +<<< Sequence is too short: 7edo-1 +<<< Too many missing values in the middle: 7ezh-1 +<<< Too many missing values in the middle: 7f2o-1 +<<< Too many missing values in total: 7f4a-1 +<<< Too many missing values in the middle: 7jsk-1 +<<< Sequence is too short: 7k7r-1 +<<< Too many missing values in the middle: 7kzc-2 +<<< Too many missing values in the middle: 7l7j-1 +<<< Too many missing values in the ends: 7lfb-1 +<<< Unnatural amino acids found: 7ln5-1 +<<< Too many missing values in total: 7n27-2 +<<< Too many missing values in the middle: 7mvy-1 +<<< Sequence is too short: 7n5c-1 +<<< Too many missing values in total: 7ni6-1 +<<< Too many missing values in total: 7nkq-1 +<<< Some chains in the PDB do not appear in the fasta file: 7nfv-1 +<<< Some chains in the PDB do not appear in the fasta file: 7nvk-1 +<<< Too many missing values in total: 7nma-1 +<<< Some chains in the PDB do not appear in the fasta file: 7nzb-1 +<<< Too many missing values in the middle: 7o2f-1 +<<< Some chains in the PDB do not appear in the fasta file: 7od0-5 +<<< Some chains in the PDB do not appear in the fasta file: 7obo-1 +<<< Some chains in the PDB do not appear in the fasta file: 7olw-1 +<<< Some chains in the PDB do not appear in the fasta file: 7oza-2 +<<< Some chains in the PDB do not appear in the fasta file: 7p7w-1 +<<< Too many missing values in the middle: 7pe7-1 +<<< Sequence is too short: 7q1s-6 +<<< Some chains in the PDB do not appear in the fasta file: 7pwx-1 +<<< Unknown: 7q8j-2 +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert + for (chain,) in pdb_entry.get_chains(): +ValueError: too many values to unpack (expected 1) + +<<< Unknown: 7q9h-1 +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert + for (chain,) in pdb_entry.get_chains(): +ValueError: too many values to unpack (expected 1) + +<<< Sequence is too short: 7qqy-1 +<<< Some chains in the PDB do not appear in the fasta file: 7quk-1 +<<< Some chains in the PDB do not appear in the fasta file: 7qyx-1 +<<< Too many missing values in total: 7rg9-1 +<<< Too many missing values in the middle: 7rkm-1 +<<< Too many missing values in the middle: 7rna-1 +<<< Too many missing values in total: 7rlz-2 +<<< Too many missing values in the middle: 7rym-1 +<<< Sequence is too short: 7s4g-3 +<<< Sequence is too short: 7s8r-1 +<<< Sequence is too short: 7snx-1 +<<< Too many missing values in total: 7sy0-1 +<<< Too many missing values in the middle: 7st3-6 +<<< Unknown: 7t68-2 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 7t8v-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Incorrect alignment: 7tl7-1 +<<< Too many missing values in total: 7tuq-1 +<<< Too many missing values in the middle: 7u5b-1 +<<< Too many missing values in the ends: 7uxe-1 +<<< Unnatural amino acids found: 7uyl-1 +<<< Too many missing values in the middle: 7v2a-1 +<<< Too many missing values in the ends: 7vec-10 +<<< Too many missing values in total: 7vf3-2 +<<< Too many missing values in total: 7v0s-1 +<<< Too many missing values in the middle: 7vvl-1 +<<< Too many missing values in total: 7vph-3 +<<< Sequence is too short: 7w6i-1 +<<< Too many missing values in total: 7wu3-1 +<<< Too many missing values in the middle: 7x9s-3 +<<< Too many missing values in the middle: 7xwj-1 +<<< Too many missing values in the middle: 7y9n-1 +<<< Too many missing values in the middle: 7ye7-2 +<<< Some chains in the PDB do not appear in the fasta file: 7zae-1 +<<< Too many missing values in total: 7zh4-1 +<<< Too many missing values in total: 7zv7-1 +<<< Too many missing values in the middle: 8aqa-1 +<<< Too many missing values in total: 8bfe-6 +<<< Too many missing values in total: 8b8w-1 +<<< Sequence is too short: 8d36-1 +<<< Unnatural amino acids found: 8ddq-1 +<<< Too many missing values in total: 8dki-1 +<<< Unnatural amino acids found: 8em8-1 +<<< Too many missing values in the middle: 7wlz-1 +<<< Too many missing values in total: 1hh3-2 +<<< Sequence is too short: 1h15-1 +<<< Sequence is too short: 1lgc-2 +<<< Sequence is too short: 1lwu-2 +<<< Sequence is too short: 2g5b-3 +<<< Sequence is too short: 2h43-1 +<<< Sequence is too short: 2zck-1 +<<< Sequence is too short: 3hdb-1 +<<< Sequence is too short: 3n95-8 +<<< Sequence is too short: 3v5a-1 +<<< Too many missing values in total: 4aa2-1 +<<< Too many missing values in the middle: 4gg8-1 +<<< Too many missing values in the middle: 4mwf-1 +<<< Sequence is too short: 4oga-1 +<<< Too many missing values in total: 4um8-1 +<<< Sequence is too short: 5djy-1 +<<< Too many missing values in the middle: 4z5w-1 +<<< Sequence is too short: 5j50-2 +<<< Too many missing values in the middle: 5esv-1 +<<< Too many missing values in the ends: 5w6r-1 +<<< Too many missing values in the middle: 6agf-1 +<<< Too many missing values in total: 5hce-1 +<<< Too many missing values in the ends: 6e7k-1 +<<< Too many missing values in the middle: 6hug-1 +<<< Too many missing values in the middle: 6j15-2 +<<< Too many missing values in the middle: 6l63-1 +<<< Too many missing values in the middle: 6mkz-1 +<<< Too many missing values in the middle: 6oel-1 +<<< Unknown: 6m8p-7 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in the middle: 6pm0-1 +<<< Too many missing values in the middle: 6rvd-1 +<<< Too many missing values in the middle: 6uym-1 +<<< Too many missing values in the middle: 6vkm-1 +<<< Too many missing values in the middle: 6y1z-1 +<<< Some chains in the PDB do not appear in the fasta file: 6zfa-1 +<<< Too many missing values in total: 7ad6-1 +<<< Some chains in the PDB do not appear in the fasta file: 6ytr-2 +<<< Too many missing values in the ends: 7cq6-1 +<<< Some chains in the PDB do not appear in the fasta file: 7b6u-2 +<<< Unknown: 7drb-2 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in the middle: 7kbu-1 +<<< Too many missing values in the middle: 7lkz-1 +<<< Too many missing values in the middle: 7mdu-1 +<<< Too many missing values in the ends: 7qzr-2 +<<< Too many missing values in the middle: 7sxz-1 +<<< Too many missing values in the middle: 7yhk-1 +<<< Sequence is too short: 1a6a-2 +<<< Too many missing values in total: 1ayb-1 +<<< Sequence is too short: 1awr-2 +<<< Sequence is too short: 1b17-2 +<<< Sequence is too short: 1bbr-3 +<<< Sequence is too short: 1bph-1 +<<< Too many missing values in the middle: 1com-1 +<<< Too many missing values in the ends: 7v7z-1 +<<< Sequence is too short: 1d4w-2 +<<< Sequence is too short: 1dph-2 +<<< Too many missing values in the middle: 1du3-2 +<<< Too many missing values in the middle: 1efn-1 +<<< Sequence is too short: 1ee4-1 +<<< Sequence is too short: 1etm-1 +<<< Too many missing values in the middle: 1f1o-1 +<<< Too many missing values in the middle: 1fl1-1 +<<< Sequence is too short: 1fpc-1 +<<< Sequence is too short: 1ffp-2 +<<< Sequence is too short: 1g39-4 +<<< Too many missing values in total: 1gi9-1 +<<< Sequence is too short: 1h24-1 +<<< Sequence is too short: 1hin-1 +<<< Too many missing values in the middle: 1huu-2 +<<< Sequence is too short: 1i1f-2 +<<< Too many missing values in total: 1iqn-1 +<<< Too many missing values in total: 1h8h-1 +<<< Too many missing values in the middle: 1jen-1 +<<< Too many missing values in the middle: 1jg3-1 +<<< Sequence is too short: 1jq8-1 +<<< Too many missing values in the middle: 1jr1-1 +<<< Too many missing values in total: 1kna-1 +<<< Too many missing values in the middle: 1lm8-1 +<<< Sequence is too short: 1mk9-2 +<<< Too many missing values in the middle: 1n0w-1 +<<< Too many missing values in the middle: 1ne2-1 +<<< Sequence is too short: 1nvs-1 +<<< Sequence is too short: 1nx1-1 +<<< Too many missing values in total: 1o6o-2 +<<< Sequence is too short: 1ogt-1 +<<< Sequence is too short: 1ou8-2 +<<< Sequence is too short: 1ox1-1 +<<< Sequence is too short: 1p9u-3 +<<< Too many missing values in the ends: 1q4q-3 +<<< Sequence is too short: 1qd6-3 +<<< Too many missing values in the middle: 1qow-1 +<<< Sequence is too short: 1r5v-3 +<<< Too many missing values in the ends: 1r17-1 +<<< Sequence is too short: 1rbg-2 +<<< Too many missing values in total: 1rrv-2 +<<< Sequence is too short: 1s7s-1 +<<< Too many missing values in the ends: 1sm3-1 +<<< Too many missing values in total: 1sza-2 +<<< Too many missing values in the ends: 1t2v-4 +<<< Unexpected atoms (DD21): 1tes-1 +<<< Too many missing values in the middle: 1tgl-1 +<<< Sequence is too short: 1tjh-1 +<<< Too many missing values in the middle: 1tu3-3 +<<< Too many missing values in total: 1tno-3 +<<< Too many missing values in the ends: 1u9g-1 +<<< Too many missing values in total: 1s3s-1 +<<< Sequence is too short: 1uhd-1 +<<< Sequence is too short: 1uj0-1 +<<< Too many missing values in the middle: 1uys-1 +<<< Sequence is too short: 1v1t-1 +<<< Sequence is too short: 1vc3-1 +<<< Too many missing values in total: 1w7r-2 +<<< Unnatural amino acids found: 1w5c-2 +<<< Too many missing values in the ends: 1wck-1 +<<< Too many missing values in the middle: 1x9r-1 +<<< Too many missing values in the middle: 1xas-1 +<<< Too many missing values in the ends: 1x7a-1 +<<< Sequence is too short: 1xda-12 +<<< Sequence is too short: 1yod-1 +<<< Sequence is too short: 1ypm-1 +<<< Sequence is too short: 1yn7-1 +<<< Too many missing values in the middle: 1zbd-1 +<<< Sequence is too short: 1zni-2 +<<< Too many missing values in the middle: 1zw0-2 +<<< Too many missing values in the middle: 1zxe-2 +<<< Sequence is too short: 2a4q-1 +<<< Sequence is too short: 2adv-1 +<<< Too many missing values in the middle: 1zq1-1 +<<< Too many missing values in the middle: 2b48-1 +<<< Too many missing values in the middle: 2bbh-2 +<<< Too many missing values in total: 2bd5-1 +<<< Sequence is too short: 2bdy-1 +<<< Too many missing values in the middle: 2c1n-2 +<<< Too many missing values in the middle: 2c9w-1 +<<< Too many missing values in the middle: 2d5h-2 +<<< Sequence is too short: 2cvy-1 +<<< Too many missing values in the middle: 2dza-1 +<<< Too many missing values in the middle: 2f0a-7 +<<< Too many missing values in the ends: 2fvv-1 +<<< Sequence is too short: 2fx8-2 +<<< Sequence is too short: 2gch-1 +<<< Unnatural amino acids found: 2gnx-1 +<<< Too many missing values in total: 2gl7-2 +<<< Sequence is too short: 2h1c-2 +<<< Too many missing values in the ends: 2h4w-1 +<<< Sequence is too short: 2h96-1 +<<< Too many missing values in the middle: 2hjg-1 +<<< Too many missing values in the middle: 2hql-2 +<<< Too many missing values in the middle: 2ihf-1 +<<< Sequence is too short: 2ins-5 +<<< Sequence is too short: 2j7i-1 +<<< Too many missing values in the middle: 2jb8-1 +<<< Sequence is too short: 2jds-1 +<<< Too many missing values in the middle: 2nye-1 +<<< Too many missing values in the middle: 2o1x-2 +<<< Too many missing values in the middle: 2ocy-1 +<<< Too many missing values in total: 2npp-1 +<<< Sequence is too short: 2os2-2 +<<< Sequence is too short: 2p6b-1 +<<< Sequence is too short: 2pm5-6 +<<< Too many missing values in the middle: 2pf4-3 +<<< Too many missing values in the middle: 2q7u-2 +<<< Sequence is too short: 2qa9-1 +<<< Sequence is too short: 2qbx-2 +<<< Too many missing values in total: 2uwo-1 +<<< Too many missing values in the middle: 2uy1-1 +<<< Too many missing values in the middle: 2vhf-2 +<<< Too many missing values in the middle: 2vo9-1 +<<< Too many missing values in the middle: 2vpe-1 +<<< Too many missing values in the middle: 2vso-2 +<<< Too many missing values in the middle: 2w6p-2 +<<< Too many missing values in total: 2way-1 +<<< Too many missing values in the ends: 2wpk-1 +<<< Sequence is too short: 2ws6-6 +<<< Too many missing values in the middle: 2wok-1 +<<< Too many missing values in total: 2x4n-1 +<<< Sequence is too short: 2y4v-1 +<<< Too many missing values in the middle: 2yqy-2 +<<< Sequence is too short: 2yvc-3 +<<< Too many missing values in the ends: 2z5s-1 +<<< Too many missing values in total: 2z3e-1 +<<< Too many missing values in the middle: 2zv2-1 +<<< Too many missing values in the middle: 3afq-1 +<<< Too many missing values in total: 3b71-1 +<<< Too many missing values in the middle: 3bku-1 +<<< Too many missing values in total: 3bzy-1 +<<< Sequence is too short: 3c9j-1 +<<< Too many missing values in the middle: 3cjq-2 +<<< Too many missing values in the middle: 3d8e-4 +<<< Sequence is too short: 3dt0-1 +<<< Too many missing values in the middle: 3dpo-1 +<<< Too many missing values in the middle: 3e1k-3 +<<< Sequence is too short: 3e8c-5 +<<< Too many missing values in total: 3egh-3 +<<< Too many missing values in the middle: 3eul-6 +<<< Too many missing values in the middle: 3f4z-1 +<<< Too many missing values in the middle: 3f87-2 +<<< Too many missing values in the middle: 3f9y-2 +<<< Too many missing values in the middle: 3fdx-1 +<<< Too many missing values in the middle: 3fna-1 +<<< Sequence is too short: 3fii-1 +<<< Sequence is too short: 3fqt-1 +<<< Sequence is too short: 3fwv-2 +<<< Too many missing values in total: 3g3b-4 +<<< Too many missing values in the ends: 3gj9-1 +<<< Too many missing values in the middle: 3h8v-1 +<<< Too many missing values in the middle: 3hfh-1 +<<< Too many missing values in the middle: 3hsm-1 +<<< Too many missing values in the middle: 3ier-1 +<<< Too many missing values in the middle: 3ilm-1 +<<< Too many missing values in the middle: 3kdf-1 +<<< Too many missing values in total: 3kqi-2 +<<< Unknown: 3kp5-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in the middle: 3khd-3 +<<< Too many missing values in the middle: 3l15-1 +<<< Sequence is too short: 3l3g-1 +<<< Too many missing values in the middle: 3l6v-2 +<<< Unknown: 3l8r-4 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3l9v-3 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3ld2-4 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lb0-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3le7-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lf9-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lhb-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lgb-2 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lc2-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3li9-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lit-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3ljy-3 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3llt-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lkq-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in the ends: 3lpr-1 +<<< Too many missing values in the middle: 3lt1-1 +<<< Too many missing values in the middle: 3m1g-2 +<<< Too many missing values in the middle: 3mcu-1 +<<< Too many missing values in the ends: 3mlt-1 +<<< Too many missing values in the ends: 3lww-2 +<<< Sequence is too short: 3mrr-1 +<<< Too many missing values in the middle: 3n2e-3 +<<< Sequence is too short: 3nco-4 +<<< Too many missing values in total: 3nfl-1 +<<< Sequence is too short: 3nji-1 +<<< Too many missing values in the middle: 3nkf-1 +<<< Too many missing values in the middle: 3nru-8 +<<< Too many missing values in total: 3o36-1 +<<< Sequence is too short: 3o17-2 +<<< Sequence is too short: 3obq-1 +<<< Too many missing values in the middle: 3oen-1 +<<< Too many missing values in the ends: 3oj3-3 +<<< Sequence is too short: 3omm-1 +<<< Too many missing values in the middle: 3os5-1 +<<< Too many missing values in total: 3ov1-1 +<<< Sequence is too short: 3ozj-1 +<<< Sequence is too short: 3ogl-7 +<<< Too many missing values in the middle: 3p35-2 +<<< Too many missing values in the ends: 3pcx-3 +<<< Sequence is too short: 3plz-1 +<<< Sequence is too short: 3pwl-2 +<<< Too many missing values in the middle: 3q9j-1 +<<< Sequence is too short: 3qjn-6 +<<< Sequence is too short: 3qg6-2 +<<< Sequence is too short: 3qxa-1 +<<< Sequence is too short: 3qzw-1 +<<< Too many missing values in the middle: 3r6o-1 +<<< Too many missing values in the middle: 3re0-2 +<<< Sequence is too short: 3r9i-1 +<<< Too many missing values in the middle: 3rz3-4 +<<< Too many missing values in the ends: 3r1r-9 +<<< Sequence is too short: 3rwf-1 +<<< Unnatural amino acids found: 3stj-2 +<<< Too many missing values in the middle: 3tdh-1 +<<< Sequence is too short: 3tbs-2 +<<< Too many missing values in the middle: 3t8a-1 +<<< Too many missing values in the middle: 3tig-1 +<<< Sequence is too short: 3tei-1 +<<< Sequence is too short: 3tjh-1 +<<< Too many missing values in the middle: 3tsw-3 +<<< Too many missing values in total: 3tpm-1 +<<< Too many missing values in the middle: 3tzn-1 +<<< Sequence is too short: 3u3f-2 +<<< Too many missing values in total: 3u1i-2 +<<< Too many missing values in the middle: 3ub2-1 +<<< Too many missing values in the ends: 3u97-1 +<<< Too many missing values in total: 3ul5-2 +<<< Too many missing values in the ends: 3uua-3 +<<< Sequence is too short: 3uvn-1 +<<< Sequence is too short: 3v3v-2 +<<< Too many missing values in the middle: 3v5n-1 +<<< Too many missing values in total: 3vb6-1 +<<< Sequence is too short: 3vfn-1 +<<< Too many missing values in the middle: 3vnn-1 +<<< Incorrect alignment: 3von-4 +<<< Sequence is too short: 3vrt-1 +<<< Too many missing values in the middle: 3vu4-2 +<<< Sequence is too short: 3vt8-1 +<<< Too many missing values in total: 3vx8-1 +<<< Too many missing values in total: 3wdc-1 +<<< Too many missing values in the middle: 3wso-1 +<<< Too many missing values in total: 3wgv-2 +<<< Sequence is too short: 3zip-1 +<<< Too many missing values in the middle: 4a2q-1 +<<< Sequence is too short: 3zrm-1 +<<< Too many missing values in the ends: 4ag2-1 +<<< Too many missing values in the middle: 4an7-1 +<<< Too many missing values in the middle: 4au7-1 +<<< Too many missing values in the middle: 4ay9-1 +<<< Sequence is too short: 4ax9-1 +<<< Too many missing values in the ends: 4b0e-3 +<<< Sequence is too short: 4bak-1 +<<< Too many missing values in the middle: 4bj5-2 +<<< Too many missing values in total: 4boh-1 +<<< Too many missing values in the ends: 4brr-2 +<<< Too many missing values in total: 4btt-1 +<<< Too many missing values in total: 4bwq-4 +<<< Too many missing values in the middle: 4by2-3 +<<< Unnatural amino acids found: 4cat-1 +<<< Too many missing values in the middle: 4cdz-1 +<<< Too many missing values in the middle: 4cfe-2 +<<< Sequence is too short: 4cim-1 +<<< Too many missing values in the middle: 4ckw-3 +<<< Sequence is too short: 4cxn-2 +<<< Too many missing values in total: 4d11-4 +<<< Too many missing values in the middle: 4da9-2 +<<< Unknown: 4dcb-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in the middle: 4dgs-1 +<<< Sequence is too short: 4dos-1 +<<< Sequence is too short: 4dqm-2 +<<< Sequence is too short: 4e05-1 +<<< Too many missing values in total: 4dx8-1 +<<< Too many missing values in the ends: 4e19-2 +<<< Sequence is too short: 4e2j-1 +<<< Too many missing values in the ends: 4ec6-3 +<<< Sequence is too short: 4edn-2 +<<< Too many missing values in the middle: 4etv-3 +<<< Sequence is too short: 4ezr-1 +<<< Too many missing values in total: 4fbw-3 +<<< Too many missing values in total: 4fgx-1 +<<< Sequence is too short: 4ftg-1 +<<< Too many missing values in total: 4fz3-1 +<<< Sequence is too short: 4g6a-2 +<<< Too many missing values in the middle: 4gfl-1 +<<< Too many missing values in the middle: 4go6-4 +<<< Too many missing values in the middle: 4gq1-1 +<<< Too many missing values in total: 4hs2-1 +<<< Sequence is too short: 4ht6-3 +<<< Sequence is too short: 4hw4-2 +<<< Sequence is too short: 4hwz-1 +<<< Sequence is too short: 4i32-1 +<<< Too many missing values in the middle: 4igk-2 +<<< Sequence is too short: 4ins-7 +<<< Too many missing values in the middle: 4iw4-2 +<<< Too many missing values in total: 4j1v-1 +<<< Sequence is too short: 4j9g-3 +<<< Sequence is too short: 4j84-1 +<<< Too many missing values in the ends: 4k38-2 +<<< Too many missing values in the middle: 4iij-1 +<<< Too many missing values in the middle: 4kb3-1 +<<< Too many missing values in the middle: 4kmo-1 +<<< Sequence is too short: 4ktu-1 +<<< Too many missing values in the middle: 4kzc-1 +<<< Sequence is too short: 4laj-4 +<<< Sequence is too short: 4lrs-2 +<<< Too many missing values in the middle: 4lop-1 +<<< Too many missing values in the middle: 4lzk-1 +<<< Too many missing values in the middle: 4m6h-1 +<<< Too many missing values in total: 4mbe-1 +<<< Sequence is too short: 4mny-2 +<<< Sequence is too short: 4n0c-1 +<<< Unexpected atoms (D): 4n3m-1 +<<< Too many missing values in the middle: 4n84-1 +<<< Too many missing values in total: 4n1a-1 +<<< Too many missing values in total: 4nft-4 +<<< Too many missing values in the middle: 4nim-3 +<<< Too many missing values in the middle: 4nj7-4 +<<< Sequence is too short: 4nmt-2 +<<< Sequence is too short: 4nsk-1 +<<< Too many missing values in total: 4p0b-2 +<<< Sequence is too short: 4p6j-1 +<<< Too many missing values in the ends: 4p3w-2 +<<< Too many missing values in the ends: 4pa7-2 +<<< Too many missing values in the middle: 4pdp-2 +<<< Too many missing values in the middle: 4pl7-2 +<<< Too many missing values in total: 4pk3-1 +<<< Too many missing values in the middle: 4po6-1 +<<< Sequence is too short: 4prb-1 +<<< Too many missing values in the middle: 4qbs-1 +<<< Too many missing values in the middle: 4qky-1 +<<< Too many missing values in total: 4qmf-2 +<<< Sequence is too short: 4pes-2 +<<< Too many missing values in the middle: 4r0j-1 +<<< Sequence is too short: 4qxb-1 +<<< Too many missing values in the middle: 4r3r-1 +<<< Too many missing values in total: 4roj-3 +<<< Too many missing values in total: 4rta-1 +<<< Too many missing values in total: 4ryd-2 +<<< Sequence is too short: 4twj-1 +<<< Too many missing values in the middle: 4u5a-3 +<<< Too many missing values in total: 4u7y-1 +<<< Too many missing values in the middle: 4up7-1 +<<< Too many missing values in the middle: 4v0m-3 +<<< Too many missing values in the middle: 4tv9-1 +<<< Sequence is too short: 4ux9-1 +<<< Too many missing values in the ends: 4w2o-3 +<<< Sequence is too short: 4w71-1 +<<< Unknown: 4v7n-16 +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert + for (chain,) in pdb_entry.get_chains(): +ValueError: too many values to unpack (expected 1) + +<<< Sequence is too short: 4w50-4 +<<< Unknown: 4v4c-10 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in the ends: 4wci-1 +<<< Too many missing values in total: 4uva-1 +<<< Sequence is too short: 4wb6-2 +<<< Too many missing values in the middle: 4x34-1 +<<< Too many missing values in total: 4wyb-10 +<<< Sequence is too short: 4wuu-1 +<<< Too many missing values in total: 4xup-5 +<<< Sequence is too short: 4xi9-1 +<<< Too many missing values in the middle: 4xpd-1 +<<< Sequence is too short: 4yo0-2 +<<< Too many missing values in the middle: 4zb7-1 +<<< Too many missing values in the middle: 4zhx-2 +<<< Too many missing values in the ends: 5aeo-1 +<<< Sequence is too short: 5ajo-1 +<<< Too many missing values in total: 5ah2-2 +<<< Too many missing values in the middle: 5bop-2 +<<< Sequence is too short: 5b4w-2 +<<< Too many missing values in the middle: 5c03-1 +<<< Too many missing values in the middle: 5c7e-2 +<<< Too many missing values in total: 5cxt-9 +<<< Too many missing values in the middle: 5d3x-2 +<<< Too many missing values in the ends: 5d57-2 +<<< Too many missing values in total: 5da7-2 +<<< Too many missing values in total: 5dmg-3 +<<< Too many missing values in the ends: 5dpw-2 +<<< Too many missing values in the middle: 5dxe-1 +<<< Too many missing values in total: 5et0-1 +<<< Sequence is too short: 5f2y-1 +<<< Sequence is too short: 5f67-2 +<<< Too many missing values in the middle: 5f7c-4 +<<< Too many missing values in total: 5ft1-3 +<<< Too many missing values in total: 5fvd-1 +<<< Too many missing values in the middle: 5g53-2 +<<< Too many missing values in the middle: 5gyd-1 +<<< Too many missing values in the middle: 5h5c-1 +<<< Sequence is too short: 5hhq-1 +<<< Sequence is too short: 5hoy-2 +<<< Sequence is too short: 5hyq-2 +<<< Too many missing values in total: 5h2v-1 +<<< Too many missing values in the ends: 5ic3-1 +<<< Too many missing values in total: 5i70-2 +<<< Sequence is too short: 5id0-2 +<<< Too many missing values in total: 5iq9-1 +<<< Sequence is too short: 5fq8-1 +<<< Too many missing values in total: 5iue-3 +<<< Too many missing values in total: 5jbm-1 +<<< Sequence is too short: 5jhc-11 +<<< Sequence is too short: 5jwe-3 +<<< Too many missing values in the middle: 5k1a-1 +<<< Too many missing values in the ends: 5jxh-1 +<<< Too many missing values in total: 5kc1-3 +<<< Too many missing values in the middle: 5keu-2 +<<< Sequence is too short: 5kra-2 +<<< Too many missing values in total: 5l6s-4 +<<< Too many missing values in total: 5lb7-1 +<<< Too many missing values in the middle: 5lsb-1 +<<< Sequence is too short: 5lw1-1 +<<< Sequence is too short: 5m5s-2 +<<< Too many missing values in the ends: 5me5-1 +<<< Sequence is too short: 5m75-1 +<<< Too many missing values in total: 5mk2-2 +<<< Too many missing values in the middle: 5mpi-1 +<<< Too many missing values in total: 5msu-2 +<<< Too many missing values in the middle: 5lov-1 +<<< Too many missing values in the middle: 5mvi-2 +<<< Too many missing values in the ends: 5mwy-2 +<<< Too many missing values in total: 5mu0-6 +<<< Too many missing values in total: 5mub-8 +<<< Too many missing values in total: 5n74-4 +<<< Too many missing values in the middle: 5n5r-1 +<<< Too many missing values in the middle: 5nud-2 +<<< Too many missing values in total: 5npw-3 +<<< Too many missing values in the middle: 5o3r-1 +<<< Sequence is too short: 5o9v-1 +<<< Too many missing values in the middle: 5oi5-1 +<<< Too many missing values in the middle: 5ojo-1 +<<< Too many missing values in total: 5oo6-7 +<<< Sequence is too short: 5q0m-1 +<<< Too many missing values in the ends: 5q1g-1 +<<< Too many missing values in total: 5oqr-1 +<<< Sequence is too short: 5qu2-1 +<<< Too many missing values in the middle: 5r4b-1 +<<< Sequence is too short: 5r1r-10 +<<< Too many missing values in the middle: 5s5z-1 +<<< Too many missing values in the middle: 5s4l-1 +<<< Too many missing values in the middle: 5sbc-1 +<<< Too many missing values in the middle: 5sus-1 +<<< Too many missing values in the middle: 5t28-1 +<<< Sequence is too short: 5t1m-1 +<<< Too many missing values in the middle: 5tgc-1 +<<< Sequence is too short: 5u98-1 +<<< Too many missing values in the middle: 5un6-2 +<<< Too many missing values in the middle: 5uq0-2 +<<< Too many missing values in the middle: 5uui-1 +<<< Sequence is too short: 5v5l-1 +<<< Sequence is too short: 5va9-2 +<<< Sequence is too short: 5vkl-1 +<<< Too many missing values in the middle: 5vvu-1 +<<< Too many missing values in the middle: 5vph-1 +<<< Sequence is too short: 5vuf-1 +<<< Too many missing values in the middle: 5w4h-1 +<<< Too many missing values in the middle: 5wer-4 +<<< Sequence is too short: 5wlj-1 +<<< Sequence is too short: 5wqd-1 +<<< Too many missing values in the middle: 5wuy-1 +<<< Too many missing values in the middle: 5wy5-1 +<<< Sequence is too short: 5wzx-2 +<<< Too many missing values in the middle: 5xeu-1 +<<< Sequence is too short: 5xoq-1 +<<< Too many missing values in the middle: 5xu6-2 +<<< Too many missing values in total: 5xwa-1 +<<< Too many missing values in the middle: 5y28-1 +<<< Sequence is too short: 5xzh-1 +<<< Sequence is too short: 5yd5-2 +<<< Too many missing values in the ends: 5yiq-1 +<<< Too many missing values in the middle: 5yj1-15 +<<< Too many missing values in the middle: 5z08-1 +<<< Too many missing values in total: 5zgc-3 +<<< Too many missing values in the middle: 5zia-5 +<<< Sequence is too short: 5zmz-1 +<<< Too many missing values in the middle: 6a2l-1 +<<< Too many missing values in the middle: 6ae1-1 +<<< Sequence is too short: 6au5-2 +<<< Sequence is too short: 6azk-1 +<<< Too many missing values in the middle: 6b4c-2 +<<< Too many missing values in total: 6bqt-2 +<<< Too many missing values in the middle: 6c08-2 +<<< Too many missing values in the middle: 6brp-1 +<<< Too many missing values in the middle: 6c4u-4 +<<< Too many missing values in total: 6c1q-1 +<<< Sequence is too short: 6cbi-2 +<<< Sequence is too short: 6cqq-1 +<<< Too many missing values in the middle: 6cxo-3 +<<< Too many missing values in the middle: 6d4g-2 +<<< Too many missing values in the middle: 6dft-1 +<<< Too many missing values in the middle: 6dr6-1 +<<< Sequence is too short: 6e3g-2 +<<< Too many missing values in total: 6ecf-6 +<<< Too many missing values in the middle: 6d88-1 +<<< Too many missing values in the middle: 6ejl-1 +<<< Sequence is too short: 6e4d-1 +<<< Sequence is too short: 6eqb-1 +<<< Too many missing values in the middle: 6ffk-2 +<<< Too many missing values in total: 6g07-4 +<<< Too many missing values in total: 6fy2-2 +<<< Sequence is too short: 6g6f-1 +<<< Unknown: 6g5k-2 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in the middle: 6g8r-1 +<<< Too many missing values in the middle: 6gek-2 +<<< Sequence is too short: 6gh1-2 +<<< Too many missing values in total: 6h06-4 +<<< Sequence is too short: 6hby-2 +<<< Too many missing values in the middle: 6hm8-1 +<<< Some chains in the PDB do not appear in the fasta file: 6i47-1 +<<< Too many missing values in the middle: 6hzk-1 +<<< Too many missing values in the middle: 6i8b-1 +<<< Sequence is too short: 6iwg-1 +<<< Too many missing values in the middle: 6j7f-1 +<<< Sequence is too short: 6j2f-1 +<<< Too many missing values in total: 6jzc-1 +<<< Too many missing values in the middle: 6k6w-1 +<<< Too many missing values in the middle: 6k9g-1 +<<< Too many missing values in the middle: 6kmt-3 +<<< Sequence is too short: 6knw-1 +<<< Too many missing values in the middle: 6l7v-1 +<<< Too many missing values in total: 6ldw-1 +<<< Too many missing values in total: 6ltn-1 +<<< Too many missing values in the middle: 6m1v-1 +<<< Too many missing values in the middle: 6m33-1 +<<< Sequence is too short: 6mbl-1 +<<< Too many missing values in total: 6mak-1 +<<< Too many missing values in the ends: 6mjb-1 +<<< Too many missing values in the middle: 6mnm-1 +<<< Sequence is too short: 6mpn-3 +<<< Too many missing values in the ends: 6n2b-1 +<<< Sequence is too short: 6nca-14 +<<< Sequence is too short: 6nv1-2 +<<< Unnatural amino acids found: 6o2p-1 +<<< Too many missing values in total: 6o3x-3 +<<< Too many missing values in the ends: 6oau-2 +<<< Sequence is too short: 6oqy-1 +<<< Sequence is too short: 6oyy-2 +<<< Sequence is too short: 6pho-1 +<<< Too many missing values in the ends: 6psd-6 +<<< Too many missing values in the middle: 6pw8-1 +<<< Too many missing values in total: 6qsz-5 +<<< Too many missing values in total: 6r3v-1 +<<< Sequence is too short: 6r51-2 +<<< Too many missing values in the middle: 6rix-2 +<<< Too many missing values in the middle: 6rn5-1 +<<< Sequence is too short: 6rot-1 +<<< Too many missing values in the middle: 6qpg-1 +<<< Too many missing values in total: 6rtb-1 +<<< Sequence is too short: 6rxm-6 +<<< Too many missing values in the ends: 6sb4-1 +<<< Unnatural amino acids found: 6sdv-1 +<<< Some chains in the PDB do not appear in the fasta file: 6sqv-2 +<<< Too many missing values in total: 6sst-1 +<<< Some chains in the PDB do not appear in the fasta file: 6sla-2 +<<< Some chains in the PDB do not appear in the fasta file: 6t2n-2 +<<< Some chains in the PDB do not appear in the fasta file: 6t9r-1 +<<< Some chains in the PDB do not appear in the fasta file: 6tkr-1 +<<< Sequence is too short: 6tq0-7 +<<< Too many missing values in the middle: 6u04-1 +<<< Too many missing values in the ends: 6u39-4 +<<< Sequence is too short: 6u8i-1 +<<< Too many missing values in the middle: 6v98-1 +<<< Sequence is too short: 6vbx-1 +<<< Too many missing values in the middle: 6vjo-1 +<<< Too many missing values in total: 6vil-7 +<<< Incorrect alignment: 6vmk-1 +<<< Unknown: 6wat-6 +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert + for (chain,) in pdb_entry.get_chains(): +ValueError: too many values to unpack (expected 1) + +<<< Too many missing values in the middle: 6wcb-1 +<<< Sequence is too short: 6wfz-2 +<<< Sequence is too short: 6wi4-2 +<<< Too many missing values in total: 6wme-1 +<<< Too many missing values in the middle: 6wsk-1 +<<< Too many missing values in the middle: 6wnx-3 +<<< Incorrect alignment: 6x0a-4 +<<< Too many missing values in total: 6x1s-2 +<<< Too many missing values in the middle: 6x90-1 +<<< Too many missing values in the middle: 6xog-1 +<<< Too many missing values in total: 6xxr-2 +<<< Too many missing values in total: 6wxh-1 +<<< Too many missing values in total: 6y73-3 +<<< Some chains in the PDB do not appear in the fasta file: 6yab-3 +<<< Some chains in the PDB do not appear in the fasta file: 6y4a-1 +<<< Too many missing values in total: 6yih-1 +<<< Too many missing values in total: 6yn1-3 +<<< Sequence is too short: 6yx2-1 +<<< Some chains in the PDB do not appear in the fasta file: 6z3o-2 +<<< Sequence is too short: 6zfm-1 +<<< Some chains in the PDB do not appear in the fasta file: 6zi1-1 +<<< Too many missing values in the middle: 6zmm-1 +<<< Some chains in the PDB do not appear in the fasta file: 6ziv-6 +<<< Sequence is too short: 6zv8-1 +<<< Some chains in the PDB do not appear in the fasta file: 6zrz-1 +<<< Sequence is too short: 7a2x-1 +<<< Too many missing values in total: 7acv-1 +<<< Some chains in the PDB do not appear in the fasta file: 7aly-1 +<<< Too many missing values in total: 7ahh-1 +<<< Too many missing values in the middle: 7aue-1 +<<< Too many missing values in total: 7b5o-1 +<<< Too many missing values in the middle: 7b15-1 +<<< Some chains in the PDB do not appear in the fasta file: 7b74-1 +<<< Too many missing values in total: 7azf-2 +<<< Some chains in the PDB do not appear in the fasta file: 7beb-1 +<<< Too many missing values in the middle: 7bii-1 +<<< Too many missing values in total: 7bcy-2 +<<< Too many missing values in total: 7bqz-3 +<<< Too many missing values in the middle: 7cmu-1 +<<< Sequence is too short: 7co2-1 +<<< Too many missing values in total: 7b2m-1 +<<< Too many missing values in the middle: 7d4y-1 +<<< Too many missing values in total: 7d6r-1 +<<< Too many missing values in the middle: 7dmx-2 +<<< Too many missing values in the ends: 7duv-1 +<<< Too many missing values in the middle: 7dvs-2 +<<< Too many missing values in total: 7e0f-1 +<<< Too many missing values in the middle: 7ce6-1 +<<< Too many missing values in the middle: 7eg0-1 +<<< Too many missing values in the middle: 7el4-1 +<<< Sequence is too short: 7edo-2 +<<< Too many missing values in total: 7e6j-1 +<<< Too many missing values in total: 7f1o-1 +<<< Sequence is too short: 7esi-1 +<<< Sequence is too short: 7f7g-1 +<<< Too many missing values in the ends: 7fcp-1 +<<< Unknown: 7f8i-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in the ends: 7k7r-2 +<<< Too many missing values in the middle: 7kgv-1 +<<< Too many missing values in the middle: 7l7k-1 +<<< Sequence is too short: 7lfc-1 +<<< Too many missing values in the middle: 7mbx-1 +<<< Too many missing values in the middle: 7mvz-1 +<<< Too many missing values in total: 7n27-3 +<<< Too many missing values in total: 7n5d-1 +<<< Some chains in the PDB do not appear in the fasta file: 7n3m-1 +<<< Too many missing values in total: 7nfw-1 +<<< Too many missing values in the middle: 7ni7-1 +<<< Some chains in the PDB do not appear in the fasta file: 7nmc-1 +<<< Some chains in the PDB do not appear in the fasta file: 7nkt-1 +<<< Some chains in the PDB do not appear in the fasta file: 7nvp-1 +<<< Some chains in the PDB do not appear in the fasta file: 7nzb-2 +<<< Too many missing values in the middle: 7o0l-1 +<<< Some chains in the PDB do not appear in the fasta file: 7od0-6 +<<< Too many missing values in total: 7opw-1 +<<< Too many missing values in total: 7ors-1 +<<< Some chains in the PDB do not appear in the fasta file: 7ozb-1 +<<< Some chains in the PDB do not appear in the fasta file: 7p1y-1 +<<< Sequence is too short: 7oxn-1 +<<< Some chains in the PDB do not appear in the fasta file: 7pj3-1 +<<< Some chains in the PDB do not appear in the fasta file: 7plr-1 +<<< Too many missing values in the middle: 7pe8-1 +<<< Sequence is too short: 7pns-1 +<<< Some chains in the PDB do not appear in the fasta file: 7pwx-2 +<<< Sequence is too short: 7q1s-7 +<<< Sequence is too short: 7q50-1 +<<< Unknown: 7q8k-1 +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert + for (chain,) in pdb_entry.get_chains(): +ValueError: too many values to unpack (expected 1) + +<<< Too many missing values in the ends: 7qb9-1 +<<< Unknown: 7q9h-2 +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert + for (chain,) in pdb_entry.get_chains(): +ValueError: too many values to unpack (expected 1) + +<<< Some chains in the PDB do not appear in the fasta file: 7qel-1 +<<< Too many missing values in the middle: 7rga-1 +<<< Sequence is too short: 7r1v-1 +<<< Sequence is too short: 7rnb-1 +<<< Too many missing values in total: 7rm0-1 +<<< Sequence is too short: 7s4g-4 +<<< Too many missing values in the middle: 7ryn-1 +<<< Sequence is too short: 7s8r-2 +<<< Too many missing values in total: 7sy2-1 +<<< Too many missing values in the middle: 7st3-7 +<<< Too many missing values in the middle: 7t1i-1 +<<< Unknown: 7t8v-2 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Incorrect alignment: 7tl7-2 +<<< Sequence is too short: 7tt8-1 +<<< Too many missing values in the middle: 7u5b-2 +<<< Too many missing values in total: 7t30-1 +<<< Unnatural amino acids found: 7uym-1 +<<< Too many missing values in total: 7v0t-1 +<<< Too many missing values in the middle: 7vvm-1 +<<< Too many missing values in the middle: 7vph-4 +<<< Too many missing values in the ends: 7w08-1 +<<< Sequence is too short: 7w6j-1 +<<< Too many missing values in total: 7wm0-1 +<<< Too many missing values in total: 7wu4-1 +<<< Too many missing values in the middle: 7xmr-1 +<<< Too many missing values in total: 7xp4-1 +<<< Too many missing values in the middle: 7xwj-2 +<<< Too many missing values in the middle: 7ye8-1 +<<< Too many missing values in the middle: 8a2d-1 +<<< Sequence is too short: 7zpy-1 +<<< Too many missing values in the ends: 7zv8-1 +<<< Too many missing values in total: 8aex-1 +<<< Too many missing values in the middle: 8aqb-1 +<<< Too many missing values in the middle: 8bfe-7 +<<< Too many missing values in total: 8b8w-2 +<<< Unnatural amino acids found: 8ddr-1 +<<< Too many missing values in total: 8dpf-1 +<<< Sequence is too short: 8gch-1 +<<< Sequence is too short: 8gvg-1 +<<< Too many missing values in the middle: 1gmn-1 +<<< Too many missing values in total: 1hha-1 +<<< Sequence is too short: 1h15-2 +<<< Too many missing values in the ends: 1iau-1 +<<< Too many missing values in the middle: 1k9i-1 +<<< Too many missing values in total: 1r9n-1 +<<< Too many missing values in total: 2b5i-1 +<<< Sequence is too short: 2g5b-4 +<<< Sequence is too short: 2h43-2 +<<< Too many missing values in the middle: 3cu7-2 +<<< Sequence is too short: 3n95-9 +<<< Unknown: 3l4u-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in the middle: 4bqc-2 +<<< Too many missing values in the middle: 4gg8-2 +<<< Too many missing values in the middle: 4mwf-2 +<<< Too many missing values in the middle: 4pir-1 +<<< Too many missing values in the middle: 4v3d-1 +<<< Too many missing values in total: 4um8-2 +<<< Too many missing values in the middle: 4z5w-2 +<<< Too many missing values in total: 5djz-1 +<<< Sequence is too short: 5ab0-1 +<<< Sequence is too short: 5j51-1 +<<< Too many missing values in the middle: 5l1x-1 +<<< Too many missing values in the middle: 5hyx-1 +<<< Too many missing values in the middle: 5uph-1 +<<< Too many missing values in the middle: 5xea-1 +<<< Too many missing values in the ends: 5w6r-2 +<<< Too many missing values in total: 6cxg-1 +<<< Too many missing values in the ends: 6e7k-2 +<<< Too many missing values in the middle: 6huj-1 +<<< Too many missing values in the middle: 6j34-1 +<<< Too many missing values in the middle: 6l63-2 +<<< Too many missing values in the middle: 6oeu-1 +<<< Too many missing values in the middle: 6pm1-1 +<<< Unknown: 6m8p-8 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in the middle: 6uym-2 +<<< Some chains in the PDB do not appear in the fasta file: 6yut-1 +<<< Some chains in the PDB do not appear in the fasta file: 6zfn-1 +<<< Too many missing values in total: 7ad7-1 +<<< Some chains in the PDB do not appear in the fasta file: 7b6v-1 +<<< Too many missing values in the middle: 7kc4-1 +<<< Too many missing values in the middle: 7laa-1 +<<< Too many missing values in the middle: 7my2-1 +<<< Too many missing values in the middle: 7r14-1 +<<< Too many missing values in the middle: 7sy1-1 +<<< Too many missing values in the middle: 8dlm-1 +<<< Sequence is too short: 1a3r-1 +<<< Sequence is too short: 1avf-1 +<<< Sequence is too short: 1awr-3 +<<< Too many missing values in total: 1ayc-1 +<<< Sequence is too short: 1b17-3 +<<< Sequence is too short: 1bbr-4 +<<< Incorrect alignment: 1bj4-1 +<<< Sequence is too short: 1bph-2 +<<< Sequence is too short: 1bw8-1 +<<< Too many missing values in the middle: 1bzh-1 +<<< Sequence is too short: 1c9l-1 +<<< Too many missing values in the middle: 1com-2 +<<< Too many missing values in total: 1czi-1 +<<< Unnatural amino acids found: 1deq-1 +<<< Sequence is too short: 1dph-3 +<<< Too many missing values in the ends: 7v81-1 +<<< Sequence is too short: 1ejh-1 +<<< Sequence is too short: 1ee4-2 +<<< Sequence is too short: 1etn-1 +<<< Too many missing values in the middle: 1ex4-1 +<<< Too many missing values in total: 1ffs-1 +<<< Too many missing values in the middle: 1fl1-2 +<<< Sequence is too short: 1h8i-1 +<<< Too many missing values in the middle: 1hio-1 +<<< Sequence is too short: 1hh6-1 +<<< Too many missing values in the middle: 1huu-3 +<<< Sequence is too short: 1hy2-1 +<<< Too many missing values in the ends: 1isq-1 +<<< Too many missing values in the middle: 1jen-2 +<<< Too many missing values in the middle: 1jg3-2 +<<< Too many missing values in the middle: 1jr1-2 +<<< Sequence is too short: 1mk9-3 +<<< Too many missing values in the middle: 1mul-1 +<<< Sequence is too short: 1n0x-1 +<<< Too many missing values in the middle: 1ofp-1 +<<< Sequence is too short: 1o5g-1 +<<< Sequence is too short: 1oj5-1 +<<< Too many missing values in total: 1o6o-3 +<<< Too many missing values in the ends: 1p8d-1 +<<< Sequence is too short: 1pfg-1 +<<< Sequence is too short: 1pzl-1 +<<< Too many missing values in total: 1q4q-4 +<<< Sequence is too short: 1q94-1 +<<< Too many missing values in the ends: 1r17-2 +<<< Sequence is too short: 1rbh-1 +<<< Sequence is too short: 1r5w-1 +<<< Sequence is too short: 1rxm-1 +<<< Too many missing values in total: 1s4v-1 +<<< Sequence is too short: 1s7t-1 +<<< Too many missing values in total: 1sps-1 +<<< Sequence is too short: 1t2v-5 +<<< Sequence is too short: 1t5z-1 +<<< Sequence is too short: 1ta6-1 +<<< Sequence is too short: 1tet-1 +<<< Too many missing values in the middle: 1tol-1 +<<< Sequence is too short: 1tji-1 +<<< Too many missing values in total: 1tno-4 +<<< Too many missing values in the ends: 1u9g-2 +<<< Sequence is too short: 1uhe-1 +<<< Sequence is too short: 1uef-1 +<<< Sequence is too short: 1uny-1 +<<< Too many missing values in the middle: 1uys-2 +<<< Sequence is too short: 1vc3-2 +<<< Too many missing values in total: 1vr9-1 +<<< Too many missing values in total: 1w7r-3 +<<< Too many missing values in total: 1w6i-1 +<<< Too many missing values in the ends: 1x7a-2 +<<< Sequence is too short: 1xda-2 +<<< Too many missing values in the middle: 1xp4-2 +<<< Too many missing values in the middle: 1y14-1 +<<< Too many missing values in the middle: 1zbd-2 +<<< Sequence is too short: 1zmk-1 +<<< Sequence is too short: 1zni-5 +<<< Too many missing values in the middle: 1zw0-3 +<<< Too many missing values in the middle: 1zxe-3 +<<< Sequence is too short: 2a4r-1 +<<< Sequence is too short: 2ag3-1 +<<< Too many missing values in total: 2ahk-1 +<<< Too many missing values in total: 2bd7-1 +<<< Unknown: 2c2o-1 +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1334, in get_coordinates_array + chain_crd[informative_mask]["unique_residue_number"].astype(int), + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/generic.py", line 6324, in astype + new_data = self._mgr.astype(dtype=dtype, copy=copy, errors=errors) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/internals/managers.py", line 451, in astype + return self.apply( + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/internals/managers.py", line 352, in apply + applied = getattr(b, f)(**kwargs) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/internals/blocks.py", line 511, in astype + new_values = astype_array_safe(values, dtype, copy=copy, errors=errors) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/dtypes/astype.py", line 242, in astype_array_safe + new_values = astype_array(values, dtype, copy=copy) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/dtypes/astype.py", line 187, in astype_array + values = _astype_nansafe(values, dtype, copy=copy) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/dtypes/astype.py", line 138, in _astype_nansafe + return arr.astype(dtype, copy=True) +ValueError: invalid literal for int() with base 10: '277_' + +<<< Sequence is too short: 2clv-1 +<<< Sequence is too short: 2fx8-3 +<<< Sequence is too short: 2gch-2 +<<< Too many missing values in the middle: 2gl8-1 +<<< Too many missing values in the middle: 2h3r-1 +<<< Sequence is too short: 2gt9-1 +<<< Too many missing values in the middle: 2hak-8 +<<< Sequence is too short: 2h96-2 +<<< Too many missing values in the middle: 2hwy-1 +<<< Too many missing values in the middle: 2i46-1 +<<< Too many missing values in the middle: 2ieq-1 +<<< Too many missing values in total: 2j5l-1 +<<< Sequence is too short: 2j7i-2 +<<< Too many missing values in total: 2jf1-1 +<<< Sequence is too short: 2jdt-1 +<<< Too many missing values in the middle: 2nye-3 +<<< Too many missing values in the middle: 2ocy-2 +<<< Too many missing values in total: 2npp-2 +<<< Too many missing values in the middle: 2op0-1 +<<< Too many missing values in the ends: 2p32-1 +<<< Too many missing values in the middle: 2p22-4 +<<< Too many missing values in the middle: 2pf4-4 +<<< Too many missing values in total: 2pxj-1 +<<< Sequence is too short: 2qa9-2 +<<< Sequence is too short: 2qbx-3 +<<< Too many missing values in the middle: 2qob-1 +<<< Sequence is too short: 2qpy-1 +<<< Too many missing values in total: 2uwp-1 +<<< Sequence is too short: 2vay-1 +<<< Too many missing values in the middle: 2vfj-2 +<<< Too many missing values in the middle: 2vo9-2 +<<< Sequence is too short: 2vpe-2 +<<< Too many missing values in the ends: 2way-2 +<<< Too many missing values in the ends: 2wpl-1 +<<< Too many missing values in the ends: 2x6m-1 +<<< Too many missing values in total: 2x4n-2 +<<< Too many missing values in the middle: 2xc0-1 +<<< Too many missing values in total: 2xi1-1 +<<< Too many missing values in the middle: 2yqy-3 +<<< Too many missing values in the ends: 2z5s-2 +<<< Sequence is too short: 2z4j-1 +<<< Too many missing values in total: 2z3e-2 +<<< Sequence is too short: 2zg0-1 +<<< Sequence is too short: 2zl9-1 +<<< Too many missing values in the middle: 2zxf-1 +<<< Too many missing values in total: 3a2h-3 +<<< Sequence is too short: 3afr-1 +<<< Too many missing values in total: 3b71-2 +<<< Too many missing values in the middle: 3bd1-1 +<<< Too many missing values in the middle: 3bku-2 +<<< Too many missing values in the middle: 3bqu-1 +<<< Too many missing values in total: 3bzy-2 +<<< Sequence is too short: 3cay-1 +<<< Too many missing values in the middle: 3cjq-3 +<<< Sequence is too short: 3cvn-1 +<<< Too many missing values in the middle: 3d8f-1 +<<< Too many missing values in the middle: 3db3-1 +<<< Too many missing values in the middle: 3dpo-2 +<<< Too many missing values in the middle: 3ddr-1 +<<< Too many missing values in the middle: 3dy7-1 +<<< Too many missing values in the middle: 3e1k-4 +<<< Sequence is too short: 3e8c-6 +<<< Too many missing values in the middle: 3f50-1 +<<< Sequence is too short: 3f9z-1 +<<< Too many missing values in the middle: 3fdx-2 +<<< Too many missing values in the middle: 3fqu-1 +<<< Unnatural amino acids found: 3gd3-5 +<<< Sequence is too short: 3g9e-1 +<<< Sequence is too short: 3gic-1 +<<< Too many missing values in the ends: 3gj9-2 +<<< Too many missing values in total: 3h3p-1 +<<< Too many missing values in the middle: 3h6x-1 +<<< Too many missing values in the middle: 3hfh-2 +<<< Too many missing values in the middle: 3hsm-2 +<<< Too many missing values in the middle: 3ihr-1 +<<< Too many missing values in the middle: 3ilm-2 +<<< Too many missing values in the middle: 3ioy-1 +<<< Too many missing values in the middle: 3iam-1 +<<< Too many missing values in the middle: 3kdf-2 +<<< Unexpected atoms (D1): 3kcj-1 +<<< Too many missing values in total: 3kee-1 +<<< Unknown: 3kog-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3kp6-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in the middle: 3l15-2 +<<< Too many missing values in the middle: 3k9b-1 +<<< Unknown: 3l27-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in total: 3kv4-1 +<<< Too many missing values in the middle: 3kyc-1 +<<< Sequence is too short: 3l3h-1 +<<< Unknown: 3l9v-4 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3l8s-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lb1-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lc3-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3le7-2 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lgc-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lfa-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lhb-2 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3liu-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Sequence is too short: 3l6x-1 +<<< Unknown: 3li9-2 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3ljz-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3ld3-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 3lkr-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Sequence is too short: 3lox-1 +<<< Too many missing values in the middle: 3lt2-1 +<<< Unknown: 3llu-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in total: 3mat-1 +<<< Unnatural amino acids found: 3mn9-1 +<<< Too many missing values in the ends: 3mlt-2 +<<< Too many missing values in the middle: 3n6y-1 +<<< Too many missing values in total: 3nfl-2 +<<< Too many missing values in the middle: 3ml1-1 +<<< Sequence is too short: 3njj-2 +<<< Too many missing values in the middle: 3nkf-2 +<<< Sequence is too short: 3o2h-1 +<<< Sequence is too short: 3o17-3 +<<< Too many missing values in total: 3o71-1 +<<< Too many missing values in the middle: 3oeo-1 +<<< Too many missing values in the ends: 3oj3-4 +<<< Sequence is too short: 3okh-1 +<<< Sequence is too short: 3omm-2 +<<< Sequence is too short: 3ou3-1 +<<< Too many missing values in total: 3ov1-2 +<<< Too many missing values in the middle: 3p0h-2 +<<< Sequence is too short: 3ogl-8 +<<< Sequence is too short: 3p8n-1 +<<< Too many missing values in the middle: 3p9g-1 +<<< Too many missing values in total: 3pgz-1 +<<< Sequence is too short: 3plz-2 +<<< Too many missing values in the middle: 3q9j-2 +<<< Sequence is too short: 3qjn-7 +<<< Too many missing values in total: 3qhe-1 +<<< Sequence is too short: 3qtv-1 +<<< Sequence is too short: 3qxa-2 +<<< Sequence is too short: 3qzw-2 +<<< Too many missing values in the middle: 3rd4-1 +<<< Too many missing values in the ends: 3r9i-2 +<<< Too many missing values in the middle: 3rpg-3 +<<< Sequence is too short: 3rqf-3 +<<< Sequence is too short: 3rwg-1 +<<< Sequence is too short: 3si3-1 +<<< Unnatural amino acids found: 3stj-3 +<<< Too many missing values in the middle: 3sy3-1 +<<< Too many missing values in the middle: 3t8b-1 +<<< Sequence is too short: 3tbt-1 +<<< Too many missing values in the middle: 3tii-1 +<<< Too many missing values in total: 3tdi-1 +<<< Too many missing values in the ends: 3tnp-1 +<<< Sequence is too short: 3tkn-1 +<<< Too many missing values in total: 3tsw-4 +<<< Too many missing values in total: 3u1j-1 +<<< Sequence is too short: 3u3f-3 +<<< Sequence is too short: 3u98-1 +<<< Too many missing values in the middle: 3ub3-1 +<<< Too many missing values in the middle: 3ujz-1 +<<< Too many missing values in total: 3ul6-1 +<<< Sequence is too short: 3uvn-2 +<<< Too many missing values in the middle: 3v6o-1 +<<< Too many missing values in the middle: 3v9r-1 +<<< Too many missing values in the ends: 3vb7-1 +<<< Sequence is too short: 3vfo-1 +<<< Sequence is too short: 3vi1-1 +<<< Sequence is too short: 3vru-1 +<<< Too many missing values in the middle: 3vu4-3 +<<< Too many missing values in total: 3vx8-2 +<<< Too many missing values in total: 3wdd-1 +<<< Too many missing values in the middle: 3wyf-1 +<<< Too many missing values in total: 3ziq-1 +<<< Too many missing values in the middle: 4a2q-2 +<<< Sequence is too short: 4aen-1 +<<< Too many missing values in the ends: 4ag2-2 +<<< Unnatural amino acids found: 4aze-1 +<<< Too many missing values in the middle: 4ay9-2 +<<< Sequence is too short: 4axa-1 +<<< Too many missing values in the middle: 4b86-1 +<<< Too many missing values in the middle: 4bj6-1 +<<< Sequence is too short: 4boh-2 +<<< Too many missing values in total: 4btt-2 +<<< Too many missing values in the middle: 4cbt-3 +<<< Too many missing values in the middle: 4ce0-1 +<<< Too many missing values in total: 4cfg-1 +<<< Sequence is too short: 4cim-2 +<<< Too many missing values in the middle: 4ckw-4 +<<< Too many missing values in the middle: 4cz2-1 +<<< Sequence is too short: 4d2l-1 +<<< Too many missing values in the middle: 4da9-3 +<<< Too many missing values in total: 4d4o-1 +<<< Sequence is too short: 4dos-2 +<<< Too many missing values in the middle: 4dx8-2 +<<< Sequence is too short: 4e06-1 +<<< Sequence is too short: 4e2j-2 +<<< Too many missing values in the ends: 4ec6-4 +<<< Too many missing values in total: 4edn-3 +<<< Too many missing values in the middle: 4em0-1 +<<< Sequence is too short: 4eqf-1 +<<< Sequence is too short: 4ezr-2 +<<< Too many missing values in total: 4fgx-2 +<<< Too many missing values in the middle: 4fxu-1 +<<< Too many missing values in total: 4gln-1 +<<< Too many missing values in the middle: 4go7-1 +<<< Sequence is too short: 4ht6-4 +<<< Sequence is too short: 4hs3-1 +<<< Too many missing values in the middle: 4hvh-1 +<<< Sequence is too short: 4i32-2 +<<< Sequence is too short: 4iw6-1 +<<< Too many missing values in total: 4j40-1 +<<< Too many missing values in total: 4j1v-2 +<<< Too many missing values in total: 4imy-1 +<<< Sequence is too short: 4j9h-1 +<<< Sequence is too short: 4j84-2 +<<< Too many missing values in the middle: 4jdx-3 +<<< Sequence is too short: 4jbn-1 +<<< Too many missing values in total: 4jmg-1 +<<< Sequence is too short: 4js0-1 +<<< Sequence is too short: 4jzz-1 +<<< Too many missing values in total: 4k39-1 +<<< Too many missing values in the middle: 4kg8-1 +<<< Too many missing values in total: 4kv4-1 +<<< Too many missing values in the middle: 4kya-1 +<<< Too many missing values in the middle: 4lop-2 +<<< Too many missing values in the middle: 4m6h-2 +<<< Too many missing values in total: 4mbe-2 +<<< Sequence is too short: 4mgp-1 +<<< Sequence is too short: 4n0c-2 +<<< Too many missing values in the middle: 4n77-1 +<<< Unexpected atoms (D): 4n9v-1 +<<< Too many missing values in total: 4n1a-2 +<<< Sequence is too short: 4nin-1 +<<< Too many missing values in the middle: 4nks-1 +<<< Unexpected atoms (DA): 4ny6-1 +<<< Too many missing values in the ends: 4ol4-1 +<<< Sequence is too short: 4onf-1 +<<< Sequence is too short: 4p6k-1 +<<< Unnatural amino acids found: 4p1w-1 +<<< Too many missing values in the ends: 4p3w-3 +<<< Too many missing values in the middle: 4p7s-1 +<<< Sequence is too short: 4pg2-1 +<<< Too many missing values in the middle: 4pnh-1 +<<< Too many missing values in total: 4pl8-1 +<<< Too many missing values in the middle: 4psi-1 +<<< Sequence is too short: 4prd-1 +<<< Sequence is too short: 4q6s-1 +<<< Too many missing values in the middle: 4qnq-1 +<<< Too many missing values in total: 4qmg-1 +<<< Too many missing values in the middle: 4r0j-2 +<<< Sequence is too short: 4r3s-1 +<<< Too many missing values in total: 4qxb-2 +<<< Too many missing values in the ends: 4rxh-1 +<<< Too many missing values in total: 4ryd-3 +<<< Sequence is too short: 4tzl-1 +<<< Too many missing values in the ends: 4ug3-2 +<<< Too many missing values in the middle: 4v0m-4 +<<< Too many missing values in the ends: 4ux9-2 +<<< Too many missing values in the ends: 4w2o-4 +<<< Unknown: 4v7n-17 +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert + for (chain,) in pdb_entry.get_chains(): +ValueError: too many values to unpack (expected 1) + +<<< Unknown: 4v4c-11 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in the ends: 4wci-2 +<<< Too many missing values in the middle: 4w9l-4 +<<< Too many missing values in total: 4uvb-1 +<<< Sequence is too short: 4wb7-1 +<<< Too many missing values in the middle: 4x34-2 +<<< Too many missing values in total: 4wyb-11 +<<< Sequence is too short: 4xaw-1 +<<< Too many missing values in the middle: 4y4s-1 +<<< Sequence is too short: 4xi9-2 +<<< Too many missing values in the middle: 4yo1-1 +<<< Too many missing values in total: 4ycw-1 +<<< Too many missing values in the middle: 4zb7-2 +<<< Too many missing values in the ends: 4zhy-1 +<<< Too many missing values in total: 4zh8-1 +<<< Too many missing values in the middle: 4zyn-1 +<<< Too many missing values in the middle: 5aeo-2 +<<< Too many missing values in total: 5afp-1 +<<< Sequence is too short: 5ajp-1 +<<< Sequence is too short: 5boq-1 +<<< Sequence is too short: 5b62-1 +<<< Sequence is too short: 5b4w-3 +<<< Too many missing values in the middle: 5c03-2 +<<< Too many missing values in the middle: 5c26-1 +<<< Too many missing values in total: 5c6d-1 +<<< Sequence is too short: 5c7f-1 +<<< Too many missing values in the middle: 5cil-1 +<<< Too many missing values in the middle: 5dg6-2 +<<< Too many missing values in the middle: 5da9-1 +<<< Too many missing values in the ends: 5dpw-3 +<<< Too many missing values in the middle: 5dxf-1 +<<< Sequence is too short: 5eoj-1 +<<< Too many missing values in the middle: 5eqj-1 +<<< Too many missing values in total: 5et0-2 +<<< Too many missing values in the middle: 5f7c-5 +<<< Unnatural amino acids found: 5fcd-1 +<<< Too many missing values in the middle: 5fei-1 +<<< Too many missing values in total: 5fvd-2 +<<< Too many missing values in total: 5ghw-1 +<<< Too many missing values in the middle: 5gyd-2 +<<< Too many missing values in the middle: 5h5c-2 +<<< Too many missing values in total: 5h2w-1 +<<< Too many missing values in the middle: 5hmk-1 +<<< Sequence is too short: 5hoy-3 +<<< Too many missing values in the middle: 5hzr-1 +<<< Too many missing values in the middle: 5hyr-1 +<<< Too many missing values in the ends: 5i9b-1 +<<< Too many missing values in total: 5ic3-2 +<<< Sequence is too short: 5iaw-1 +<<< Sequence is too short: 5id1-1 +<<< Too many missing values in total: 5iq9-2 +<<< Too many missing values in total: 5iue-4 +<<< Sequence is too short: 5jhc-12 +<<< Sequence is too short: 5jwe-4 +<<< Too many missing values in the middle: 5k1a-2 +<<< Too many missing values in the middle: 5k5w-1 +<<< Too many missing values in the middle: 5kam-1 +<<< Too many missing values in the middle: 5keu-3 +<<< Too many missing values in the middle: 5ksy-1 +<<< Sequence is too short: 5krc-1 +<<< Too many missing values in the ends: 5low-1 +<<< Too many missing values in the middle: 5lsb-2 +<<< Sequence is too short: 5lw1-2 +<<< Too many missing values in total: 5m9n-1 +<<< Sequence is too short: 5m5t-1 +<<< Too many missing values in the middle: 5mio-3 +<<< Too many missing values in the ends: 5mk3-1 +<<< Too many missing values in total: 5msu-3 +<<< Too many missing values in total: 5mu0-7 +<<< Too many missing values in the middle: 5n4g-1 +<<< Too many missing values in total: 5mzl-1 +<<< Too many missing values in the middle: 5mvi-3 +<<< Too many missing values in the middle: 5nb2-1 +<<< Sequence is too short: 5n75-1 +<<< Sequence is too short: 5nht-1 +<<< Too many missing values in total: 5npw-4 +<<< Too many missing values in the middle: 5nyp-1 +<<< Too many missing values in the middle: 5o3s-1 +<<< Sequence is too short: 5o9v-2 +<<< Sequence is too short: 5otg-1 +<<< Sequence is too short: 5ov3-1 +<<< Too many missing values in total: 5oo6-8 +<<< Sequence is too short: 5q0n-1 +<<< Sequence is too short: 5q1h-1 +<<< Too many missing values in total: 5oqr-2 +<<< Sequence is too short: 5qu2-2 +<<< Too many missing values in the middle: 5r4c-1 +<<< Sequence is too short: 5r1r-11 +<<< Too many missing values in the middle: 5s4m-1 +<<< Too many missing values in the middle: 5s60-1 +<<< Too many missing values in the middle: 5sbd-1 +<<< Too many missing values in the middle: 5sus-2 +<<< Sequence is too short: 5t1m-2 +<<< Too many missing values in the middle: 5tqb-1 +<<< Too many missing values in the middle: 5tgc-2 +<<< Too many missing values in the middle: 5u4u-1 +<<< Sequence is too short: 5u98-2 +<<< Sequence is too short: 5um1-1 +<<< Too many missing values in the middle: 5un6-3 +<<< Sequence is too short: 5vab-1 +<<< Sequence is too short: 5v5l-2 +<<< Too many missing values in the middle: 5veb-1 +<<< Sequence is too short: 5vko-1 +<<< Too many missing values in the middle: 5vvv-1 +<<< Too many missing values in the middle: 5w4j-1 +<<< Too many missing values in the middle: 5wa3-1 +<<< Sequence is too short: 5wes-1 +<<< Sequence is too short: 5wha-4 +<<< Sequence is too short: 5wlj-2 +<<< Sequence is too short: 5wqd-2 +<<< Sequence is too short: 5wsh-1 +<<< Sequence is too short: 5wtt-1 +<<< Too many missing values in total: 5wzz-1 +<<< Too many missing values in total: 5wby-1 +<<< Too many missing values in the ends: 5xor-1 +<<< Too many missing values in the middle: 5xjo-1 +<<< Too many missing values in the middle: 5xq0-1 +<<< Too many missing values in total: 5y9w-1 +<<< Too many missing values in the ends: 5yir-1 +<<< Too many missing values in the middle: 5yj1-16 +<<< Too many missing values in the middle: 5ynl-1 +<<< Too many missing values in the middle: 5ytu-4 +<<< Too many missing values in the middle: 5yrp-1 +<<< Too many missing values in total: 5zgc-4 +<<< Unexpected atoms (D): 5zn0-1 +<<< Too many missing values in the middle: 5zia-6 +<<< Too many missing values in the ends: 5zx3-1 +<<< Too many missing values in the middle: 6a2m-1 +<<< Too many missing values in the middle: 6a9e-1 +<<< Too many missing values in the middle: 6ae1-2 +<<< Too many missing values in the middle: 6akj-1 +<<< Too many missing values in total: 6ahc-1 +<<< Sequence is too short: 6ati-1 +<<< Sequence is too short: 6azk-2 +<<< Too many missing values in the middle: 6b4c-3 +<<< Too many missing values in total: 6bd1-1 +<<< Too many missing values in total: 6bqt-3 +<<< Too many missing values in total: 6bvv-1 +<<< Too many missing values in the middle: 6brp-2 +<<< Too many missing values in the middle: 6c4u-5 +<<< Too many missing values in total: 6c1r-1 +<<< Too many missing values in the middle: 6cj5-1 +<<< Sequence is too short: 6cqq-2 +<<< Too many missing values in the middle: 6dft-2 +<<< Sequence is too short: 6di8-1 +<<< Too many missing values in the middle: 6dr6-2 +<<< Too many missing values in the ends: 6cxs-1 +<<< Sequence is too short: 6e3i-1 +<<< Sequence is too short: 6eex-1 +<<< Sequence is too short: 6em6-1 +<<< Sequence is too short: 6f14-1 +<<< Too many missing values in the ends: 6fmp-1 +<<< Too many missing values in the middle: 6fy3-1 +<<< Sequence is too short: 6gfx-1 +<<< Sequence is too short: 6gh1-3 +<<< Sequence is too short: 6h41-1 +<<< Too many missing values in the middle: 6how-1 +<<< Too many missing values in the middle: 6hzl-1 +<<< Too many missing values in the middle: 6i8b-2 +<<< Some chains in the PDB do not appear in the fasta file: 6i48-1 +<<< Too many missing values in the middle: 6ima-2 +<<< Sequence is too short: 6iwh-1 +<<< Sequence is too short: 6j2f-2 +<<< Too many missing values in the middle: 6hx8-1 +<<< Too many missing values in total: 6jzc-2 +<<< Too many missing values in the middle: 6k9g-2 +<<< Too many missing values in the middle: 6kmt-4 +<<< Too many missing values in the middle: 6kny-1 +<<< Sequence is too short: 6kwk-1 +<<< Sequence is too short: 6l96-1 +<<< Too many missing values in total: 6ldw-2 +<<< Sequence is too short: 6lf8-1 +<<< Sequence is too short: 6lry-1 +<<< Too many missing values in the middle: 6lto-1 +<<< Too many missing values in the ends: 6lx0-1 +<<< Too many missing values in total: 6m90-1 +<<< Sequence is too short: 6mjc-1 +<<< Too many missing values in the middle: 6mnn-1 +<<< Sequence is too short: 6mm5-1 +<<< Too many missing values in the ends: 6mwl-1 +<<< Too many missing values in the ends: 6n2b-2 +<<< Sequence is too short: 6nca-15 +<<< Too many missing values in the middle: 6nb0-1 +<<< Too many missing values in the middle: 6no1-1 +<<< Too many missing values in the middle: 6ntc-1 +<<< Too many missing values in the middle: 6nxf-1 +<<< Too many missing values in total: 6o3y-1 +<<< Too many missing values in the ends: 6nv2-1 +<<< Too many missing values in the middle: 6p6z-1 +<<< Too many missing values in the middle: 6pdm-1 +<<< Sequence is too short: 6php-1 +<<< Sequence is too short: 6pau-1 +<<< Too many missing values in total: 6psd-7 +<<< Unexpected atoms (D): 6ptp-1 +<<< Too many missing values in the middle: 6puo-1 +<<< Too many missing values in the middle: 6pc4-1 +<<< Too many missing values in total: 6qsz-6 +<<< Sequence is too short: 6r51-3 +<<< Too many missing values in total: 6qh5-1 +<<< Too many missing values in the middle: 6riy-1 +<<< Too many missing values in the middle: 6qpg-2 +<<< Too many missing values in the middle: 6roy-1 +<<< Too many missing values in total: 6s33-1 +<<< Too many missing values in the middle: 6rrp-1 +<<< Too many missing values in the ends: 6sb4-2 +<<< Some chains in the PDB do not appear in the fasta file: 6slb-1 +<<< Some chains in the PDB do not appear in the fasta file: 6sqv-3 +<<< Some chains in the PDB do not appear in the fasta file: 6t2o-1 +<<< Some chains in the PDB do not appear in the fasta file: 6syo-1 +<<< Some chains in the PDB do not appear in the fasta file: 6t9r-2 +<<< Some chains in the PDB do not appear in the fasta file: 6tkr-2 +<<< Too many missing values in total: 6tou-1 +<<< Sequence is too short: 6tno-1 +<<< Sequence is too short: 6tq0-8 +<<< Sequence is too short: 6u39-5 +<<< Too many missing values in total: 6uun-1 +<<< Too many missing values in the middle: 6uz8-1 +<<< Sequence is too short: 6vbx-2 +<<< Incorrect alignment: 6vmk-10 +<<< Too many missing values in the middle: 6vwa-1 +<<< Unknown: 6wat-7 +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert + for (chain,) in pdb_entry.get_chains(): +ValueError: too many values to unpack (expected 1) + +<<< Too many missing values in the middle: 6wcc-1 +<<< Too many missing values in total: 6wmf-1 +<<< Sequence is too short: 6wg0-1 +<<< Incorrect alignment: 6x0a-5 +<<< Too many missing values in total: 6x1s-3 +<<< Too many missing values in total: 6wsl-1 +<<< Sequence is too short: 6xqa-1 +<<< Sequence is too short: 6xxs-1 +<<< Too many missing values in total: 6xoh-1 +<<< Too many missing values in total: 6y73-4 +<<< Some chains in the PDB do not appear in the fasta file: 6yab-4 +<<< Incorrect alignment: 6yn1-4 +<<< Too many missing values in the middle: 6yyf-2 +<<< Sequence is too short: 6yx2-2 +<<< Too many missing values in the ends: 6z11-1 +<<< Unnatural amino acids found: 6z3r-1 +<<< Sequence is too short: 6z7y-1 +<<< Some chains in the PDB do not appear in the fasta file: 6zed-1 +<<< Some chains in the PDB do not appear in the fasta file: 6za8-1 +<<< Unnatural amino acids found: 6zfp-1 +<<< Some chains in the PDB do not appear in the fasta file: 6ziv-7 +<<< Sequence is too short: 6zmp-1 +<<< Unknown: 6zk7-1 +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert + for (chain,) in pdb_entry.get_chains(): +ValueError: too many values to unpack (expected 1) + +<<< Some chains in the PDB do not appear in the fasta file: 6zrz-2 +<<< Sequence is too short: 7a2y-1 +<<< Some chains in the PDB do not appear in the fasta file: 6zzh-1 +<<< Too many missing values in the middle: 7a6r-1 +<<< Too many missing values in total: 7acv-2 +<<< Some chains in the PDB do not appear in the fasta file: 7aae-1 +<<< Some chains in the PDB do not appear in the fasta file: 7aly-2 +<<< Too many missing values in the middle: 7b16-1 +<<< Too many missing values in the middle: 7ba3-1 +<<< Some chains in the PDB do not appear in the fasta file: 7bec-1 +<<< Too many missing values in the middle: 7azg-1 +<<< Too many missing values in the middle: 7bii-2 +<<< Too many missing values in total: 7bqz-4 +<<< Too many missing values in total: 7cfd-5 +<<< Too many missing values in the middle: 7cmv-1 +<<< Sequence is too short: 7co3-1 +<<< Too many missing values in the middle: 7dai-1 +<<< Too many missing values in total: 7dfl-1 +<<< Too many missing values in the middle: 7dmx-3 +<<< Too many missing values in total: 7dtc-1 +<<< Too many missing values in the ends: 7duv-2 +<<< Too many missing values in the middle: 7cda-1 +<<< Too many missing values in the middle: 7ce8-1 +<<< Sequence is too short: 7e5e-1 +<<< Too many missing values in the middle: 7eg1-1 +<<< Sequence is too short: 7eu2-1 +<<< Too many missing values in the middle: 7ezk-1 +<<< Sequence is too short: 7f7g-2 +<<< Too many missing values in total: 7f60-1 +<<< Too many missing values in the middle: 7fit-1 +<<< Unknown: 7f8i-2 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in total: 7jne-1 +<<< Too many missing values in the middle: 7k7t-1 +<<< Too many missing values in the middle: 7kgv-2 +<<< Too many missing values in the ends: 7l2h-1 +<<< Sequence is too short: 7lfd-1 +<<< Too many missing values in total: 7lkq-1 +<<< Too many missing values in the middle: 7mby-1 +<<< Too many missing values in the middle: 7mxo-1 +<<< Too many missing values in total: 7n27-4 +<<< Too many missing values in total: 7n5e-1 +<<< Too many missing values in the middle: 7ni8-1 +<<< Too many missing values in the ends: 7nku-1 +<<< Sequence is too short: 7nmd-1 +<<< Too many missing values in the middle: 7n3n-1 +<<< Some chains in the PDB do not appear in the fasta file: 7nzb-3 +<<< Too many missing values in the middle: 7o49-5 +<<< Too many missing values in the middle: 7o0m-1 +<<< Too many missing values in the middle: 7o2h-1 +<<< Too many missing values in the ends: 7ohi-1 +<<< Too many missing values in the middle: 7ov9-1 +<<< Too many missing values in total: 7ort-1 +<<< Some chains in the PDB do not appear in the fasta file: 7ozb-2 +<<< Some chains in the PDB do not appear in the fasta file: 7p1y-2 +<<< Too many missing values in the ends: 7p9d-1 +<<< Unknown: 7oxp-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Some chains in the PDB do not appear in the fasta file: 7pj4-1 +<<< Some chains in the PDB do not appear in the fasta file: 7plr-2 +<<< Too many missing values in total: 7ppl-1 +<<< Sequence is too short: 7pul-1 +<<< Sequence is too short: 7q51-1 +<<< Unknown: 7pkc-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Unknown: 7q8k-2 +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert + for (chain,) in pdb_entry.get_chains(): +ValueError: too many values to unpack (expected 1) + +<<< Some chains in the PDB do not appear in the fasta file: 7qel-2 +<<< Sequence is too short: 7rnc-1 +<<< Too many missing values in total: 7rm0-2 +<<< Too many missing values in the middle: 7s1x-1 +<<< Sequence is too short: 7s8s-1 +<<< Too many missing values in total: 7sy4-1 +<<< Too many missing values in the middle: 7st3-8 +<<< Unknown: 7su4-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in the ends: 7t8w-1 +<<< Incorrect alignment: 7tl7-3 +<<< Unexpected atoms (D1): 7tur-1 +<<< Too many missing values in total: 7tyh-1 +<<< Too many missing values in total: 7un6-1 +<<< Too many missing values in total: 7v0u-1 +<<< Too many missing values in total: 7v47-1 +<<< Too many missing values in total: 7vab-1 +<<< Too many missing values in total: 7vec-12 +<<< Too many missing values in the middle: 7vpn-1 +<<< Too many missing values in the middle: 7vr7-1 +<<< Too many missing values in the ends: 7w08-2 +<<< Too many missing values in the middle: 7w6k-1 +<<< Too many missing values in total: 7wu5-1 +<<< Too many missing values in the middle: 7x9y-1 +<<< Too many missing values in the middle: 7xjh-1 +<<< Too many missing values in total: 7xp5-1 +<<< Too many missing values in the middle: 7xr6-1 +<<< Too many missing values in the middle: 7xms-1 +<<< Too many missing values in the middle: 7xuq-1 +<<< Too many missing values in the middle: 7xwk-1 +<<< Too many missing values in the middle: 7ye8-2 +<<< Some chains in the PDB do not appear in the fasta file: 7zaj-1 +<<< Some chains in the PDB do not appear in the fasta file: 7zfn-1 +<<< Too many missing values in total: 7zir-1 +<<< Too many missing values in total: 7zh7-1 +<<< Too many missing values in total: 7wjy-1 +<<< Too many missing values in total: 8ag3-1 +<<< Too many missing values in the middle: 8bfe-8 +<<< Too many missing values in total: 8b8x-1 +<<< Unnatural amino acids found: 8dds-1 +<<< Sequence is too short: 8d5j-1 +<<< Too many missing values in total: 8dph-1 +<<< Unnatural amino acids found: 8eiq-1 +<<< Too many missing values in the ends: 8ev1-1 +<<< Sequence is too short: 8gch-2 +<<< Too many missing values in the middle: 8h15-1 +<<< Too many missing values in total: 1hha-2 +<<< Too many missing values in total: 1jma-1 +<<< Sequence is too short: 1nam-1 +<<< Too many missing values in the middle: 8eaq-1 +<<< Sequence is too short: 2aij-1 +<<< Too many missing values in total: 1r9n-2 +<<< Too many missing values in the middle: 3muu-1 +<<< Unknown: 3l4v-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Sequence is too short: 3n96-1 +<<< Sequence is too short: 3wv0-1 +<<< Too many missing values in the middle: 4cp0-1 +<<< Too many missing values in the ends: 4eef-1 +<<< Too many missing values in the middle: 3cu7-3 +<<< Too many missing values in total: 4wjv-1 +<<< Sequence is too short: 4um9-1 +<<< Sequence is too short: 5dk0-1 +<<< Too many missing values in the middle: 4z64-1 +<<< Sequence is too short: 5ab0-2 +<<< Sequence is too short: 5j51-2 +<<< Too many missing values in the middle: 5l1x-2 +<<< Too many missing values in the middle: 5hz0-1 +<<< Too many missing values in the middle: 5m5e-1 +<<< Too many missing values in the middle: 6huo-1 +<<< Unknown: 6m8p-9 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in the middle: 6pm2-1 +<<< Too many missing values in the middle: 6uz0-1 +<<< Unnatural amino acids found: 6wth-1 +<<< Some chains in the PDB do not appear in the fasta file: 6yut-2 +<<< Some chains in the PDB do not appear in the fasta file: 7b6v-2 +<<< Too many missing values in the middle: 7my3-1 +<<< Some chains in the PDB do not appear in the fasta file: 7oa1-1 +<<< Too many missing values in the middle: 7lab-1 +<<< Too many missing values in the middle: 7r16-1 +<<< Too many missing values in total: 7ddh-1 +<<< Unknown: 7pbd-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Too many missing values in the middle: 7sy3-1 +<<< Unknown: 8a47-1 +Traceback (most recent call last): + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc + return self._engine.get_loc(casted_key) + File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc + File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item + File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item +KeyError: 'unique_residue_number' + +The above exception was the direct cause of the following exception: + +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert + crd_arr = pdb_entry.get_coordinates_array(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array + unique_numbers = self.get_unique_residue_numbers(chain) + File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers + return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ + indexer = self.columns.get_loc(key) + File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc + raise KeyError(key) from err +KeyError: 'unique_residue_number' + +<<< Sequence is too short: 1a4w-1 +<<< Too many missing values in the middle: 1aat-1 +<<< Sequence is too short: 1avf-2 +<<< Sequence is too short: 1b07-1 +<<< Sequence is too short: 1awr-4 +<<< Sequence is too short: 1b18-1 +<<< Sequence is too short: 1b40-1 +<<< Sequence is too short: 1bph-3 +<<< Too many missing values in total: 1c4u-1 +<<< Too many missing values in the middle: 1com-3 +<<< Unnatural amino acids found: 1deq-2 +<<< Sequence is too short: 1ddh-1 +<<< Sequence is too short: 1dkd-1 +<<< Sequence is too short: 1dph-4 +<<< Too many missing values in the ends: 7v82-1 +<<< Too many missing values in the middle: 1e69-1 +<<< Sequence is too short: 1ee5-1 +<<< Sequence is too short: 1ejh-2 +<<< Too many missing values in the middle: 1es8-1 +<<< Too many missing values in the middle: 1ex4-10 +<<< Too many missing values in total: 1ffs-2 +<<< Too many missing values in the middle: 1ft4-1 +<<< Sequence is too short: 1gy3-1 +<<< Sequence is too short: 1h25-1 +<<< Too many missing values in the middle: 1huu-4 +<<< Sequence is too short: 1jd5-1 +<<< Sequence is too short: 1jq9-1 +<<< Too many missing values in total: 1k8k-1 +<<< Sequence is too short: 1kyc-1 +<<< Too many missing values in the ends: 1ktr-1 +<<< Too many missing values in the middle: 1l8w-5 +<<< Too many missing values in the middle: 1miu-1 +<<< Sequence is too short: 1mk9-4 +<<< Too many missing values in the middle: 1mul-2 +<<< Too many missing values in total: 1n0y-1 +<<< Too many missing values in total: 1n4s-1 +<<< Sequence is too short: 1o2g-1 +<<< Too many missing values in total: 1o6p-1 +<<< Too many missing values in the middle: 1ofp-2 +<<< Too many missing values in total: 1p16-1 +<<< Too many missing values in total: 1p8d-2 +<<< Sequence is too short: 1pj8-1 +<<< Sequence is too short: 1pu9-1 +<<< Too many missing values in the ends: 1q4q-5 +<<< Sequence is too short: 1q24-1 +<<< Sequence is too short: 1q94-2 +<<< Unnatural amino acids found: 1r4l-1 +<<< Sequence is too short: 1rbh-2 +<<< Too many missing values in the middle: 1rea-1 +<<< Sequence is too short: 1r5w-2 +<<< Too many missing values in total: 1s4v-2 +<<< Sequence is too short: 1sfq-1 +<<< Sequence is too short: 1s7t-2 +<<< Too many missing values in the middle: 1so8-1 +<<< Too many missing values in total: 1sps-2 +<<< Too many missing values in the middle: 1t2v-6 +<<< Sequence is too short: 1tom-1 +<<< Too many missing values in total: 1tno-5 +<<< Sequence is too short: 1u00-1 +<<< Too many missing values in the ends: 1u9g-3 +<<< Sequence is too short: 1uef-2 +<<< Sequence is too short: 1unz-1 +<<< Too many missing values in total: 1vr9-2 +<<< Too many missing values in total: 1w7r-4 +<<< Too many missing values in total: 1w6i-2 +<<< Too many missing values in total: 1wu1-1 +<<< Sequence is too short: 1x2r-1 +<<< Sequence is too short: 1xda-3 +<<< Sequence is too short: 1x7b-1 +<<< Unnatural amino acids found: 1xgf-1 +<<< Too many missing values in the middle: 1y01-1 +<<< Too many missing values in the middle: 1y14-2 +<<< Too many missing values in total: 1y80-1 +<<< Too many missing values in the middle: 1yb2-1 +<<< Sequence is too short: 1zmk-2 +<<< Sequence is too short: 1zni-6 +<<< Too many missing values in the middle: 1zw0-4 +<<< Too many missing values in total: 2ahl-1 +<<< Too many missing values in the ends: 1zzd-1 +<<< Too many missing values in the ends: 2b1h-1 +<<< Too many missing values in the middle: 2bbo-1 +<<< Too many missing values in total: 2bd8-1 +<<< Too many missing values in total: 2aka-1 +<<< Sequence is too short: 2bxt-1 +<<< Sequence is too short: 2c8w-1 +<<< Too many missing values in the middle: 2cn5-1 +<<< Too many missing values in the middle: 2b5l-1 +<<< Sequence is too short: 2clv-2 +<<< Too many missing values in the middle: 2cy7-1 +<<< Too many missing values in the middle: 2eq5-2 +<<< Too many missing values in the middle: 2f1m-1 +<<< Sequence is too short: 2fx8-4 +<<< Too many missing values in the middle: 2g2q-3 +<<< Too many missing values in the ends: 2g1t-1 +<<< Too many missing values in the middle: 2gjv-1 +<<< Too many missing values in the middle: 2gmt-1 +<<< Sequence is too short: 2gt9-2 +<<< Too many missing values in the middle: 2h3r-2 +<<< Too many missing values in the ends: 2h4y-1 +<<< Sequence is too short: 2h96-3 +<<< Sequence is too short: 2hjk-1 +<<< Unnatural amino acids found: 2hpe-1 +<<< Too many missing values in the middle: 2hwy-2 +<<< Too many missing values in the middle: 2ic9-2 +<<< Unnatural amino acids found: 2iv2-1 +<<< Too many missing values in the middle: 2nye-4 +<<< Too many missing values in the middle: 2op1-1 +<<< Too many missing values in the middle: 2oq1-1 +<<< Too many missing values in the ends: 2p32-2 +<<< Too many missing values in the middle: 2p22-5 +<<< Sequence is too short: 2p54-1 +<<< Too many missing values in total: 2pxj-2 +<<< Sequence is too short: 2q3y-1 +<<< Too many missing values in the middle: 2q97-1 +<<< Too many missing values in the middle: 2qoc-1 +<<< Sequence is too short: 2qgw-1 +<<< Too many missing values in the middle: 2qv8-2 +<<< Too many missing values in the middle: 2qsx-1 +<<< Too many missing values in the middle: 2qym-1 +<<< Too many missing values in total: 2r3c-1 +<<< Too many missing values in the middle: 2vo9-3 +<<< Too many missing values in the middle: 2vgi-1 +<<< Unknown: 2vvj-1 +Traceback (most recent call last): + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f + protein_dict = filter_and_convert( + File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert + for (chain,) in pdb_entry.get_chains(): +ValueError: too many values to unpack (expected 1) + +<<< Too many missing values in the ends: 2w0p-1 +<<< Too many missing values in the middle: 2waz-1 +<<< Sequence is too short: 2wpm-1 +<<< Too many missing values in total: 2wtt-4 +<<< Sequence is too short: 2x4o-1 +<<< Too many missing values in total: 2xi1-2 +<<< Too many missing values in the middle: 2xk6-1 +<<< Too many missing values in the middle: 2yqy-4 +<<< Too many missing values in the ends: 2z5s-3 +<<< Too many missing values in the middle: 2z9h-1 +<<< Sequence is too short: 2zhw-1 +<<< Sequence is too short: 2zla-1 +<<< Sequence is too short: 3a0m-1 +<<< Too many missing values in the ends: 3a1m-1 +<<< Too many missing values in the middle: 3b0s-1 +<<< Sequence is too short: 3b23-1 +<<< Too many missing values in total: 3b71-3 +<<< Too many missing values in the middle: 3b80-1 +<<< Too many missing values in the middle: 3bby-1 +<<< Too many missing values in the middle: 3bd1-2 +<<< Too many missing values in the middle: 3bku-3 +<<< Sequence is too short: 3bw9-1 +<<< Too many missing values in total: 3bzy-3 +<<< Too many missing values in total: 3c57-1 +<<< Sequence is too short: 3cay-2 +<<< Sequence is too short: 3c9n-1 +<<< Too many missing values in the middle: 3cjr-1 +<<< Too many missing values in the middle: 3d8f-2 +<<< Too many missing values in the middle: 3db4-1 +<<< Too many missing values in total: 3dnj-1 +<<< Too many missing values in the ends: 3dom-1 +<<< Too many missing values in the middle: 3dpo-3 +<<< Too many missing values in the middle: 3ddr-2 +<<< Sequence is too short: 3e1r-1 +<<< Sequence is too short: 3dx6-1 +<<< Too many missing values in the middle: 3e9c-1 +<<< Sequence is too short: 3e8d-1 +<<< Too many missing values in the middle: 3efk-1 diff --git a/proteinflow/data/utils.py b/proteinflow/data/utils.py index 5637fb0..45df353 100644 --- a/proteinflow/data/utils.py +++ b/proteinflow/data/utils.py @@ -3,6 +3,7 @@ from copy import deepcopy import numpy as np +import pandas as pd from biopandas.mmcif import PandasMmcif from biotite.structure.geometry import angle, dihedral, distance from einops import rearrange @@ -12,6 +13,7 @@ ATOM_MAP_3, ATOM_MAP_4, ATOM_MAP_14, + D3TO1, GLOBAL_PAD_CHAR, ONE_TO_THREE_LETTER_MAP, ) @@ -451,6 +453,7 @@ def read_mmcif(self, path: str): "Cartn_x": "x_coord", "Cartn_y": "y_coord", "Cartn_z": "z_coord", + "pdbx_PDB_ins_code": "insertion", }, axis=1, inplace=True, @@ -460,7 +463,20 @@ def read_mmcif(self, path: str): def amino3to1(self): """Return a dataframe with the amino acid names converted to one letter codes.""" - df = super().amino3to1() + tmp = self.df["ATOM"] + cmp = "placeholder" + indices = [] + + residue_number_insertion = tmp["residue_number"].astype(str) + tmp["insertion"] + + for num, ind in zip(residue_number_insertion, np.arange(tmp.shape[0])): + if num != cmp: + indices.append(ind) + cmp = num + + transl = tmp.iloc[indices]["auth_comp_id"].map(D3TO1).fillna("?") + + df = pd.concat((tmp.iloc[indices]["auth_asym_id"], transl), axis=1) df.columns = ["chain_id", "residue_name"] return df diff --git a/proteinflow/processing/__init__.py b/proteinflow/processing/__init__.py index 7a55d6e..b8f8c37 100644 --- a/proteinflow/processing/__init__.py +++ b/proteinflow/processing/__init__.py @@ -219,10 +219,13 @@ def process_f( for id in error_ids: with open(LOG_FILE, "a") as f: f.write(f"<<< Could not download PDB/mmCIF file: {id} \n") - # paths = [(os.path.join(TMP_FOLDER, "6tkb.pdb"), "H_L_nan")] + # paths = [("data/6m8p-4.cif.gz", "data/6m8p.fasta")] print("Filter and process...") _ = p_map(lambda x: process_f(x, force=force, sabdab=sabdab), paths) - # _ = [process_f(x, force=force, sabdab=sabdab, show_error=True) for x in tqdm(paths)] + # _ = [ + # process_f(x, force=force, sabdab=sabdab, show_error=True) + # for x in tqdm(paths) + # ] except Exception as e: _raise_rcsbsearch(e) From 3935714a777d19397ac36b17650df48832b115ab Mon Sep 17 00:00:00 2001 From: Liza Kozlova Date: Wed, 12 Jul 2023 16:03:23 +0000 Subject: [PATCH 5/7] fix: add a check for inconsistencies and fix long chain names bug --- proteinflow/data/__init__.py | 3 +++ proteinflow/processing/__init__.py | 4 ++-- 2 files changed, 5 insertions(+), 2 deletions(-) diff --git a/proteinflow/data/__init__.py b/proteinflow/data/__init__.py index 25ddfe3..07dcf78 100644 --- a/proteinflow/data/__init__.py +++ b/proteinflow/data/__init__.py @@ -1326,6 +1326,9 @@ def arr_index(row): informative_mask = indices != -1 res_indices = np.where(mask == 1)[0] unique_numbers = self.get_unique_residue_numbers(chain) + pdb_seq = self._pdb_sequence(chain) + if len(unique_numbers) != len(pdb_seq): + raise PDBError("Inconsistencies in the biopandas dataframe") replace_dict = {x: y for x, y in zip(unique_numbers, res_indices)} chain_crd.loc[:, "unique_residue_number"] = chain_crd[ "unique_residue_number" diff --git a/proteinflow/processing/__init__.py b/proteinflow/processing/__init__.py index b8f8c37..04e48db 100644 --- a/proteinflow/processing/__init__.py +++ b/proteinflow/processing/__init__.py @@ -219,7 +219,7 @@ def process_f( for id in error_ids: with open(LOG_FILE, "a") as f: f.write(f"<<< Could not download PDB/mmCIF file: {id} \n") - # paths = [("data/6m8p-4.cif.gz", "data/6m8p.fasta")] + # paths = [("data/2c2m-1.pdb.gz", "data/2c2m.fasta")] print("Filter and process...") _ = p_map(lambda x: process_f(x, force=force, sabdab=sabdab), paths) # _ = [ @@ -306,7 +306,7 @@ def filter_and_convert( if pdb_entry.has_unnatural_amino_acids(): raise PDBError("Unnatural amino acids found") - for (chain,) in pdb_entry.get_chains(): + for chain in pdb_entry.get_chains(): pdb_dict[chain] = {} chain_crd = pdb_entry.get_sequence_df(chain) fasta_seq = fasta_dict[chain] From aa6f379954867faf2edfe1728adbaac410733479 Mon Sep 17 00:00:00 2001 From: Liza Kozlova Date: Wed, 12 Jul 2023 16:06:41 +0000 Subject: [PATCH 6/7] chore: remove log file --- log_Tmp.txt | 14878 -------------------------------------------------- 1 file changed, 14878 deletions(-) delete mode 100644 log_Tmp.txt diff --git a/log_Tmp.txt b/log_Tmp.txt deleted file mode 100644 index 754361b..0000000 --- a/log_Tmp.txt +++ /dev/null @@ -1,14878 +0,0 @@ -07/12/2023, 10:11:42 - -tag: 20230102_v141 - min_length: 30 - max_length: 10000 - resolution_thr: 3.5 - missing_ends_thr: 0.3 - missing_middle_thr: 0.1 - filter_methods: True - remove_redundancies: False - sabdab: False - pdb_snapshot: 20230102 - load_live: False - -07/12/2023, 10:12:45 - -tag: 20230102_v141 - min_length: 30 - max_length: 10000 - resolution_thr: 3.5 - missing_ends_thr: 0.3 - missing_middle_thr: 0.1 - filter_methods: True - remove_redundancies: False - sabdab: False - pdb_snapshot: 20230102 - max_chains: 10 - load_live: False - -<<< Could not download PDB/mmCIF file: 7QCN-1 -<<< Could not download PDB/mmCIF file: 7TRO-1 -<<< Could not download PDB/mmCIF file: 7VWB-1 -<<< Could not download PDB/mmCIF file: 7X36-1 -<<< Could not download PDB/mmCIF file: 7XSW-1 -<<< Could not download PDB/mmCIF file: 7YCL-2 -<<< Could not download PDB/mmCIF file: 8A17-1 -<<< Could not download PDB/mmCIF file: 8CEM-2 -<<< Could not download PDB/mmCIF file: 8DL2-4 -<<< Could not download PDB/mmCIF file: 8EDK-1 -<<< Could not download PDB/mmCIF file: 8FHD-1 -<<< Could not download PDB/mmCIF file: 8G3T-1 -<<< Could not download PDB/mmCIF file: 8IDP-1 -<<< Could not download PDB/mmCIF file: 7E4A-1 -<<< Could not download PDB/mmCIF file: 7FRX-2 -<<< Could not download PDB/mmCIF file: 7FSJ-4 -<<< Could not download PDB/mmCIF file: 7FSW-2 -<<< Could not download PDB/mmCIF file: 7FT8-4 -<<< Could not download PDB/mmCIF file: 7FVL-1 -<<< Could not download PDB/mmCIF file: 7FWY-1 -<<< Could not download PDB/mmCIF file: 7FY8-4 -<<< Could not download PDB/mmCIF file: 7FZD-1 -<<< Could not download PDB/mmCIF file: 7G09-1 -<<< Could not download PDB/mmCIF file: 7G1L-1 -<<< Could not download PDB/mmCIF file: 7G8W-1 -<<< Could not download PDB/mmCIF file: 7Q4X-1 -<<< Could not download PDB/mmCIF file: 7QLI-1 -<<< Could not download PDB/mmCIF file: 7QO2-1 -<<< Could not download PDB/mmCIF file: 7QUI-1 -<<< Could not download PDB/mmCIF file: 7QW4-5 -<<< Could not download PDB/mmCIF file: 7QXF-1 -<<< Could not download PDB/mmCIF file: 7R2Y-1 -<<< Could not download PDB/mmCIF file: 7RYK-2 -<<< Could not download PDB/mmCIF file: 7SCV-1 -<<< Could not download PDB/mmCIF file: 7SVI-1 -<<< Could not download PDB/mmCIF file: 7T4U-1 -<<< Could not download PDB/mmCIF file: 7T8S-3 -<<< Could not download PDB/mmCIF file: 7TL6-1 -<<< Could not download PDB/mmCIF file: 7TSW-5 -<<< Could not download PDB/mmCIF file: 7TUN-2 -<<< Could not download PDB/mmCIF file: 7TZY-1 -<<< Could not download PDB/mmCIF file: 7U6H-3 -<<< Could not download PDB/mmCIF file: 7ULQ-4 -<<< Could not download PDB/mmCIF file: 7UR2-6 -<<< Could not download PDB/mmCIF file: 7UVD-1 -<<< Could not download PDB/mmCIF file: 7VA1-4 -<<< Could not download PDB/mmCIF file: 7WNJ-1 -<<< Could not download PDB/mmCIF file: 7WU1-1 -<<< Could not download PDB/mmCIF file: 7WW0-1 -<<< Could not download PDB/mmCIF file: 7X4J-1 -<<< Could not download PDB/mmCIF file: 7XBN-1 -<<< Could not download PDB/mmCIF file: 7XHW-2 -<<< Could not download PDB/mmCIF file: 7XJB-4 -<<< Could not download PDB/mmCIF file: 7XMK-1 -<<< Could not download PDB/mmCIF file: 7XR1-1 -<<< Could not download PDB/mmCIF file: 7XUK-1 -<<< Could not download PDB/mmCIF file: 7XXT-1 -<<< Could not download PDB/mmCIF file: 7Y0X-2 -<<< Could not download PDB/mmCIF file: 7Y3V-1 -<<< Could not download PDB/mmCIF file: 7Y5M-1 -<<< Could not download PDB/mmCIF file: 7Y8B-1 -<<< Could not download PDB/mmCIF file: 7Y9M-1 -<<< Could not download PDB/mmCIF file: 7YC4-4 -<<< Could not download PDB/mmCIF file: 7YE6-1 -<<< Could not download PDB/mmCIF file: 7YHC-3 -<<< Could not download PDB/mmCIF file: 7YJI-1 -<<< Could not download PDB/mmCIF file: 7YME-2 -<<< Could not download PDB/mmCIF file: 7YOU-1 -<<< Could not download PDB/mmCIF file: 7YYF-2 -<<< Could not download PDB/mmCIF file: 7YZW-2 -<<< Could not download PDB/mmCIF file: 7Z1F-1 -<<< Could not download PDB/mmCIF file: 7ZAC-1 -<<< Could not download PDB/mmCIF file: 7ZBH-1 -<<< Could not download PDB/mmCIF file: 7ZDN-2 -<<< Could not download PDB/mmCIF file: 7ZK7-1 -<<< Could not download PDB/mmCIF file: 7ZLT-1 -<<< Could not download PDB/mmCIF file: 7ZOB-1 -<<< Could not download PDB/mmCIF file: 7ZTL-1 -<<< Could not download PDB/mmCIF file: 7ZV6-2 -<<< Could not download PDB/mmCIF file: 7ZX4-1 -<<< Could not download PDB/mmCIF file: 8A3X-2 -<<< Could not download PDB/mmCIF file: 8A70-1 -<<< Could not download PDB/mmCIF file: 8A8Z-2 -<<< Could not download PDB/mmCIF file: 8AAP-1 -<<< Could not download PDB/mmCIF file: 8AD5-1 -<<< Could not download PDB/mmCIF file: 8AET-1 -<<< Could not download PDB/mmCIF file: 8AFU-2 -<<< Could not download PDB/mmCIF file: 8AHT-4 -<<< Could not download PDB/mmCIF file: 8AQ8-3 -<<< Could not download PDB/mmCIF file: 8AST-1 -<<< Could not download PDB/mmCIF file: 8AUZ-1 -<<< Could not download PDB/mmCIF file: 8AWY-1 -<<< Could not download PDB/mmCIF file: 8AZB-1 -<<< Could not download PDB/mmCIF file: 8B2C-1 -<<< Could not download PDB/mmCIF file: 8B5Y-1 -<<< Could not download PDB/mmCIF file: 8B8U-2 -<<< Could not download PDB/mmCIF file: 8BAU-1 -<<< Could not download PDB/mmCIF file: 8BC9-1 -<<< Could not download PDB/mmCIF file: 8BDM-2 -<<< Could not download PDB/mmCIF file: 8BHD-4 -<<< Could not download PDB/mmCIF file: 8BJ4-1 -<<< Could not download PDB/mmCIF file: 8BNS-1 -<<< Could not download PDB/mmCIF file: 8BQR-1 -<<< Could not download PDB/mmCIF file: 8BYK-1 -<<< Could not download PDB/mmCIF file: 8C3E-1 -<<< Could not download PDB/mmCIF file: 8C77-2 -<<< Could not download PDB/mmCIF file: 8CC0-1 -<<< Could not download PDB/mmCIF file: 8CEV-1 -<<< Could not download PDB/mmCIF file: 8CJH-1 -<<< Could not download PDB/mmCIF file: 8CTX-1 -<<< Could not download PDB/mmCIF file: 8D34-1 -<<< Could not download PDB/mmCIF file: 8DBO-1 -<<< Could not download PDB/mmCIF file: 8DF0-1 -<<< Could not download PDB/mmCIF file: 8DGX-2 -<<< Could not download PDB/mmCIF file: 8DJ1-1 -<<< Could not download PDB/mmCIF file: 8DKG-1 -<<< Could not download PDB/mmCIF file: 8DMN-1 -<<< Could not download PDB/mmCIF file: 8DSF-2 -<<< Could not download PDB/mmCIF file: 8DWL-1 -<<< Could not download PDB/mmCIF file: 8E5M-1 -<<< Could not download PDB/mmCIF file: 8E7Y-1 -<<< Could not download PDB/mmCIF file: 8EAA-1 -<<< Could not download PDB/mmCIF file: 8ECW-1 -<<< Could not download PDB/mmCIF file: 8EIN-2 -<<< Could not download PDB/mmCIF file: 8EM1-2 -<<< Could not download PDB/mmCIF file: 8EPJ-2 -<<< Could not download PDB/mmCIF file: 8EUT-1 -<<< Could not download PDB/mmCIF file: 8EZW-4 -<<< Could not download PDB/mmCIF file: 8F2P-1 -<<< Could not download PDB/mmCIF file: 8F8P-1 -<<< Could not download PDB/mmCIF file: 8FBT-1 -<<< Could not download PDB/mmCIF file: 8FF6-2 -<<< Could not download PDB/mmCIF file: 8FIC-1 -<<< Could not download PDB/mmCIF file: 8FM2-4 -<<< Could not download PDB/mmCIF file: 8FO4-2 -<<< Could not download PDB/mmCIF file: 8FTG-1 -<<< Could not download PDB/mmCIF file: 8FX7-2 -<<< Could not download PDB/mmCIF file: 8G1N-2 -<<< Could not download PDB/mmCIF file: 8G62-2 -<<< Could not download PDB/mmCIF file: 8GBZ-1 -<<< Could not download PDB/mmCIF file: 8GHG-1 -<<< Could not download PDB/mmCIF file: 8GMI-4 -<<< Could not download PDB/mmCIF file: 8GQW-1 -<<< Could not download PDB/mmCIF file: 8GSX-1 -<<< Could not download PDB/mmCIF file: 8GVC-1 -<<< Could not download PDB/mmCIF file: 8H0T-1 -<<< Could not download PDB/mmCIF file: 8H9E-1 -<<< Could not download PDB/mmCIF file: 8HE1-1 -<<< Could not download PDB/mmCIF file: 8HJ3-1 -<<< Could not download PDB/mmCIF file: 8HN7-2 -<<< Could not download PDB/mmCIF file: 8HY5-1 -<<< Could not download PDB/mmCIF file: 8I2E-1 -<<< Could not download PDB/mmCIF file: 8I71-1 -<<< Could not download PDB/mmCIF file: 8IIT-1 -<<< Could not download PDB/mmCIF file: 8IUL-1 -<<< Could not download PDB/mmCIF file: 8JCU-1 -<<< Could not download PDB/mmCIF file: 8OG7-1 -<<< Could not download PDB/mmCIF file: 8OQD-1 -<<< Could not download PDB/mmCIF file: 8OWL-1 -<<< Could not download PDB/mmCIF file: 8PA9-1 -<<< Could not download PDB/mmCIF file: 8SBX-1 -<<< Could not download PDB/mmCIF file: 8SKK-1 -<<< Could not download PDB/mmCIF file: 8T1D-1 -<<< Could not download PDB/mmCIF file: 7QCU-1 -<<< Could not download PDB/mmCIF file: 7QVK-1 -<<< Could not download PDB/mmCIF file: 7UED-1 -<<< Could not download PDB/mmCIF file: 7VZT-1 -<<< Could not download PDB/mmCIF file: 7XSW-2 -<<< Could not download PDB/mmCIF file: 7YFH-1 -<<< Could not download PDB/mmCIF file: 8A17-2 -<<< Could not download PDB/mmCIF file: 8CGO-1 -<<< Could not download PDB/mmCIF file: 8EGW-1 -<<< Could not download PDB/mmCIF file: 8FIA-1 -<<< Could not download PDB/mmCIF file: 8G3U-1 -<<< Could not download PDB/mmCIF file: 8IDP-2 -<<< Could not download PDB/mmCIF file: 7E4B-1 -<<< Could not download PDB/mmCIF file: 7FRY-1 -<<< Could not download PDB/mmCIF file: 7FSK-1 -<<< Could not download PDB/mmCIF file: 7FSW-3 -<<< Could not download PDB/mmCIF file: 7FT9-1 -<<< Could not download PDB/mmCIF file: 7FVM-1 -<<< Could not download PDB/mmCIF file: 7FWZ-1 -<<< Could not download PDB/mmCIF file: 7FY8-5 -<<< Could not download PDB/mmCIF file: 7FZE-1 -<<< Could not download PDB/mmCIF file: 7G0A-1 -<<< Could not download PDB/mmCIF file: 7G1M-1 -<<< Could not download PDB/mmCIF file: 7G8X-1 -<<< Could not download PDB/mmCIF file: 7PVP-1 -<<< Could not download PDB/mmCIF file: 7QO2-2 -<<< Could not download PDB/mmCIF file: 7QPK-1 -<<< Could not download PDB/mmCIF file: 7QW4-6 -<<< Could not download PDB/mmCIF file: 7QXF-2 -<<< Could not download PDB/mmCIF file: 7R0F-1 -<<< Could not download PDB/mmCIF file: 7R2Z-1 -<<< Could not download PDB/mmCIF file: 7R4A-1 -<<< Could not download PDB/mmCIF file: 7SVJ-1 -<<< Could not download PDB/mmCIF file: 7T4U-2 -<<< Could not download PDB/mmCIF file: 7T7U-1 -<<< Could not download PDB/mmCIF file: 7T8S-4 -<<< Could not download PDB/mmCIF file: 7TAZ-1 -<<< Could not download PDB/mmCIF file: 7TC7-1 -<<< Could not download PDB/mmCIF file: 7TL6-2 -<<< Could not download PDB/mmCIF file: 7TSW-6 -<<< Could not download PDB/mmCIF file: 7TUO-1 -<<< Could not download PDB/mmCIF file: 7U1R-1 -<<< Could not download PDB/mmCIF file: 7U6H-4 -<<< Could not download PDB/mmCIF file: 7UCW-1 -<<< Could not download PDB/mmCIF file: 7ULQ-5 -<<< Could not download PDB/mmCIF file: 7UR2-7 -<<< Could not download PDB/mmCIF file: 7UXB-1 -<<< Could not download PDB/mmCIF file: 7WNK-1 -<<< Could not download PDB/mmCIF file: 7WW2-1 -<<< Could not download PDB/mmCIF file: 7WY1-1 -<<< Could not download PDB/mmCIF file: 7X4L-1 -<<< Could not download PDB/mmCIF file: 7XBN-2 -<<< Could not download PDB/mmCIF file: 7XDU-1 -<<< Could not download PDB/mmCIF file: 7XGL-1 -<<< Could not download PDB/mmCIF file: 7XHW-3 -<<< Could not download PDB/mmCIF file: 7XJC-1 -<<< Could not download PDB/mmCIF file: 7XP0-1 -<<< Could not download PDB/mmCIF file: 7XUL-1 -<<< Could not download PDB/mmCIF file: 7XXU-1 -<<< Could not download PDB/mmCIF file: 7Y0Y-1 -<<< Could not download PDB/mmCIF file: 7Y3V-2 -<<< Could not download PDB/mmCIF file: 7Y5P-1 -<<< Could not download PDB/mmCIF file: 7Y8B-2 -<<< Could not download PDB/mmCIF file: 7Y9M-2 -<<< Could not download PDB/mmCIF file: 7YC5-1 -<<< Could not download PDB/mmCIF file: 7YHC-4 -<<< Could not download PDB/mmCIF file: 7YJK-1 -<<< Could not download PDB/mmCIF file: 7YMG-1 -<<< Could not download PDB/mmCIF file: 7YOV-1 -<<< Could not download PDB/mmCIF file: 7YYF-3 -<<< Could not download PDB/mmCIF file: 7YZW-3 -<<< Could not download PDB/mmCIF file: 7Z1F-2 -<<< Could not download PDB/mmCIF file: 7ZK8-1 -<<< Could not download PDB/mmCIF file: 7ZLT-2 -<<< Could not download PDB/mmCIF file: 7ZOB-2 -<<< Could not download PDB/mmCIF file: 7ZPW-1 -<<< Could not download PDB/mmCIF file: 7ZS0-1 -<<< Could not download PDB/mmCIF file: 7ZTM-1 -<<< Could not download PDB/mmCIF file: 7ZV6-3 -<<< Could not download PDB/mmCIF file: 7ZX4-2 -<<< Could not download PDB/mmCIF file: 7ZYP-1 -<<< Could not download PDB/mmCIF file: 8A0Z-1 -<<< Could not download PDB/mmCIF file: 8A2C-1 -<<< Could not download PDB/mmCIF file: 8A44-1 -<<< Could not download PDB/mmCIF file: 8A5B-1 -<<< Could not download PDB/mmCIF file: 8A73-1 -<<< Could not download PDB/mmCIF file: 8A90-1 -<<< Could not download PDB/mmCIF file: 8AAQ-1 -<<< Could not download PDB/mmCIF file: 8AD5-2 -<<< Could not download PDB/mmCIF file: 8AEU-1 -<<< Could not download PDB/mmCIF file: 8AFV-1 -<<< Could not download PDB/mmCIF file: 8AQ8-4 -<<< Could not download PDB/mmCIF file: 8AST-2 -<<< Could not download PDB/mmCIF file: 8AV0-1 -<<< Could not download PDB/mmCIF file: 8AWZ-1 -<<< Could not download PDB/mmCIF file: 8AZR-1 -<<< Could not download PDB/mmCIF file: 8B2D-1 -<<< Could not download PDB/mmCIF file: 8B5Y-2 -<<< Could not download PDB/mmCIF file: 8B8V-1 -<<< Could not download PDB/mmCIF file: 8BAW-1 -<<< Could not download PDB/mmCIF file: 8BCA-1 -<<< Could not download PDB/mmCIF file: 8BDM-3 -<<< Could not download PDB/mmCIF file: 8BHD-5 -<<< Could not download PDB/mmCIF file: 8BJ4-2 -<<< Could not download PDB/mmCIF file: 8BNS-2 -<<< Could not download PDB/mmCIF file: 8BQT-1 -<<< Could not download PDB/mmCIF file: 8BYL-1 -<<< Could not download PDB/mmCIF file: 8C3F-1 -<<< Could not download PDB/mmCIF file: 8C77-3 -<<< Could not download PDB/mmCIF file: 8CC1-1 -<<< Could not download PDB/mmCIF file: 8CEV-2 -<<< Could not download PDB/mmCIF file: 8CJH-2 -<<< Could not download PDB/mmCIF file: 8CTX-2 -<<< Could not download PDB/mmCIF file: 8CW2-1 -<<< Could not download PDB/mmCIF file: 8D35-1 -<<< Could not download PDB/mmCIF file: 8D84-1 -<<< Could not download PDB/mmCIF file: 8DAE-1 -<<< Could not download PDB/mmCIF file: 8DBX-1 -<<< Could not download PDB/mmCIF file: 8DDP-1 -<<< Could not download PDB/mmCIF file: 8DF0-2 -<<< Could not download PDB/mmCIF file: 8DJ3-1 -<<< Could not download PDB/mmCIF file: 8DKH-1 -<<< Could not download PDB/mmCIF file: 8DMP-1 -<<< Could not download PDB/mmCIF file: 8DRK-1 -<<< Could not download PDB/mmCIF file: 8DSF-3 -<<< Could not download PDB/mmCIF file: 8DWL-2 -<<< Could not download PDB/mmCIF file: 8E27-1 -<<< Could not download PDB/mmCIF file: 8E5M-2 -<<< Could not download PDB/mmCIF file: 8E7Z-1 -<<< Could not download PDB/mmCIF file: 8EAB-1 -<<< Could not download PDB/mmCIF file: 8ECW-2 -<<< Could not download PDB/mmCIF file: 8EM2-1 -<<< Could not download PDB/mmCIF file: 8EPO-1 -<<< Could not download PDB/mmCIF file: 8EUT-2 -<<< Could not download PDB/mmCIF file: 8EXM-1 -<<< Could not download PDB/mmCIF file: 8EZW-5 -<<< Could not download PDB/mmCIF file: 8F2Q-1 -<<< Could not download PDB/mmCIF file: 8F8Q-1 -<<< Could not download PDB/mmCIF file: 8FBT-2 -<<< Could not download PDB/mmCIF file: 8FF6-3 -<<< Could not download PDB/mmCIF file: 8FID-1 -<<< Could not download PDB/mmCIF file: 8FM3-1 -<<< Could not download PDB/mmCIF file: 8FO5-1 -<<< Could not download PDB/mmCIF file: 8FTG-2 -<<< Could not download PDB/mmCIF file: 8FX9-1 -<<< Could not download PDB/mmCIF file: 8G1Y-1 -<<< Could not download PDB/mmCIF file: 8G62-3 -<<< Could not download PDB/mmCIF file: 8GC0-1 -<<< Could not download PDB/mmCIF file: 8GHT-1 -<<< Could not download PDB/mmCIF file: 8GMK-1 -<<< Could not download PDB/mmCIF file: 8GQW-2 -<<< Could not download PDB/mmCIF file: 8GSY-1 -<<< Could not download PDB/mmCIF file: 8GVE-1 -<<< Could not download PDB/mmCIF file: 8H9G-1 -<<< Could not download PDB/mmCIF file: 8HE2-1 -<<< Could not download PDB/mmCIF file: 8HJ5-1 -<<< Could not download PDB/mmCIF file: 8HNR-1 -<<< Could not download PDB/mmCIF file: 8HYE-1 -<<< Could not download PDB/mmCIF file: 8I2E-2 -<<< Could not download PDB/mmCIF file: 8I7L-1 -<<< Could not download PDB/mmCIF file: 8ID3-1 -<<< Could not download PDB/mmCIF file: 8IJ9-1 -<<< Could not download PDB/mmCIF file: 8IUM-1 -<<< Could not download PDB/mmCIF file: 8JCV-1 -<<< Could not download PDB/mmCIF file: 8OG8-1 -<<< Could not download PDB/mmCIF file: 8OQE-1 -<<< Could not download PDB/mmCIF file: 8OXU-1 -<<< Could not download PDB/mmCIF file: 8PAF-1 -<<< Could not download PDB/mmCIF file: 8SBX-2 -<<< Could not download PDB/mmCIF file: 8SL0-1 -<<< Could not download PDB/mmCIF file: 8T1E-1 -<<< Could not download PDB/mmCIF file: 7UWV-1 -<<< Could not download PDB/mmCIF file: 7XTJ-1 -<<< Could not download PDB/mmCIF file: 7YFI-1 -<<< Could not download PDB/mmCIF file: 8A17-3 -<<< Could not download PDB/mmCIF file: 8EIZ-1 -<<< Could not download PDB/mmCIF file: 8FIS-1 -<<< Could not download PDB/mmCIF file: 8G3W-1 -<<< Could not download PDB/mmCIF file: 8IDQ-1 -<<< Could not download PDB/mmCIF file: 7E4C-1 -<<< Could not download PDB/mmCIF file: 7FRY-2 -<<< Could not download PDB/mmCIF file: 7FSK-2 -<<< Could not download PDB/mmCIF file: 7FSW-4 -<<< Could not download PDB/mmCIF file: 7FT9-2 -<<< Could not download PDB/mmCIF file: 7FVN-1 -<<< Could not download PDB/mmCIF file: 7FX0-1 -<<< Could not download PDB/mmCIF file: 7FY8-6 -<<< Could not download PDB/mmCIF file: 7FZF-1 -<<< Could not download PDB/mmCIF file: 7G0B-1 -<<< Could not download PDB/mmCIF file: 7G1N-1 -<<< Could not download PDB/mmCIF file: 7G8Y-1 -<<< Could not download PDB/mmCIF file: 7QLK-1 -<<< Could not download 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file: 7XGM-1 -<<< Could not download PDB/mmCIF file: 7XHW-4 -<<< Could not download PDB/mmCIF file: 7XJD-1 -<<< Could not download PDB/mmCIF file: 7XMP-1 -<<< Could not download PDB/mmCIF file: 7XP1-1 -<<< Could not download PDB/mmCIF file: 7XSY-1 -<<< Could not download PDB/mmCIF file: 7XUN-1 -<<< Could not download PDB/mmCIF file: 7XXW-1 -<<< Could not download PDB/mmCIF file: 7Y0Z-1 -<<< Could not download PDB/mmCIF file: 7Y3V-3 -<<< Could not download PDB/mmCIF file: 7Y5R-1 -<<< Could not download PDB/mmCIF file: 7Y8C-1 -<<< Could not download PDB/mmCIF file: 7YC6-1 -<<< Could not download PDB/mmCIF file: 7YHC-5 -<<< Could not download PDB/mmCIF file: 7YJM-1 -<<< Could not download PDB/mmCIF file: 7YMG-2 -<<< Could not download PDB/mmCIF file: 7YOW-1 -<<< Could not download PDB/mmCIF file: 7YYF-4 -<<< Could not download PDB/mmCIF file: 7YZW-4 -<<< Could not download PDB/mmCIF file: 7Z1G-1 -<<< Could not download PDB/mmCIF file: 7Z6P-1 -<<< Could not download PDB/mmCIF file: 7Z8O-1 -<<< Could not download PDB/mmCIF file: 7ZDR-1 -<<< Could not download PDB/mmCIF file: 7ZKA-1 -<<< Could not download PDB/mmCIF file: 7ZLT-3 -<<< Could not download PDB/mmCIF file: 7ZOB-3 -<<< Could not download PDB/mmCIF file: 7ZPW-2 -<<< Could not download PDB/mmCIF file: 7ZS1-1 -<<< Could not download PDB/mmCIF file: 7ZX5-1 -<<< Could not download PDB/mmCIF file: 7ZYQ-1 -<<< Could not download PDB/mmCIF file: 8A0Z-2 -<<< Could not download PDB/mmCIF file: 8A2C-2 -<<< Could not download PDB/mmCIF file: 8A45-1 -<<< Could not download PDB/mmCIF file: 8A5B-2 -<<< Could not download PDB/mmCIF file: 8A74-1 -<<< Could not download PDB/mmCIF file: 8A91-1 -<<< Could not download PDB/mmCIF file: 8AEW-1 -<<< Could not download PDB/mmCIF file: 8AFV-2 -<<< Could not download PDB/mmCIF file: 8AHW-1 -<<< Could not download PDB/mmCIF file: 8ASU-1 -<<< Could not download PDB/mmCIF file: 8AV1-1 -<<< Could not download PDB/mmCIF file: 8AX0-1 -<<< Could not download PDB/mmCIF file: 8B2I-1 -<<< Could 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not download PDB/mmCIF file: 7FSX-1 -<<< Could not download PDB/mmCIF file: 7FT9-3 -<<< Could not download PDB/mmCIF file: 7FVO-1 -<<< Could not download PDB/mmCIF file: 7FX1-1 -<<< Could not download PDB/mmCIF file: 7FY8-7 -<<< Could not download PDB/mmCIF file: 7FZG-1 -<<< Could not download PDB/mmCIF file: 7G0C-1 -<<< Could not download PDB/mmCIF file: 7G1O-1 -<<< Could not download PDB/mmCIF file: 7G8Z-1 -<<< Could not download PDB/mmCIF file: 7Q6B-1 -<<< Could not download PDB/mmCIF file: 7QLL-1 -<<< Could not download PDB/mmCIF file: 7QPL-1 -<<< Could not download PDB/mmCIF file: 7QR2-1 -<<< Could not download PDB/mmCIF file: 7QW4-8 -<<< Could not download PDB/mmCIF file: 7R31-1 -<<< Could not download PDB/mmCIF file: 7R4B-2 -<<< Could not download PDB/mmCIF file: 7T4V-2 -<<< Could not download PDB/mmCIF file: 7T69-1 -<<< Could not download PDB/mmCIF file: 7U01-1 -<<< Could not download PDB/mmCIF file: 7U6I-2 -<<< Could not download PDB/mmCIF file: 7UJD-1 -<<< Could not download 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not download PDB/mmCIF file: 8DFC-1 -<<< Could not download PDB/mmCIF file: 8DKJ-1 -<<< Could not download PDB/mmCIF file: 8DMP-3 -<<< Could not download PDB/mmCIF file: 8DOD-1 -<<< Could not download PDB/mmCIF file: 8DSG-1 -<<< Could not download PDB/mmCIF file: 8DWZ-1 -<<< Could not download PDB/mmCIF file: 8E0W-1 -<<< Could not download PDB/mmCIF file: 8E2E-1 -<<< Could not download PDB/mmCIF file: 8E5N-2 -<<< Could not download PDB/mmCIF file: 8E80-1 -<<< Could not download PDB/mmCIF file: 8ED4-1 -<<< Could not download PDB/mmCIF file: 8EG5-2 -<<< Could not download PDB/mmCIF file: 8EIP-2 -<<< Could not download PDB/mmCIF file: 8EPR-1 -<<< Could not download PDB/mmCIF file: 8EUX-2 -<<< Could not download PDB/mmCIF file: 8EZX-1 -<<< Could not download PDB/mmCIF file: 8F3A-1 -<<< Could not download PDB/mmCIF file: 8F5S-2 -<<< Could not download PDB/mmCIF file: 8F8S-1 -<<< Could not download PDB/mmCIF file: 8FBU-2 -<<< Could not download PDB/mmCIF file: 8FF6-5 -<<< Could not download 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file: 8IVJ-1 -<<< Could not download PDB/mmCIF file: 8JCX-1 -<<< Could not download PDB/mmCIF file: 8OGA-1 -<<< Could not download PDB/mmCIF file: 8OQG-1 -<<< Could not download PDB/mmCIF file: 8OYF-1 -<<< Could not download PDB/mmCIF file: 8SBY-2 -<<< Could not download PDB/mmCIF file: 8SLD-1 -<<< Could not download PDB/mmCIF file: 8T1O-1 -<<< Could not download PDB/mmCIF file: 7UWW-2 -<<< Could not download PDB/mmCIF file: 7WGV-1 -<<< Could not download PDB/mmCIF file: 7X96-1 -<<< Could not download PDB/mmCIF file: 7ZE9-1 -<<< Could not download PDB/mmCIF file: 8A1F-1 -<<< Could not download PDB/mmCIF file: 8CIM-1 -<<< Could not download PDB/mmCIF file: 8D56-1 -<<< Could not download PDB/mmCIF file: 8EM4-1 -<<< Could not download PDB/mmCIF file: 8FJC-2 -<<< Could not download PDB/mmCIF file: 8G3Y-1 -<<< Could not download PDB/mmCIF file: 8IDS-1 -<<< Could not download PDB/mmCIF file: 4E6D-2 -<<< Could not download PDB/mmCIF file: 7FRZ-2 -<<< Could not download PDB/mmCIF file: 7FSK-4 -<<< Could not download PDB/mmCIF file: 7FSX-2 -<<< Could not download PDB/mmCIF file: 7FT9-4 -<<< Could not download PDB/mmCIF file: 7FVP-1 -<<< Could not download PDB/mmCIF file: 7FX2-1 -<<< Could not download PDB/mmCIF file: 7FY8-8 -<<< Could not download PDB/mmCIF file: 7FZH-1 -<<< Could not download PDB/mmCIF file: 7G0E-1 -<<< Could not download PDB/mmCIF file: 7G1P-1 -<<< Could not download PDB/mmCIF file: 7G90-1 -<<< Could not download PDB/mmCIF file: 7QPM-1 -<<< Could not download PDB/mmCIF file: 7QUM-1 -<<< Could not download PDB/mmCIF file: 7QW4-9 -<<< Could not download PDB/mmCIF file: 7R1X-1 -<<< Could not download PDB/mmCIF file: 7R32-1 -<<< Could not download PDB/mmCIF file: 7S0O-1 -<<< Could not download PDB/mmCIF file: 7T4W-1 -<<< Could not download PDB/mmCIF file: 7T6A-1 -<<< Could not download PDB/mmCIF file: 7TH0-1 -<<< Could not download PDB/mmCIF file: 7TWD-1 -<<< Could not download PDB/mmCIF file: 7U01-2 -<<< Could not download PDB/mmCIF file: 7U6J-1 -<<< Could not download PDB/mmCIF file: 7UKX-1 -<<< Could not download PDB/mmCIF file: 7ULQ-8 -<<< Could not download PDB/mmCIF file: 7UPA-1 -<<< Could not download PDB/mmCIF file: 7UR7-1 -<<< Could not download PDB/mmCIF file: 7UVH-1 -<<< Could not download PDB/mmCIF file: 7VUB-1 -<<< Could not download PDB/mmCIF file: 7W34-1 -<<< Could not download PDB/mmCIF file: 7WM1-1 -<<< Could not download PDB/mmCIF file: 7WNL-2 -<<< Could not download PDB/mmCIF file: 7WPW-1 -<<< Could not download PDB/mmCIF file: 7WRN-1 -<<< Could not download PDB/mmCIF file: 7WY2-2 -<<< Could not download PDB/mmCIF file: 7X28-1 -<<< Could not download PDB/mmCIF file: 7X6C-1 -<<< Could not download PDB/mmCIF file: 7XDW-1 -<<< Could not download PDB/mmCIF file: 7XHX-2 -<<< Could not download PDB/mmCIF file: 7XT2-1 -<<< Could not download PDB/mmCIF file: 7XXZ-1 -<<< Could not download PDB/mmCIF file: 7Y10-2 -<<< Could not download PDB/mmCIF file: 7Y8F-1 -<<< Could not download PDB/mmCIF file: 7Y9P-1 -<<< Could not download 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-<<< Could not download PDB/mmCIF file: 8DMP-4 -<<< Could not download PDB/mmCIF file: 8DOE-1 -<<< Could not download PDB/mmCIF file: 8DRP-1 -<<< Could not download PDB/mmCIF file: 8DSG-2 -<<< Could not download PDB/mmCIF file: 8DX0-1 -<<< Could not download PDB/mmCIF file: 8E0W-2 -<<< Could not download PDB/mmCIF file: 8E2F-1 -<<< Could not download PDB/mmCIF file: 8E5S-1 -<<< Could not download PDB/mmCIF file: 8E81-1 -<<< Could not download PDB/mmCIF file: 8ED4-2 -<<< Could not download PDB/mmCIF file: 8EG6-1 -<<< Could not download PDB/mmCIF file: 8EPR-2 -<<< Could not download PDB/mmCIF file: 8F00-1 -<<< Could not download PDB/mmCIF file: 8F3B-1 -<<< Could not download PDB/mmCIF file: 8F5T-1 -<<< Could not download PDB/mmCIF file: 8F8T-1 -<<< Could not download PDB/mmCIF file: 8FBY-1 -<<< Could not download PDB/mmCIF file: 8FF6-6 -<<< Could not download PDB/mmCIF file: 8FIU-1 -<<< Could not download PDB/mmCIF file: 8FM3-4 -<<< Could not download PDB/mmCIF file: 8FOA-1 -<<< Could 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not download PDB/mmCIF file: 7YHC-8 -<<< Could not download PDB/mmCIF file: 7YJP-1 -<<< Could not download PDB/mmCIF file: 7YMK-2 -<<< Could not download PDB/mmCIF file: 7YS6-1 -<<< Could not download PDB/mmCIF file: 7YXF-3 -<<< Could not download PDB/mmCIF file: 7YYJ-2 -<<< Could not download PDB/mmCIF file: 7Z5L-1 -<<< Could not download PDB/mmCIF file: 7Z8R-1 -<<< Could not download PDB/mmCIF file: 7ZAK-1 -<<< Could not download PDB/mmCIF file: 7ZDU-1 -<<< Could not download PDB/mmCIF file: 7ZS4-1 -<<< Could not download PDB/mmCIF file: 7ZTV-1 -<<< Could not download PDB/mmCIF file: 7ZXA-1 -<<< Could not download PDB/mmCIF file: 8A14-1 -<<< Could not download PDB/mmCIF file: 8A2E-2 -<<< Could not download PDB/mmCIF file: 8A7A-1 -<<< Could not download PDB/mmCIF file: 8A96-1 -<<< Could not download PDB/mmCIF file: 8AB1-1 -<<< Could not download PDB/mmCIF file: 8AD9-2 -<<< Could not download PDB/mmCIF file: 8AI9-1 -<<< Could not download PDB/mmCIF file: 8AV9-1 -<<< Could not download 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file: 8DKL-1 -<<< Could not download PDB/mmCIF file: 8DMP-5 -<<< Could not download PDB/mmCIF file: 8DSG-3 -<<< Could not download PDB/mmCIF file: 8DX0-2 -<<< Could not download PDB/mmCIF file: 8E2G-1 -<<< Could not download PDB/mmCIF file: 8E5U-1 -<<< Could not download PDB/mmCIF file: 8EG6-2 -<<< Could not download PDB/mmCIF file: 8EIR-1 -<<< Could not download PDB/mmCIF file: 8F01-1 -<<< Could not download PDB/mmCIF file: 8F5T-2 -<<< Could not download PDB/mmCIF file: 8FBY-2 -<<< Could not download PDB/mmCIF file: 8FF7-1 -<<< Could not download PDB/mmCIF file: 8FIU-2 -<<< Could not download PDB/mmCIF file: 8FM4-1 -<<< Could not download PDB/mmCIF file: 8FOB-1 -<<< Could not download PDB/mmCIF file: 8FU7-1 -<<< Could not download PDB/mmCIF file: 8FXQ-1 -<<< Could not download PDB/mmCIF file: 8G25-2 -<<< Could not download PDB/mmCIF file: 8G67-2 -<<< Could not download PDB/mmCIF file: 8GI5-1 -<<< Could not download PDB/mmCIF file: 8GMN-4 -<<< Could not download PDB/mmCIF file: 8GR1-2 -<<< Could not download PDB/mmCIF file: 8GT3-1 -<<< Could not download PDB/mmCIF file: 8HEF-1 -<<< Could not download PDB/mmCIF file: 8HJE-1 -<<< Could not download PDB/mmCIF file: 8HO1-1 -<<< Could not download PDB/mmCIF file: 8HZ1-1 -<<< Could not download PDB/mmCIF file: 8I2L-1 -<<< Could not download PDB/mmCIF file: 8I8J-2 -<<< Could not download PDB/mmCIF file: 8ID9-1 -<<< Could not download PDB/mmCIF file: 8IK1-2 -<<< Could not download PDB/mmCIF file: 8IVK-1 -<<< Could not download PDB/mmCIF file: 8JCZ-1 -<<< Could not download PDB/mmCIF file: 8OGC-1 -<<< Could not download PDB/mmCIF file: 8OR2-1 -<<< Could not download PDB/mmCIF file: 8OZA-1 -<<< Could not download PDB/mmCIF file: 8PDH-1 -<<< Could not download PDB/mmCIF file: 8SBZ-2 -<<< Could not download PDB/mmCIF file: 8SLG-1 -<<< Could not download PDB/mmCIF file: 8T55-2 -<<< Could not download PDB/mmCIF file: 7UYI-1 -<<< Could not download PDB/mmCIF file: 7WH6-1 -<<< Could not download PDB/mmCIF file: 7YL6-2 -<<< Could not download PDB/mmCIF file: 7ZE9-3 -<<< Could not download PDB/mmCIF file: 8AXI-2 -<<< Could not download PDB/mmCIF file: 8D74-1 -<<< Could not download PDB/mmCIF file: 8EMR-1 -<<< Could not download PDB/mmCIF file: 8FK4-1 -<<< Could not download PDB/mmCIF file: 8GB5-1 -<<< Could not download PDB/mmCIF file: 8IF3-1 -<<< Could not download PDB/mmCIF file: 7FS0-2 -<<< Could not download PDB/mmCIF file: 7FSL-2 -<<< Could not download PDB/mmCIF file: 7FSX-4 -<<< Could not download PDB/mmCIF file: 7FTA-2 -<<< Could not download PDB/mmCIF file: 7FVR-1 -<<< Could not download PDB/mmCIF file: 7FX4-1 -<<< Could not download PDB/mmCIF file: 7FYA-1 -<<< Could not download PDB/mmCIF file: 7FZJ-1 -<<< Could not download PDB/mmCIF file: 7G0G-1 -<<< Could not download PDB/mmCIF file: 7G1R-1 -<<< Could not download PDB/mmCIF file: 7G92-1 -<<< Could not download PDB/mmCIF file: 7Q58-1 -<<< Could not download PDB/mmCIF file: 7QEM-1 -<<< Could not download PDB/mmCIF file: 7QOB-2 -<<< Could not download 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-<<< Could not download PDB/mmCIF file: 7ZQ1-1 -<<< Could not download PDB/mmCIF file: 7ZTW-1 -<<< Could not download PDB/mmCIF file: 7ZXA-2 -<<< Could not download PDB/mmCIF file: 7ZYT-1 -<<< Could not download PDB/mmCIF file: 8A14-2 -<<< Could not download PDB/mmCIF file: 8A2F-1 -<<< Could not download PDB/mmCIF file: 8A7B-1 -<<< Could not download PDB/mmCIF file: 8A97-1 -<<< Could not download PDB/mmCIF file: 8ADA-1 -<<< Could not download PDB/mmCIF file: 8AIB-1 -<<< Could not download PDB/mmCIF file: 8ATD-1 -<<< Could not download PDB/mmCIF file: 8AVA-1 -<<< Could not download PDB/mmCIF file: 8AZY-1 -<<< Could not download PDB/mmCIF file: 8B6A-2 -<<< Could not download PDB/mmCIF file: 8BCF-1 -<<< Could not download PDB/mmCIF file: 8BDN-4 -<<< Could not download PDB/mmCIF file: 8BFF-1 -<<< Could not download PDB/mmCIF file: 8BI2-1 -<<< Could not download PDB/mmCIF file: 8BJG-1 -<<< Could not download PDB/mmCIF file: 8BNX-2 -<<< Could not download PDB/mmCIF file: 8BRB-1 -<<< Could not download PDB/mmCIF file: 8BTU-1 -<<< Could not download PDB/mmCIF file: 8BYW-2 -<<< Could not download PDB/mmCIF file: 8C3L-2 -<<< Could not download PDB/mmCIF file: 8C7E-2 -<<< Could not download PDB/mmCIF file: 8CCE-1 -<<< Could not download PDB/mmCIF file: 8CFF-2 -<<< Could not download PDB/mmCIF file: 8CKS-1 -<<< Could not download PDB/mmCIF file: 8CZG-4 -<<< Could not download PDB/mmCIF file: 8D8A-1 -<<< Could not download PDB/mmCIF file: 8DJC-2 -<<< Could not download PDB/mmCIF file: 8DMP-6 -<<< Could not download PDB/mmCIF file: 8DSG-4 -<<< Could not download PDB/mmCIF file: 8DX2-1 -<<< Could not download PDB/mmCIF file: 8E2H-1 -<<< Could not download PDB/mmCIF file: 8E5U-2 -<<< Could not download PDB/mmCIF file: 8EAZ-1 -<<< Could not download PDB/mmCIF file: 8EGD-1 -<<< Could not download PDB/mmCIF file: 8EIS-1 -<<< Could not download PDB/mmCIF file: 8F03-1 -<<< Could not download PDB/mmCIF file: 8F3F-1 -<<< Could not download PDB/mmCIF file: 8F5U-1 -<<< Could not download 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file: 8IK3-1 -<<< Could not download PDB/mmCIF file: 8IVR-1 -<<< Could not download PDB/mmCIF file: 8JD0-1 -<<< Could not download PDB/mmCIF file: 8OGH-1 -<<< Could not download PDB/mmCIF file: 8OR3-1 -<<< Could not download PDB/mmCIF file: 8P04-1 -<<< Could not download PDB/mmCIF file: 8PDJ-1 -<<< Could not download PDB/mmCIF file: 8SC0-1 -<<< Could not download PDB/mmCIF file: 8SLH-1 -<<< Could not download PDB/mmCIF file: 8T55-3 -<<< Could not download PDB/mmCIF file: 7UYI-2 -<<< Could not download PDB/mmCIF file: 7WH6-2 -<<< Could not download PDB/mmCIF file: 7WT7-1 -<<< Could not download PDB/mmCIF file: 7YQG-1 -<<< Could not download PDB/mmCIF file: 8B0F-1 -<<< Could not download PDB/mmCIF file: 8D7E-1 -<<< Could not download PDB/mmCIF file: 8ENT-1 -<<< Could not download PDB/mmCIF file: 8FK4-2 -<<< Could not download PDB/mmCIF file: 8GB5-2 -<<< Could not download PDB/mmCIF file: 8IF4-1 -<<< Could not download PDB/mmCIF file: 5SBG-1 -<<< Could not download PDB/mmCIF file: 7FCT-1 -<<< Could not download PDB/mmCIF file: 7FS1-1 -<<< Could not download PDB/mmCIF file: 7FSL-3 -<<< Could not download PDB/mmCIF file: 7FSY-1 -<<< Could not download PDB/mmCIF file: 7FTA-3 -<<< Could not download PDB/mmCIF file: 7FVU-1 -<<< Could not download PDB/mmCIF file: 7FX5-1 -<<< Could not download PDB/mmCIF file: 7FYA-2 -<<< Could not download PDB/mmCIF file: 7FZK-1 -<<< Could not download PDB/mmCIF file: 7G0H-1 -<<< Could not download PDB/mmCIF file: 7G1S-1 -<<< Could not download PDB/mmCIF file: 7G93-1 -<<< Could not download PDB/mmCIF file: 7QEM-2 -<<< Could not download PDB/mmCIF file: 7QR9-1 -<<< Could not download PDB/mmCIF file: 7QTE-1 -<<< Could not download PDB/mmCIF file: 7QWA-1 -<<< Could not download PDB/mmCIF file: 7RYT-3 -<<< Could not download PDB/mmCIF file: 7ST5-1 -<<< Could not download PDB/mmCIF file: 7T82-2 -<<< Could not download PDB/mmCIF file: 7TCD-1 -<<< Could not download PDB/mmCIF file: 7TO3-1 -<<< Could not download PDB/mmCIF file: 7TTD-1 -<<< Could not download PDB/mmCIF file: 7TYK-1 -<<< Could not download PDB/mmCIF file: 7U6J-4 -<<< Could not download PDB/mmCIF file: 7U9D-1 -<<< Could not download PDB/mmCIF file: 7UEH-3 -<<< Could not download PDB/mmCIF file: 7UFY-1 -<<< Could not download PDB/mmCIF file: 7ULS-1 -<<< Could not download PDB/mmCIF file: 7UNH-1 -<<< Could not download PDB/mmCIF file: 7UVI-2 -<<< Could not download PDB/mmCIF file: 7V2T-1 -<<< Could not download PDB/mmCIF file: 7WI1-2 -<<< Could not download PDB/mmCIF file: 7WPY-2 -<<< Could not download PDB/mmCIF file: 7WY4-1 -<<< Could not download PDB/mmCIF file: 7X2B-1 -<<< Could not download PDB/mmCIF file: 7X4Q-2 -<<< Could not download PDB/mmCIF file: 7X6F-3 -<<< Could not download PDB/mmCIF file: 7X8G-1 -<<< Could not download PDB/mmCIF file: 7XA1-1 -<<< Could not download PDB/mmCIF file: 7XBR-2 -<<< Could not download PDB/mmCIF file: 7XDX-2 -<<< Could not download PDB/mmCIF file: 7XFK-1 -<<< Could not download PDB/mmCIF file: 7XKS-1 -<<< Could not download 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-<<< Could not download PDB/mmCIF file: 8D3S-1 -<<< Could not download PDB/mmCIF file: 8D8B-1 -<<< Could not download PDB/mmCIF file: 8DJD-1 -<<< Could not download PDB/mmCIF file: 8DMP-7 -<<< Could not download PDB/mmCIF file: 8DPK-1 -<<< Could not download PDB/mmCIF file: 8DSH-1 -<<< Could not download PDB/mmCIF file: 8DX3-1 -<<< Could not download PDB/mmCIF file: 8DZ8-1 -<<< Could not download PDB/mmCIF file: 8E2I-1 -<<< Could not download PDB/mmCIF file: 8E5V-1 -<<< Could not download PDB/mmCIF file: 8E84-1 -<<< Could not download PDB/mmCIF file: 8EAZ-2 -<<< Could not download PDB/mmCIF file: 8EDH-1 -<<< Could not download PDB/mmCIF file: 8EGF-1 -<<< Could not download PDB/mmCIF file: 8EIT-1 -<<< Could not download PDB/mmCIF file: 8ERM-1 -<<< Could not download PDB/mmCIF file: 8F05-1 -<<< Could not download PDB/mmCIF file: 8F3H-1 -<<< Could not download PDB/mmCIF file: 8F5V-1 -<<< Could not download PDB/mmCIF file: 8F8V-2 -<<< Could not download PDB/mmCIF file: 8FC0-2 -<<< Could 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-<<< Could not download PDB/mmCIF file: 7UNI-1 -<<< Could not download PDB/mmCIF file: 7V2U-1 -<<< Could not download PDB/mmCIF file: 7VF6-1 -<<< Could not download PDB/mmCIF file: 7WY4-2 -<<< Could not download PDB/mmCIF file: 7X4S-1 -<<< Could not download PDB/mmCIF file: 7X6G-1 -<<< Could not download PDB/mmCIF file: 7X8G-2 -<<< Could not download PDB/mmCIF file: 7XA2-1 -<<< Could not download PDB/mmCIF file: 7XBS-1 -<<< Could not download PDB/mmCIF file: 7XDY-1 -<<< Could not download PDB/mmCIF file: 7XFK-2 -<<< Could not download PDB/mmCIF file: 7XHZ-1 -<<< Could not download PDB/mmCIF file: 7XJM-1 -<<< Could not download PDB/mmCIF file: 7XKX-1 -<<< Could not download PDB/mmCIF file: 7XMW-1 -<<< Could not download PDB/mmCIF file: 7XP9-1 -<<< Could not download PDB/mmCIF file: 7XR9-1 -<<< Could not download PDB/mmCIF file: 7XWM-1 -<<< Could not download PDB/mmCIF file: 7XY6-1 -<<< Could not download PDB/mmCIF file: 7Y40-1 -<<< Could not download PDB/mmCIF file: 7Y66-1 -<<< Could 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file: 8DJD-2 -<<< Could not download PDB/mmCIF file: 8DMP-8 -<<< Could not download PDB/mmCIF file: 8DPK-2 -<<< Could not download PDB/mmCIF file: 8DSI-1 -<<< Could not download PDB/mmCIF file: 8DZ8-2 -<<< Could not download PDB/mmCIF file: 8E10-1 -<<< Could not download PDB/mmCIF file: 8E2J-1 -<<< Could not download PDB/mmCIF file: 8E84-2 -<<< Could not download PDB/mmCIF file: 8EB0-1 -<<< Could not download PDB/mmCIF file: 8EDH-2 -<<< Could not download PDB/mmCIF file: 8EIW-1 -<<< Could not download PDB/mmCIF file: 8EPU-1 -<<< Could not download PDB/mmCIF file: 8ERM-2 -<<< Could not download PDB/mmCIF file: 8EVK-1 -<<< Could not download PDB/mmCIF file: 8EYA-1 -<<< Could not download PDB/mmCIF file: 8F06-1 -<<< Could not download PDB/mmCIF file: 8F3I-1 -<<< Could not download PDB/mmCIF file: 8F5W-1 -<<< Could not download PDB/mmCIF file: 8F8Y-1 -<<< Could not download PDB/mmCIF file: 8FC0-3 -<<< Could not download PDB/mmCIF file: 8FF7-4 -<<< Could not download PDB/mmCIF file: 8FJ2-2 -<<< Could not download PDB/mmCIF file: 8FM4-4 -<<< Could not download PDB/mmCIF file: 8FOZ-1 -<<< Could not download PDB/mmCIF file: 8FUB-1 -<<< Could not download PDB/mmCIF file: 8FXV-1 -<<< Could not download PDB/mmCIF file: 8G2E-1 -<<< Could not download PDB/mmCIF file: 8G69-1 -<<< Could not download PDB/mmCIF file: 8GCY-1 -<<< Could not download PDB/mmCIF file: 8GIA-1 -<<< Could not download PDB/mmCIF file: 8GN6-1 -<<< Could not download PDB/mmCIF file: 8GW8-1 -<<< Could not download PDB/mmCIF file: 8H1K-1 -<<< Could not download PDB/mmCIF file: 8HAV-1 -<<< Could not download PDB/mmCIF file: 8HFA-1 -<<< Could not download PDB/mmCIF file: 8HJZ-1 -<<< Could not download PDB/mmCIF file: 8HP5-2 -<<< Could not download PDB/mmCIF file: 8I0N-1 -<<< Could not download PDB/mmCIF file: 8I2R-1 -<<< Could not download PDB/mmCIF file: 8I8K-2 -<<< Could not download PDB/mmCIF file: 8IE7-1 -<<< Could not download PDB/mmCIF file: 8ILX-1 -<<< Could not download PDB/mmCIF file: 8IVW-2 -<<< Could not download PDB/mmCIF file: 8JD3-1 -<<< Could not download PDB/mmCIF file: 8OHY-1 -<<< Could not download PDB/mmCIF file: 8ORF-1 -<<< Could not download PDB/mmCIF file: 8P05-2 -<<< Could not download PDB/mmCIF file: 8PFC-2 -<<< Could not download PDB/mmCIF file: 8SC0-3 -<<< Could not download PDB/mmCIF file: 8SLT-1 -<<< Could not download PDB/mmCIF file: 8T5K-1 -<<< Could not download PDB/mmCIF file: 7R1L-1 -<<< Could not download PDB/mmCIF file: 7WH7-2 -<<< Could not download PDB/mmCIF file: 8A6D-1 -<<< Could not download PDB/mmCIF file: 8B3B-1 -<<< Could not download PDB/mmCIF file: 8D82-1 -<<< Could not download PDB/mmCIF file: 8ENT-3 -<<< Could not download PDB/mmCIF file: 8FK4-4 -<<< Could not download PDB/mmCIF file: 8GB5-4 -<<< Could not download PDB/mmCIF file: 8IOS-1 -<<< Could not download PDB/mmCIF file: 5SBJ-1 -<<< Could not download PDB/mmCIF file: 7FS2-1 -<<< Could not download PDB/mmCIF file: 7FSM-1 -<<< Could not download PDB/mmCIF file: 7FSY-3 -<<< Could not download 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-<<< Could not download PDB/mmCIF file: 7YMP-2 -<<< Could not download PDB/mmCIF file: 7YSX-1 -<<< Could not download PDB/mmCIF file: 7Z3R-1 -<<< Could not download PDB/mmCIF file: 7Z5N-2 -<<< Could not download PDB/mmCIF file: 7ZAM-1 -<<< Could not download PDB/mmCIF file: 7ZBZ-1 -<<< Could not download PDB/mmCIF file: 7ZIW-1 -<<< Could not download PDB/mmCIF file: 7ZOH-2 -<<< Could not download PDB/mmCIF file: 7ZS7-3 -<<< Could not download PDB/mmCIF file: 7ZVO-1 -<<< Could not download PDB/mmCIF file: 7ZXC-1 -<<< Could not download PDB/mmCIF file: 8A18-1 -<<< Could not download PDB/mmCIF file: 8A97-4 -<<< Could not download PDB/mmCIF file: 8ABO-1 -<<< Could not download PDB/mmCIF file: 8ADC-2 -<<< Could not download PDB/mmCIF file: 8AF9-1 -<<< Could not download PDB/mmCIF file: 8AGD-1 -<<< Could not download PDB/mmCIF file: 8AK3-1 -<<< Could not download PDB/mmCIF file: 8AVJ-1 -<<< Could not download PDB/mmCIF file: 8B01-1 -<<< Could not download PDB/mmCIF file: 8B2O-1 -<<< Could not download PDB/mmCIF file: 8B6I-1 -<<< Could not download PDB/mmCIF file: 8BDP-1 -<<< Could not download PDB/mmCIF file: 8BJU-1 -<<< Could not download PDB/mmCIF file: 8BO2-1 -<<< Could not download PDB/mmCIF file: 8BRD-1 -<<< Could not download PDB/mmCIF file: 8BV1-1 -<<< Could not download PDB/mmCIF file: 8BYW-5 -<<< Could not download PDB/mmCIF file: 8C3W-1 -<<< Could not download PDB/mmCIF file: 8C7O-1 -<<< Could not download PDB/mmCIF file: 8CCH-1 -<<< Could not download PDB/mmCIF file: 8CGB-1 -<<< Could not download PDB/mmCIF file: 8CLK-1 -<<< Could not download PDB/mmCIF file: 8CUD-1 -<<< Could not download PDB/mmCIF file: 8CWL-1 -<<< Could not download PDB/mmCIF file: 8CZJ-1 -<<< Could not download PDB/mmCIF file: 8D1C-1 -<<< Could not download PDB/mmCIF file: 8D8D-1 -<<< Could not download PDB/mmCIF file: 8DHI-1 -<<< Could not download PDB/mmCIF file: 8DJE-1 -<<< Could not download PDB/mmCIF file: 8DMQ-1 -<<< Could not download PDB/mmCIF file: 8DSJ-1 -<<< Could not download 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file: 8G2F-1 -<<< Could not download PDB/mmCIF file: 8G69-2 -<<< Could not download PDB/mmCIF file: 8GCZ-1 -<<< Could not download PDB/mmCIF file: 8GIA-2 -<<< Could not download PDB/mmCIF file: 8GN6-2 -<<< Could not download PDB/mmCIF file: 8GR3-1 -<<< Could not download PDB/mmCIF file: 8GTJ-1 -<<< Could not download PDB/mmCIF file: 8H1L-1 -<<< Could not download PDB/mmCIF file: 8H65-1 -<<< Could not download PDB/mmCIF file: 8HAW-1 -<<< Could not download PDB/mmCIF file: 8HFA-2 -<<< Could not download PDB/mmCIF file: 8HK0-1 -<<< Could not download PDB/mmCIF file: 8HP5-3 -<<< Could not download PDB/mmCIF file: 8I17-1 -<<< Could not download PDB/mmCIF file: 8I2Z-1 -<<< Could not download PDB/mmCIF file: 8I8K-3 -<<< Could not download PDB/mmCIF file: 8IE8-1 -<<< Could not download PDB/mmCIF file: 8ILX-2 -<<< Could not download PDB/mmCIF file: 8IVW-3 -<<< Could not download PDB/mmCIF file: 8JD4-1 -<<< Could not download PDB/mmCIF file: 8OIG-1 -<<< Could not download PDB/mmCIF file: 8ORG-1 -<<< Could not download PDB/mmCIF file: 8P06-1 -<<< Could not download PDB/mmCIF file: 8PFC-3 -<<< Could not download PDB/mmCIF file: 8SC0-4 -<<< Could not download PDB/mmCIF file: 8SLU-1 -<<< Could not download PDB/mmCIF file: 8T5L-1 -<<< Could not download PDB/mmCIF file: 7R29-1 -<<< Could not download PDB/mmCIF file: 7W4B-1 -<<< Could not download PDB/mmCIF file: 7WHB-1 -<<< Could not download PDB/mmCIF file: 7ZH1-1 -<<< Could not download PDB/mmCIF file: 8A6E-1 -<<< Could not download PDB/mmCIF file: 8B3B-2 -<<< Could not download PDB/mmCIF file: 8ENT-4 -<<< Could not download PDB/mmCIF file: 8FK4-5 -<<< Could not download PDB/mmCIF file: 8GB6-1 -<<< Could not download PDB/mmCIF file: 8IOT-1 -<<< Could not download PDB/mmCIF file: 6GPN-2 -<<< Could not download PDB/mmCIF file: 6HL8-2 -<<< Could not download PDB/mmCIF file: 7FEX-1 -<<< Could not download PDB/mmCIF file: 7FS2-2 -<<< Could not download PDB/mmCIF file: 7FSM-2 -<<< Could not download PDB/mmCIF file: 7FSY-4 -<<< Could not download PDB/mmCIF file: 7FTB-2 -<<< Could not download PDB/mmCIF file: 7FVX-1 -<<< Could not download PDB/mmCIF file: 7FX8-1 -<<< Could not download PDB/mmCIF file: 7FYD-1 -<<< Could not download PDB/mmCIF file: 7FZN-1 -<<< Could not download PDB/mmCIF file: 7G0K-1 -<<< Could not download PDB/mmCIF file: 7G1V-1 -<<< Could not download PDB/mmCIF file: 7G96-1 -<<< Could not download PDB/mmCIF file: 7PVU-2 -<<< Could not download PDB/mmCIF file: 7QOM-1 -<<< Could not download PDB/mmCIF file: 7QPQ-1 -<<< Could not download PDB/mmCIF file: 7QR9-4 -<<< Could not download PDB/mmCIF file: 7QTH-1 -<<< Could not download PDB/mmCIF file: 7QWD-1 -<<< Could not download PDB/mmCIF file: 7TH5-1 -<<< Could not download PDB/mmCIF file: 7TMA-1 -<<< Could not download PDB/mmCIF file: 7TO7-1 -<<< Could not download PDB/mmCIF file: 7U08-1 -<<< Could not download PDB/mmCIF file: 7U6J-7 -<<< Could not download PDB/mmCIF file: 7UFZ-2 -<<< Could not download PDB/mmCIF file: 7UNJ-1 -<<< Could not download PDB/mmCIF file: 7WG0-2 -<<< Could not download PDB/mmCIF file: 7WMB-1 -<<< Could not download PDB/mmCIF file: 7WNT-1 -<<< Could not download PDB/mmCIF file: 7X4T-2 -<<< Could not download PDB/mmCIF file: 7X6G-3 -<<< Could not download PDB/mmCIF file: 7XA4-1 -<<< Could not download PDB/mmCIF file: 7XBU-1 -<<< Could not download PDB/mmCIF file: 7XFK-4 -<<< Could not download PDB/mmCIF file: 7XJM-3 -<<< Could not download PDB/mmCIF file: 7XKY-1 -<<< Could not download PDB/mmCIF file: 7XN2-1 -<<< Could not download PDB/mmCIF file: 7XPC-2 -<<< Could not download PDB/mmCIF file: 7XRB-1 -<<< Could not download PDB/mmCIF file: 7XV0-1 -<<< Could not download PDB/mmCIF file: 7Y6A-1 -<<< Could not download PDB/mmCIF file: 7Y8I-1 -<<< Could not download PDB/mmCIF file: 7YA4-1 -<<< Could not download PDB/mmCIF file: 7YCN-2 -<<< Could not download PDB/mmCIF file: 7YHR-1 -<<< Could not download PDB/mmCIF file: 7YJR-2 -<<< Could not download PDB/mmCIF file: 7YMP-3 -<<< Could not download PDB/mmCIF file: 7Z3S-1 -<<< Could not download PDB/mmCIF file: 7Z5N-3 -<<< Could not download PDB/mmCIF file: 7ZE5-1 -<<< Could not download PDB/mmCIF file: 7ZHC-1 -<<< Could not download PDB/mmCIF file: 7ZIW-2 -<<< Could not download PDB/mmCIF file: 7ZKS-1 -<<< Could not download PDB/mmCIF file: 7ZOH-3 -<<< Could not download PDB/mmCIF file: 7ZQ7-1 -<<< Could not download PDB/mmCIF file: 7ZS7-4 -<<< Could not download PDB/mmCIF file: 7ZTZ-1 -<<< Could not download PDB/mmCIF file: 7ZXD-1 -<<< Could not download PDB/mmCIF file: 8A4D-1 -<<< Could not download PDB/mmCIF file: 8A9A-1 -<<< Could not download PDB/mmCIF file: 8ADD-1 -<<< Could not download PDB/mmCIF file: 8AF9-2 -<<< Could not download PDB/mmCIF file: 8AIF-1 -<<< Could not download PDB/mmCIF file: 8AKH-1 -<<< Could not download PDB/mmCIF file: 8ATM-1 -<<< Could not download PDB/mmCIF file: 8AVK-1 -<<< Could not download PDB/mmCIF file: 8B6I-2 -<<< Could not download PDB/mmCIF file: 8BB6-1 -<<< Could not download PDB/mmCIF file: 8BDS-1 -<<< Could not download PDB/mmCIF file: 8BOD-1 -<<< Could not download PDB/mmCIF file: 8BRK-1 -<<< Could not download PDB/mmCIF file: 8BV1-2 -<<< Could not download PDB/mmCIF file: 8BYW-6 -<<< Could not download PDB/mmCIF file: 8C3X-1 -<<< Could not download PDB/mmCIF file: 8C7O-2 -<<< Could not download PDB/mmCIF file: 8CCN-1 -<<< Could not download PDB/mmCIF file: 8CGB-2 -<<< Could not download PDB/mmCIF file: 8CLL-1 -<<< Could not download PDB/mmCIF file: 8CUF-1 -<<< Could not download PDB/mmCIF file: 8CZK-1 -<<< Could not download PDB/mmCIF file: 8D8E-1 -<<< Could not download PDB/mmCIF file: 8DHI-2 -<<< Could not download PDB/mmCIF file: 8DJE-2 -<<< Could not download PDB/mmCIF file: 8DMQ-2 -<<< Could not download PDB/mmCIF file: 8DPQ-1 -<<< Could not download PDB/mmCIF file: 8DSJ-2 -<<< Could not download PDB/mmCIF file: 8DZ8-4 -<<< Could not download PDB/mmCIF file: 8E11-1 -<<< Could not download PDB/mmCIF file: 8E8O-1 -<<< Could not download PDB/mmCIF file: 8EIY-1 -<<< Could not download PDB/mmCIF file: 8EMT-1 -<<< Could not download PDB/mmCIF file: 8EPW-1 -<<< Could not download PDB/mmCIF file: 8EW0-1 -<<< Could not download PDB/mmCIF file: 8EYB-1 -<<< Could not download PDB/mmCIF file: 8F3K-1 -<<< Could not download PDB/mmCIF file: 8F5Z-1 -<<< Could not download PDB/mmCIF file: 8F8Z-1 -<<< Could not download PDB/mmCIF file: 8FC0-5 -<<< Could not download PDB/mmCIF file: 8FF7-6 -<<< Could not download PDB/mmCIF file: 8FJ9-1 -<<< Could not download PDB/mmCIF file: 8FM5-2 -<<< Could not download PDB/mmCIF file: 8FP1-1 -<<< Could not download PDB/mmCIF file: 8FUI-1 -<<< Could not download PDB/mmCIF file: 8FYF-1 -<<< Could not download PDB/mmCIF file: 8G2G-1 -<<< Could not download PDB/mmCIF file: 8G6A-1 -<<< Could not download PDB/mmCIF file: 8GD0-1 -<<< Could not download PDB/mmCIF file: 8GIH-1 -<<< Could not download PDB/mmCIF file: 8GN6-3 -<<< Could not download PDB/mmCIF file: 8GR3-2 -<<< Could not download PDB/mmCIF file: 8GTJ-2 -<<< Could not download 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file: 7R29-2 -<<< Could not download PDB/mmCIF file: 7W4B-2 -<<< Could not download PDB/mmCIF file: 7WHD-1 -<<< Could not download PDB/mmCIF file: 7WVD-1 -<<< Could not download PDB/mmCIF file: 7YSH-1 -<<< Could not download PDB/mmCIF file: 7ZH2-1 -<<< Could not download PDB/mmCIF file: 8A94-1 -<<< Could not download PDB/mmCIF file: 8B3B-3 -<<< Could not download PDB/mmCIF file: 8EOG-1 -<<< Could not download PDB/mmCIF file: 8FK4-6 -<<< Could not download PDB/mmCIF file: 8GB7-1 -<<< Could not download PDB/mmCIF file: 8IOU-1 -<<< Could not download PDB/mmCIF file: 7FS3-1 -<<< Could not download PDB/mmCIF file: 7FSM-3 -<<< Could not download PDB/mmCIF file: 7FSZ-1 -<<< Could not download PDB/mmCIF file: 7FTB-3 -<<< Could not download PDB/mmCIF file: 7FVY-1 -<<< Could not download PDB/mmCIF file: 7FX9-1 -<<< Could not download PDB/mmCIF file: 7FYE-1 -<<< Could not download PDB/mmCIF file: 7FZO-1 -<<< Could not download PDB/mmCIF file: 7G0L-1 -<<< Could not download PDB/mmCIF file: 7G1W-1 -<<< Could not download PDB/mmCIF file: 7G97-1 -<<< Could not download PDB/mmCIF file: 7QON-1 -<<< Could not download PDB/mmCIF file: 7QPQ-2 -<<< Could not download PDB/mmCIF file: 7QRA-1 -<<< Could not download PDB/mmCIF file: 7QTM-1 -<<< Could not download PDB/mmCIF file: 7QWE-1 -<<< Could not download PDB/mmCIF file: 7SVP-1 -<<< Could not download PDB/mmCIF file: 7TO7-2 -<<< Could not download PDB/mmCIF file: 7U6J-8 -<<< Could not download PDB/mmCIF file: 7U9I-1 -<<< Could not download PDB/mmCIF file: 7UEK-1 -<<< Could not download PDB/mmCIF file: 7UG0-1 -<<< Could not download PDB/mmCIF file: 7UPK-1 -<<< Could not download PDB/mmCIF file: 7UVO-1 -<<< Could not download PDB/mmCIF file: 7UXL-1 -<<< Could not download PDB/mmCIF file: 7V2X-1 -<<< Could not download PDB/mmCIF file: 7WKB-1 -<<< Could not download PDB/mmCIF file: 7WNV-1 -<<< Could not download PDB/mmCIF file: 7WQ7-1 -<<< Could not download PDB/mmCIF file: 7WUD-1 -<<< Could not download PDB/mmCIF file: 7X4U-1 -<<< Could not download PDB/mmCIF file: 7X6H-1 -<<< Could not download PDB/mmCIF file: 7XBV-1 -<<< Could not download PDB/mmCIF file: 7XGS-1 -<<< Could not download PDB/mmCIF file: 7XI1-1 -<<< Could not download PDB/mmCIF file: 7XJM-4 -<<< Could not download PDB/mmCIF file: 7XPI-1 -<<< Could not download PDB/mmCIF file: 7XRE-1 -<<< Could not download PDB/mmCIF file: 7XV1-1 -<<< Could not download PDB/mmCIF file: 7XZG-1 -<<< Could not download PDB/mmCIF file: 7Y16-1 -<<< Could not download PDB/mmCIF file: 7Y48-1 -<<< Could not download PDB/mmCIF file: 7Y8I-2 -<<< Could not download PDB/mmCIF file: 7YA4-2 -<<< Could not download PDB/mmCIF file: 7YCN-3 -<<< Could not download PDB/mmCIF file: 7YI0-1 -<<< Could not download PDB/mmCIF file: 7YJS-1 -<<< Could not download PDB/mmCIF file: 7YMP-4 -<<< Could not download PDB/mmCIF file: 7Z1V-1 -<<< Could not download PDB/mmCIF file: 7Z3T-1 -<<< Could not download PDB/mmCIF file: 7Z5N-4 -<<< Could not download PDB/mmCIF file: 7ZIX-1 -<<< Could not download PDB/mmCIF file: 7ZKT-1 -<<< Could not download PDB/mmCIF file: 7ZOH-4 -<<< Could not download PDB/mmCIF file: 7ZQ7-2 -<<< Could not download PDB/mmCIF file: 7ZS8-1 -<<< Could not download PDB/mmCIF file: 7ZU1-1 -<<< Could not download PDB/mmCIF file: 7ZXD-2 -<<< Could not download PDB/mmCIF file: 8A4D-2 -<<< Could not download PDB/mmCIF file: 8A5K-1 -<<< Could not download PDB/mmCIF file: 8A7J-1 -<<< Could not download PDB/mmCIF file: 8A9C-1 -<<< Could not download PDB/mmCIF file: 8ABQ-1 -<<< Could not download PDB/mmCIF file: 8AF9-3 -<<< Could not download PDB/mmCIF file: 8AGH-1 -<<< Could not download PDB/mmCIF file: 8AIF-2 -<<< Could not download PDB/mmCIF file: 8AKH-2 -<<< Could not download PDB/mmCIF file: 8ATO-1 -<<< Could not download PDB/mmCIF file: 8AVL-1 -<<< Could not download PDB/mmCIF file: 8B6U-1 -<<< Could not download PDB/mmCIF file: 8BB6-2 -<<< Could not download PDB/mmCIF file: 8BDT-1 -<<< Could not download PDB/mmCIF file: 8BKD-1 -<<< Could not download PDB/mmCIF file: 8BOF-1 -<<< Could not download PDB/mmCIF file: 8BRL-1 -<<< Could not download PDB/mmCIF file: 8BV1-3 -<<< Could not download PDB/mmCIF file: 8BYW-7 -<<< Could not download PDB/mmCIF file: 8C4I-1 -<<< Could not download PDB/mmCIF file: 8C7T-1 -<<< Could not download PDB/mmCIF file: 8CCO-1 -<<< Could not download PDB/mmCIF file: 8CGC-1 -<<< Could not download PDB/mmCIF file: 8CM1-1 -<<< Could not download PDB/mmCIF file: 8CUF-2 -<<< Could not download PDB/mmCIF file: 8CWR-1 -<<< Could not download PDB/mmCIF file: 8CZK-2 -<<< Could not download PDB/mmCIF file: 8D8F-1 -<<< Could not download PDB/mmCIF file: 8DHJ-1 -<<< Could not download PDB/mmCIF file: 8DJF-1 -<<< Could not download PDB/mmCIF file: 8DMR-1 -<<< Could not download PDB/mmCIF file: 8DSL-1 -<<< Could not download PDB/mmCIF file: 8DUF-1 -<<< Could not download PDB/mmCIF file: 8DZ8-5 -<<< Could not download PDB/mmCIF file: 8E11-2 -<<< Could not download PDB/mmCIF file: 8E2R-1 -<<< Could not download PDB/mmCIF file: 8E60-1 -<<< Could not download PDB/mmCIF file: 8EJ7-1 -<<< Could not download PDB/mmCIF file: 8EMU-1 -<<< Could not download PDB/mmCIF file: 8EPZ-1 -<<< Could not download PDB/mmCIF file: 8EW2-1 -<<< Could not download PDB/mmCIF file: 8EYB-2 -<<< Could not download PDB/mmCIF file: 8F3L-1 -<<< Could not download PDB/mmCIF file: 8F61-1 -<<< Could not download PDB/mmCIF file: 8F8Z-2 -<<< Could not download PDB/mmCIF file: 8FC0-6 -<<< Could not download PDB/mmCIF file: 8FF8-1 -<<< Could not download PDB/mmCIF file: 8FJ9-2 -<<< Could not download PDB/mmCIF file: 8FM5-3 -<<< Could not download PDB/mmCIF file: 8FP3-1 -<<< Could not download PDB/mmCIF file: 8FUJ-1 -<<< Could not download PDB/mmCIF file: 8FZ3-1 -<<< Could not download PDB/mmCIF file: 8G2G-2 -<<< Could not download PDB/mmCIF file: 8G6A-2 -<<< Could not download PDB/mmCIF file: 8GD1-1 -<<< Could not download PDB/mmCIF file: 8GIW-1 -<<< Could not download PDB/mmCIF file: 8GR3-3 -<<< Could not download PDB/mmCIF file: 8GTK-1 -<<< Could not download PDB/mmCIF file: 8H1M-1 -<<< Could not download PDB/mmCIF file: 8H6C-1 -<<< Could not download PDB/mmCIF file: 8HB9-2 -<<< Could not download PDB/mmCIF file: 8HFA-4 -<<< Could not download PDB/mmCIF file: 8HK3-1 -<<< Could not download PDB/mmCIF file: 8HP6-2 -<<< Could not download PDB/mmCIF file: 8I17-3 -<<< Could not download PDB/mmCIF file: 8I3G-1 -<<< Could not download PDB/mmCIF file: 8I8L-2 -<<< Could not download PDB/mmCIF file: 8IEV-1 -<<< Could not download PDB/mmCIF file: 8ILY-2 -<<< Could not download PDB/mmCIF file: 8IVX-1 -<<< Could not download PDB/mmCIF file: 8OIG-3 -<<< Could not download PDB/mmCIF file: 8ORN-2 -<<< Could not download PDB/mmCIF file: 8P07-1 -<<< Could not download PDB/mmCIF file: 8PFC-5 -<<< Could not download PDB/mmCIF file: 8SCX-1 -<<< Could not download PDB/mmCIF file: 8SLY-1 -<<< Could not download PDB/mmCIF file: 8T5T-1 -<<< Could not download PDB/mmCIF file: 7R2D-1 -<<< Could not download PDB/mmCIF file: 7W4B-3 -<<< Could not download 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file: 7QON-2 -<<< Could not download PDB/mmCIF file: 7QPR-1 -<<< Could not download PDB/mmCIF file: 7QRA-2 -<<< Could not download PDB/mmCIF file: 7QWE-2 -<<< Could not download PDB/mmCIF file: 7QXV-1 -<<< Could not download PDB/mmCIF file: 7SQA-1 -<<< Could not download PDB/mmCIF file: 7SVP-2 -<<< Could not download PDB/mmCIF file: 7T94-1 -<<< Could not download PDB/mmCIF file: 7TO8-1 -<<< Could not download PDB/mmCIF file: 7TQD-1 -<<< Could not download PDB/mmCIF file: 7TTK-1 -<<< Could not download PDB/mmCIF file: 7TYP-1 -<<< Could not download PDB/mmCIF file: 7U4C-1 -<<< Could not download PDB/mmCIF file: 7U9J-1 -<<< Could not download PDB/mmCIF file: 7UDF-1 -<<< Could not download PDB/mmCIF file: 7UG1-1 -<<< Could not download PDB/mmCIF file: 7UL1-1 -<<< Could not download PDB/mmCIF file: 7UM2-1 -<<< Could not download PDB/mmCIF file: 7URL-1 -<<< Could not download PDB/mmCIF file: 7UVQ-1 -<<< Could not download PDB/mmCIF file: 7WNV-2 -<<< Could not download PDB/mmCIF file: 7WQA-1 -<<< Could not download PDB/mmCIF file: 7WYF-1 -<<< Could not download PDB/mmCIF file: 7X2H-1 -<<< Could not download PDB/mmCIF file: 7X4V-1 -<<< Could not download PDB/mmCIF file: 7X6H-2 -<<< Could not download PDB/mmCIF file: 7XGT-1 -<<< Could not download PDB/mmCIF file: 7XI2-1 -<<< Could not download PDB/mmCIF file: 7XJN-1 -<<< Could not download PDB/mmCIF file: 7XPJ-1 -<<< Could not download PDB/mmCIF file: 7XRF-1 -<<< Could not download PDB/mmCIF file: 7XV2-1 -<<< Could not download PDB/mmCIF file: 7XWO-1 -<<< Could not download PDB/mmCIF file: 7XY9-1 -<<< Could not download PDB/mmCIF file: 7XZH-1 -<<< Could not download PDB/mmCIF file: 7Y16-2 -<<< Could not download PDB/mmCIF file: 7Y4A-1 -<<< Could not download PDB/mmCIF file: 7Y8I-3 -<<< Could not download PDB/mmCIF file: 7YA7-1 -<<< Could not download PDB/mmCIF file: 7YCN-4 -<<< Could not download PDB/mmCIF file: 7YF2-1 -<<< Could not download PDB/mmCIF file: 7YI3-1 -<<< Could not download PDB/mmCIF file: 7YJS-2 -<<< Could 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not download PDB/mmCIF file: 8IW1-1 -<<< Could not download PDB/mmCIF file: 8JFS-1 -<<< Could not download PDB/mmCIF file: 8OIJ-1 -<<< Could not download PDB/mmCIF file: 8OSE-1 -<<< Could not download PDB/mmCIF file: 8P08-1 -<<< Could not download PDB/mmCIF file: 8PFC-6 -<<< Could not download PDB/mmCIF file: 8SDW-1 -<<< Could not download PDB/mmCIF file: 8SMQ-1 -<<< Could not download PDB/mmCIF file: 8T7W-1 -<<< Could not download PDB/mmCIF file: 7R2D-2 -<<< Could not download PDB/mmCIF file: 7U2M-1 -<<< Could not download PDB/mmCIF file: 7UZC-1 -<<< Could not download PDB/mmCIF file: 7W4B-4 -<<< Could not download PDB/mmCIF file: 7WHE-2 -<<< Could not download PDB/mmCIF file: 7YSW-1 -<<< Could not download PDB/mmCIF file: 8AA0-1 -<<< Could not download PDB/mmCIF file: 8B3E-1 -<<< Could not download PDB/mmCIF file: 8CT6-1 -<<< Could not download PDB/mmCIF file: 8DM1-1 -<<< Could not download PDB/mmCIF file: 8EPA-1 -<<< Could not download PDB/mmCIF file: 8FK4-8 -<<< Could not download 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-<<< Could not download PDB/mmCIF file: 7XJN-2 -<<< Could not download PDB/mmCIF file: 7XPK-1 -<<< Could not download PDB/mmCIF file: 7XRH-1 -<<< Could not download PDB/mmCIF file: 7XTK-1 -<<< Could not download PDB/mmCIF file: 7XV3-1 -<<< Could not download PDB/mmCIF file: 7XYE-1 -<<< Could not download PDB/mmCIF file: 7XZJ-1 -<<< Could not download PDB/mmCIF file: 7Y17-1 -<<< Could not download PDB/mmCIF file: 7Y4A-2 -<<< Could not download PDB/mmCIF file: 7Y8I-4 -<<< Could not download PDB/mmCIF file: 7YA7-2 -<<< Could not download PDB/mmCIF file: 7YCO-1 -<<< Could not download PDB/mmCIF file: 7YF3-1 -<<< Could not download PDB/mmCIF file: 7YJT-1 -<<< Could not download PDB/mmCIF file: 7YMP-6 -<<< Could not download PDB/mmCIF file: 7YYV-1 -<<< Could not download PDB/mmCIF file: 7Z1Y-1 -<<< Could not download PDB/mmCIF file: 7Z3T-3 -<<< Could not download PDB/mmCIF file: 7Z5N-6 -<<< Could not download PDB/mmCIF file: 7ZAS-2 -<<< Could not download PDB/mmCIF file: 7ZC4-1 -<<< Could not download PDB/mmCIF file: 7ZIY-1 -<<< Could not download PDB/mmCIF file: 7ZKT-3 -<<< Could not download PDB/mmCIF file: 7ZOM-1 -<<< Could not download PDB/mmCIF file: 7ZQF-1 -<<< Could not download PDB/mmCIF file: 7ZU3-1 -<<< Could not download PDB/mmCIF file: 7ZXJ-1 -<<< Could not download PDB/mmCIF file: 8A1G-1 -<<< Could not download PDB/mmCIF file: 8A2N-1 -<<< Could not download PDB/mmCIF file: 8A4E-1 -<<< Could not download PDB/mmCIF file: 8A5K-3 -<<< Could not download PDB/mmCIF file: 8A7L-1 -<<< Could not download PDB/mmCIF file: 8A9E-1 -<<< Could not download PDB/mmCIF file: 8ABR-1 -<<< Could not download PDB/mmCIF file: 8ADG-1 -<<< Could not download PDB/mmCIF file: 8AF9-5 -<<< Could not download PDB/mmCIF file: 8AKJ-1 -<<< Could not download PDB/mmCIF file: 8AR6-1 -<<< Could not download PDB/mmCIF file: 8ATY-1 -<<< Could not download PDB/mmCIF file: 8AVL-3 -<<< Could not download PDB/mmCIF file: 8AXS-2 -<<< Could not download PDB/mmCIF file: 8B05-1 -<<< Could not download 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-<<< Could not download PDB/mmCIF file: 8ADI-1 -<<< Could not download PDB/mmCIF file: 8AF9-7 -<<< Could not download PDB/mmCIF file: 8AIK-2 -<<< Could not download PDB/mmCIF file: 8AKL-1 -<<< Could not download PDB/mmCIF file: 8AR6-3 -<<< Could not download PDB/mmCIF file: 8AU6-1 -<<< Could not download PDB/mmCIF file: 8AVM-1 -<<< Could not download PDB/mmCIF file: 8AXT-2 -<<< Could not download PDB/mmCIF file: 8B07-1 -<<< Could not download PDB/mmCIF file: 8B2V-1 -<<< Could not download PDB/mmCIF file: 8BCQ-1 -<<< Could not download PDB/mmCIF file: 8BFT-1 -<<< Could not download PDB/mmCIF file: 8BIB-1 -<<< Could not download PDB/mmCIF file: 8BKD-5 -<<< Could not download PDB/mmCIF file: 8BOK-1 -<<< Could not download PDB/mmCIF file: 8BRQ-1 -<<< Could not download PDB/mmCIF file: 8BV2-1 -<<< Could not download PDB/mmCIF file: 8BZJ-1 -<<< Could not download PDB/mmCIF file: 8C4M-2 -<<< Could not download PDB/mmCIF file: 8C7V-3 -<<< Could not download PDB/mmCIF file: 8CCW-1 -<<< Could not download PDB/mmCIF file: 8CGS-2 -<<< Could not download PDB/mmCIF file: 8CNX-1 -<<< Could not download PDB/mmCIF file: 8D5V-1 -<<< Could not download PDB/mmCIF file: 8DKT-1 -<<< Could not download PDB/mmCIF file: 8DMU-2 -<<< Could not download PDB/mmCIF file: 8DON-1 -<<< Could not download PDB/mmCIF file: 8DQ2-2 -<<< Could not download PDB/mmCIF file: 8DSO-1 -<<< Could not download PDB/mmCIF file: 8DUK-1 -<<< Could not download PDB/mmCIF file: 8DXG-1 -<<< Could not download PDB/mmCIF file: 8E2S-4 -<<< Could not download PDB/mmCIF file: 8EDX-1 -<<< Could not download PDB/mmCIF file: 8EGQ-1 -<<< Could not download PDB/mmCIF file: 8EJK-1 -<<< Could not download PDB/mmCIF file: 8EN0-1 -<<< Could not download PDB/mmCIF file: 8EQ4-1 -<<< Could not download PDB/mmCIF file: 8ESA-1 -<<< Could not download PDB/mmCIF file: 8EYI-1 -<<< Could not download PDB/mmCIF file: 8F0L-1 -<<< Could not download PDB/mmCIF file: 8F3P-1 -<<< Could not download PDB/mmCIF file: 8F6D-1 -<<< Could not download 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-<<< Could not download PDB/mmCIF file: 8GJM-1 -<<< Could not download PDB/mmCIF file: 8J4F-1 -<<< Could not download PDB/mmCIF file: 7AVW-1 -<<< Could not download PDB/mmCIF file: 7FS5-2 -<<< Could not download PDB/mmCIF file: 7FSN-4 -<<< Could not download PDB/mmCIF file: 7FT0-2 -<<< Could not download PDB/mmCIF file: 7FTC-4 -<<< Could not download PDB/mmCIF file: 7FW3-1 -<<< Could not download PDB/mmCIF file: 7FXE-1 -<<< Could not download PDB/mmCIF file: 7FYJ-1 -<<< Could not download PDB/mmCIF file: 7FZS-1 -<<< Could not download PDB/mmCIF file: 7G0Q-1 -<<< Could not download PDB/mmCIF file: 7G20-1 -<<< Could not download PDB/mmCIF file: 7G9C-1 -<<< Could not download PDB/mmCIF file: 7QH9-4 -<<< Could not download PDB/mmCIF file: 7QPS-1 -<<< Could not download PDB/mmCIF file: 7QRB-2 -<<< Could not download PDB/mmCIF file: 7QWH-2 -<<< Could not download PDB/mmCIF file: 7R28-2 -<<< Could not download PDB/mmCIF file: 7R39-2 -<<< Could not download PDB/mmCIF file: 7RZ2-1 -<<< Could not download PDB/mmCIF file: 7S3P-2 -<<< Could not download PDB/mmCIF file: 7TEK-1 -<<< Could not download PDB/mmCIF file: 7TX9-1 -<<< Could not download PDB/mmCIF file: 7U9N-2 -<<< Could not download PDB/mmCIF file: 7UDL-1 -<<< Could not download PDB/mmCIF file: 7UER-1 -<<< Could not download PDB/mmCIF file: 7UG5-1 -<<< Could not download PDB/mmCIF file: 7UI0-1 -<<< Could not download PDB/mmCIF file: 7UNP-1 -<<< Could not download PDB/mmCIF file: 7UW3-1 -<<< Could not download PDB/mmCIF file: 7UZ1-1 -<<< Could not download PDB/mmCIF file: 7VRH-2 -<<< Could not download PDB/mmCIF file: 7WRX-2 -<<< Could not download PDB/mmCIF file: 7WUL-1 -<<< Could not download PDB/mmCIF file: 7X2P-1 -<<< Could not download PDB/mmCIF file: 7X4X-1 -<<< Could not download PDB/mmCIF file: 7XAA-1 -<<< Could not download PDB/mmCIF file: 7XC1-1 -<<< Could not download PDB/mmCIF file: 7XFS-1 -<<< Could not download PDB/mmCIF file: 7XGW-2 -<<< Could not download PDB/mmCIF file: 7XI5-4 -<<< Could not download 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-<<< Could not download PDB/mmCIF file: 8BZJ-2 -<<< Could not download PDB/mmCIF file: 8C4N-1 -<<< Could not download PDB/mmCIF file: 8C7W-1 -<<< Could not download PDB/mmCIF file: 8CCZ-1 -<<< Could not download PDB/mmCIF file: 8CH4-1 -<<< Could not download PDB/mmCIF file: 8CNY-1 -<<< Could not download PDB/mmCIF file: 8CUI-1 -<<< Could not download PDB/mmCIF file: 8CX9-1 -<<< Could not download PDB/mmCIF file: 8D5V-2 -<<< Could not download PDB/mmCIF file: 8D77-1 -<<< Could not download PDB/mmCIF file: 8D8P-1 -<<< Could not download PDB/mmCIF file: 8DJJ-1 -<<< Could not download PDB/mmCIF file: 8DMU-3 -<<< Could not download PDB/mmCIF file: 8DUK-2 -<<< Could not download PDB/mmCIF file: 8DXH-1 -<<< Could not download PDB/mmCIF file: 8E2W-1 -<<< Could not download PDB/mmCIF file: 8EGU-1 -<<< Could not download PDB/mmCIF file: 8EN1-1 -<<< Could not download PDB/mmCIF file: 8EQ5-1 -<<< Could not download PDB/mmCIF file: 8ESB-1 -<<< Could not download PDB/mmCIF file: 8EW8-1 -<<< Could not download PDB/mmCIF file: 8F0W-1 -<<< Could not download PDB/mmCIF file: 8F3Q-1 -<<< Could not download PDB/mmCIF file: 8F6D-2 -<<< Could not download PDB/mmCIF file: 8FA0-1 -<<< Could not download PDB/mmCIF file: 8FCA-1 -<<< Could not download PDB/mmCIF file: 8FFT-2 -<<< Could not download PDB/mmCIF file: 8FK3-1 -<<< Could not download PDB/mmCIF file: 8FM7-4 -<<< Could not download PDB/mmCIF file: 8FQK-1 -<<< Could not download PDB/mmCIF file: 8FUN-1 -<<< Could not download PDB/mmCIF file: 8FZ4-2 -<<< Could not download PDB/mmCIF file: 8G35-1 -<<< Could not download PDB/mmCIF file: 8G7H-1 -<<< Could not download PDB/mmCIF file: 8GDS-2 -<<< Could not download PDB/mmCIF file: 8GJT-1 -<<< Could not download PDB/mmCIF file: 8GNN-1 -<<< Could not download PDB/mmCIF file: 8H27-1 -<<< Could not download PDB/mmCIF file: 8HBH-1 -<<< Could not download PDB/mmCIF file: 8HFK-1 -<<< Could not download PDB/mmCIF file: 8HKB-1 -<<< Could not download PDB/mmCIF file: 8HP8-1 -<<< Could not download 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-<<< Could not download PDB/mmCIF file: 7TCV-1 -<<< Could not download PDB/mmCIF file: 7TEL-1 -<<< Could not download PDB/mmCIF file: 7THG-1 -<<< Could not download PDB/mmCIF file: 7TMC-1 -<<< Could not download PDB/mmCIF file: 7TXA-1 -<<< Could not download PDB/mmCIF file: 7TYU-1 -<<< Could not download PDB/mmCIF file: 7U2F-1 -<<< Could not download PDB/mmCIF file: 7UDM-1 -<<< Could not download PDB/mmCIF file: 7UES-1 -<<< Could not download PDB/mmCIF file: 7UG5-2 -<<< Could not download PDB/mmCIF file: 7UI1-1 -<<< Could not download PDB/mmCIF file: 7URV-1 -<<< Could not download PDB/mmCIF file: 7UU0-1 -<<< Could not download PDB/mmCIF file: 7UW3-2 -<<< Could not download PDB/mmCIF file: 7UZ1-2 -<<< Could not download PDB/mmCIF file: 7V1A-1 -<<< Could not download PDB/mmCIF file: 7VKU-1 -<<< Could not download PDB/mmCIF file: 7VRI-1 -<<< Could not download PDB/mmCIF file: 7WKL-1 -<<< Could not download PDB/mmCIF file: 7WUM-1 -<<< Could not download PDB/mmCIF file: 7X4X-2 -<<< Could not download PDB/mmCIF file: 7X6T-1 -<<< Could not download PDB/mmCIF file: 7X8L-1 -<<< Could not download PDB/mmCIF file: 7XAB-1 -<<< Could not download PDB/mmCIF file: 7XC1-2 -<<< Could not download PDB/mmCIF file: 7XE5-1 -<<< Could not download PDB/mmCIF file: 7XFT-1 -<<< Could not download PDB/mmCIF file: 7XGW-3 -<<< Could not download PDB/mmCIF file: 7XI6-1 -<<< Could not download PDB/mmCIF file: 7XL6-1 -<<< Could not download PDB/mmCIF file: 7XNC-1 -<<< Could not download PDB/mmCIF file: 7XPQ-1 -<<< Could not download PDB/mmCIF file: 7XRK-1 -<<< Could not download PDB/mmCIF file: 7XWU-1 -<<< Could not download PDB/mmCIF file: 7XYI-1 -<<< Could not download PDB/mmCIF file: 7XZN-2 -<<< Could not download PDB/mmCIF file: 7Y1C-1 -<<< Could not download PDB/mmCIF file: 7Y4B-2 -<<< Could not download PDB/mmCIF file: 7Y6E-3 -<<< Could not download PDB/mmCIF file: 7Y8K-1 -<<< Could not download PDB/mmCIF file: 7YAC-1 -<<< Could not download PDB/mmCIF file: 7YD1-1 -<<< Could not download 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file: 8AIL-2 -<<< Could not download PDB/mmCIF file: 8AOK-1 -<<< Could not download PDB/mmCIF file: 8AU9-1 -<<< Could not download PDB/mmCIF file: 8AVM-3 -<<< Could not download PDB/mmCIF file: 8AY0-1 -<<< Could not download PDB/mmCIF file: 8B08-1 -<<< Could not download PDB/mmCIF file: 8B75-1 -<<< Could not download PDB/mmCIF file: 8BCQ-3 -<<< Could not download PDB/mmCIF file: 8BE1-1 -<<< Could not download PDB/mmCIF file: 8BFZ-1 -<<< Could not download PDB/mmCIF file: 8BIC-1 -<<< Could not download PDB/mmCIF file: 8BKD-7 -<<< Could not download PDB/mmCIF file: 8BOQ-1 -<<< Could not download PDB/mmCIF file: 8BRR-2 -<<< Could not download PDB/mmCIF file: 8BVB-1 -<<< Could not download PDB/mmCIF file: 8BZO-1 -<<< Could not download PDB/mmCIF file: 8C4N-2 -<<< Could not download PDB/mmCIF file: 8C7X-1 -<<< Could not download PDB/mmCIF file: 8CCZ-2 -<<< Could not download PDB/mmCIF file: 8CO2-1 -<<< Could not download PDB/mmCIF file: 8CUJ-1 -<<< Could not download PDB/mmCIF file: 8CX9-2 -<<< Could not download PDB/mmCIF file: 8D5W-1 -<<< Could not download PDB/mmCIF file: 8D7A-1 -<<< Could not download PDB/mmCIF file: 8DMU-4 -<<< Could not download PDB/mmCIF file: 8DXI-1 -<<< Could not download PDB/mmCIF file: 8E3G-1 -<<< Could not download PDB/mmCIF file: 8EE0-1 -<<< Could not download PDB/mmCIF file: 8EGV-1 -<<< Could not download PDB/mmCIF file: 8EN2-1 -<<< Could not download PDB/mmCIF file: 8EQ7-1 -<<< Could not download PDB/mmCIF file: 8EW9-1 -<<< Could not download PDB/mmCIF file: 8EYK-1 -<<< Could not download PDB/mmCIF file: 8F0Z-1 -<<< Could not download PDB/mmCIF file: 8F3R-1 -<<< Could not download PDB/mmCIF file: 8F6D-3 -<<< Could not download PDB/mmCIF file: 8FA1-1 -<<< Could not download PDB/mmCIF file: 8FCB-1 -<<< Could not download PDB/mmCIF file: 8FFU-1 -<<< Could not download PDB/mmCIF file: 8FK6-1 -<<< Could not download PDB/mmCIF file: 8FM8-1 -<<< Could not download PDB/mmCIF file: 8FQM-1 -<<< Could not download PDB/mmCIF file: 8FUO-1 -<<< Could not download PDB/mmCIF file: 8FZB-1 -<<< Could not download PDB/mmCIF file: 8G36-1 -<<< Could not download PDB/mmCIF file: 8G7I-1 -<<< Could not download PDB/mmCIF file: 8GDS-3 -<<< Could not download PDB/mmCIF file: 8GJV-1 -<<< Could not download PDB/mmCIF file: 8GO8-1 -<<< Could not download PDB/mmCIF file: 8H27-2 -<<< Could not download PDB/mmCIF file: 8H6T-1 -<<< Could not download PDB/mmCIF file: 8HBL-1 -<<< Could not download PDB/mmCIF file: 8HKG-1 -<<< Could not download PDB/mmCIF file: 8HP8-2 -<<< Could not download PDB/mmCIF file: 8I1A-2 -<<< Could not download PDB/mmCIF file: 8I59-1 -<<< Could not download PDB/mmCIF file: 8I8S-1 -<<< Could not download PDB/mmCIF file: 8IFJ-3 -<<< Could not download PDB/mmCIF file: 8IM8-3 -<<< Could not download PDB/mmCIF file: 8IWI-1 -<<< Could not download PDB/mmCIF file: 8JOL-1 -<<< Could not download PDB/mmCIF file: 8OJE-1 -<<< Could not download PDB/mmCIF file: 8OT0-1 -<<< Could not download PDB/mmCIF file: 8P3L-1 -<<< Could not download 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file: 7FZU-1 -<<< Could not download PDB/mmCIF file: 7G0S-1 -<<< Could not download PDB/mmCIF file: 7G80-1 -<<< Could not download PDB/mmCIF file: 7G9E-1 -<<< Could not download PDB/mmCIF file: 7N46-1 -<<< Could not download PDB/mmCIF file: 7QPV-1 -<<< Could not download PDB/mmCIF file: 7QRB-4 -<<< Could not download PDB/mmCIF file: 7R2A-2 -<<< Could not download PDB/mmCIF file: 7R3A-2 -<<< Could not download PDB/mmCIF file: 7RUJ-1 -<<< Could not download PDB/mmCIF file: 7S3P-4 -<<< Could not download PDB/mmCIF file: 7STF-1 -<<< Could not download PDB/mmCIF file: 7TLH-1 -<<< Could not download PDB/mmCIF file: 7TXA-2 -<<< Could not download PDB/mmCIF file: 7TYU-2 -<<< Could not download PDB/mmCIF file: 7UBS-1 -<<< Could not download PDB/mmCIF file: 7UDM-2 -<<< Could not download PDB/mmCIF file: 7UET-1 -<<< Could not download PDB/mmCIF file: 7UG5-3 -<<< Could not download PDB/mmCIF file: 7UI1-2 -<<< Could not download PDB/mmCIF file: 7ULB-1 -<<< Could not download PDB/mmCIF file: 7URX-1 -<<< Could not download PDB/mmCIF file: 7UU6-1 -<<< Could not download PDB/mmCIF file: 7UW3-3 -<<< Could not download PDB/mmCIF file: 7UZ2-1 -<<< Could not download PDB/mmCIF file: 7VRK-1 -<<< Could not download PDB/mmCIF file: 7W8B-1 -<<< Could not download PDB/mmCIF file: 7WKM-1 -<<< Could not download PDB/mmCIF file: 7WUN-1 -<<< Could not download PDB/mmCIF file: 7X4X-3 -<<< Could not download PDB/mmCIF file: 7X8P-1 -<<< Could not download PDB/mmCIF file: 7XAC-1 -<<< Could not download PDB/mmCIF file: 7XE6-1 -<<< Could not download PDB/mmCIF file: 7XFU-1 -<<< Could not download PDB/mmCIF file: 7XGW-4 -<<< Could not download PDB/mmCIF file: 7XL7-1 -<<< Could not download PDB/mmCIF file: 7XND-1 -<<< Could not download PDB/mmCIF file: 7XPR-1 -<<< Could not download PDB/mmCIF file: 7XRL-1 -<<< Could not download PDB/mmCIF file: 7XVH-1 -<<< Could not download PDB/mmCIF file: 7XWU-2 -<<< Could not download PDB/mmCIF file: 7XYJ-1 -<<< Could not download PDB/mmCIF file: 7XZO-1 -<<< Could not download PDB/mmCIF file: 7Y1F-1 -<<< Could not download PDB/mmCIF file: 7Y4C-1 -<<< Could not download PDB/mmCIF file: 7Y6E-4 -<<< Could not download PDB/mmCIF file: 7Y8L-1 -<<< Could not download PDB/mmCIF file: 7YAE-1 -<<< Could not download PDB/mmCIF file: 7YD3-1 -<<< Could not download PDB/mmCIF file: 7YFK-1 -<<< Could not download PDB/mmCIF file: 7YK3-2 -<<< Could not download PDB/mmCIF file: 7YMQ-3 -<<< Could not download PDB/mmCIF file: 7YPN-1 -<<< Could not download PDB/mmCIF file: 7YTH-1 -<<< Could not download PDB/mmCIF file: 7YZ0-1 -<<< Could not download PDB/mmCIF file: 7Z3Y-1 -<<< Could not download PDB/mmCIF file: 7Z5Q-1 -<<< Could not download PDB/mmCIF file: 7Z97-1 -<<< Could not download PDB/mmCIF file: 7ZCA-1 -<<< Could not download PDB/mmCIF file: 7ZG8-2 -<<< Could not download PDB/mmCIF file: 7ZHN-1 -<<< Could not download PDB/mmCIF file: 7ZKX-1 -<<< Could not download PDB/mmCIF file: 7ZLY-1 -<<< Could not download PDB/mmCIF file: 7ZMY-1 -<<< Could not download 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file: 8BCQ-4 -<<< Could not download PDB/mmCIF file: 8BE1-2 -<<< Could not download PDB/mmCIF file: 8BG9-1 -<<< Could not download PDB/mmCIF file: 8BID-1 -<<< Could not download PDB/mmCIF file: 8BKD-8 -<<< Could not download PDB/mmCIF file: 8BOR-1 -<<< Could not download PDB/mmCIF file: 8BRS-1 -<<< Could not download PDB/mmCIF file: 8BVD-1 -<<< Could not download PDB/mmCIF file: 8BZV-1 -<<< Could not download PDB/mmCIF file: 8C4O-1 -<<< Could not download PDB/mmCIF file: 8C7Y-1 -<<< Could not download PDB/mmCIF file: 8CD8-1 -<<< Could not download PDB/mmCIF file: 8CHX-1 -<<< Could not download PDB/mmCIF file: 8CO2-2 -<<< Could not download PDB/mmCIF file: 8CT0-1 -<<< Could not download PDB/mmCIF file: 8CX9-3 -<<< Could not download PDB/mmCIF file: 8D5X-1 -<<< Could not download PDB/mmCIF file: 8D7B-1 -<<< Could not download PDB/mmCIF file: 8D8W-1 -<<< Could not download PDB/mmCIF file: 8DHV-1 -<<< Could not download PDB/mmCIF file: 8DMX-1 -<<< Could not download PDB/mmCIF file: 8DXJ-1 -<<< Could not download PDB/mmCIF file: 8DZB-1 -<<< Could not download PDB/mmCIF file: 8E3G-2 -<<< Could not download PDB/mmCIF file: 8EE1-1 -<<< Could not download PDB/mmCIF file: 8EGV-2 -<<< Could not download PDB/mmCIF file: 8EN3-1 -<<< Could not download PDB/mmCIF file: 8EQ7-2 -<<< Could not download PDB/mmCIF file: 8ESD-1 -<<< Could not download PDB/mmCIF file: 8EYL-1 -<<< Could not download PDB/mmCIF file: 8F10-1 -<<< Could not download PDB/mmCIF file: 8F3S-1 -<<< Could not download PDB/mmCIF file: 8F6D-4 -<<< Could not download PDB/mmCIF file: 8FA2-1 -<<< Could not download PDB/mmCIF file: 8FCC-1 -<<< Could not download PDB/mmCIF file: 8FFU-2 -<<< Could not download PDB/mmCIF file: 8FK8-1 -<<< Could not download PDB/mmCIF file: 8FM8-2 -<<< Could not download PDB/mmCIF file: 8FQM-2 -<<< Could not download PDB/mmCIF file: 8FUQ-1 -<<< Could not download PDB/mmCIF file: 8FZB-2 -<<< Could not download PDB/mmCIF file: 8G39-1 -<<< Could not download PDB/mmCIF file: 8G7J-1 -<<< Could not download PDB/mmCIF file: 8GDS-4 -<<< Could not download PDB/mmCIF file: 8GJV-2 -<<< Could not download PDB/mmCIF file: 8GOA-1 -<<< Could not download PDB/mmCIF file: 8H70-1 -<<< Could not download PDB/mmCIF file: 8HBR-1 -<<< Could not download PDB/mmCIF file: 8HKG-2 -<<< Could not download PDB/mmCIF file: 8HP8-3 -<<< Could not download PDB/mmCIF file: 8I5A-1 -<<< Could not download PDB/mmCIF file: 8I8S-2 -<<< Could not download PDB/mmCIF file: 8IFJ-4 -<<< Could not download PDB/mmCIF file: 8IM8-4 -<<< Could not download PDB/mmCIF file: 8IWL-1 -<<< Could not download PDB/mmCIF file: 8JPA-1 -<<< Could not download PDB/mmCIF file: 8OJE-2 -<<< Could not download PDB/mmCIF file: 8OTB-1 -<<< Could not download PDB/mmCIF file: 8P3L-2 -<<< Could not download PDB/mmCIF file: 8PIF-2 -<<< Could not download PDB/mmCIF file: 8SEV-1 -<<< Could not download PDB/mmCIF file: 8SOY-1 -<<< Could not download PDB/mmCIF file: 7V0I-3 -<<< Could not download PDB/mmCIF file: 8AD2-3 -<<< Could not download 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file: 7TBN-1 -<<< Could not download PDB/mmCIF file: 7TEU-1 -<<< Could not download PDB/mmCIF file: 7TLH-2 -<<< Could not download PDB/mmCIF file: 7TXE-1 -<<< Could not download PDB/mmCIF file: 7UBS-2 -<<< Could not download PDB/mmCIF file: 7UDM-3 -<<< Could not download PDB/mmCIF file: 7UEU-1 -<<< Could not download PDB/mmCIF file: 7UG5-4 -<<< Could not download PDB/mmCIF file: 7UI1-3 -<<< Could not download PDB/mmCIF file: 7ULB-2 -<<< Could not download PDB/mmCIF file: 7UM8-1 -<<< Could not download PDB/mmCIF file: 7UU7-1 -<<< Could not download PDB/mmCIF file: 7UW3-4 -<<< Could not download PDB/mmCIF file: 7UZ2-2 -<<< Could not download PDB/mmCIF file: 7VRK-2 -<<< Could not download PDB/mmCIF file: 7WGE-1 -<<< Could not download PDB/mmCIF file: 7WKO-1 -<<< Could not download PDB/mmCIF file: 7X4Y-1 -<<< Could not download PDB/mmCIF file: 7X8P-2 -<<< Could not download PDB/mmCIF file: 7XAD-1 -<<< Could not download PDB/mmCIF file: 7XE7-1 -<<< Could not download PDB/mmCIF file: 7XGW-5 -<<< Could not download PDB/mmCIF file: 7XJR-1 -<<< Could not download PDB/mmCIF file: 7XPS-1 -<<< Could not download PDB/mmCIF file: 7XRO-1 -<<< Could not download PDB/mmCIF file: 7XVI-1 -<<< Could not download PDB/mmCIF file: 7XWV-1 -<<< Could not download PDB/mmCIF file: 7XYJ-2 -<<< Could not download PDB/mmCIF file: 7XZO-2 -<<< Could not download PDB/mmCIF file: 7Y4D-1 -<<< Could not download PDB/mmCIF file: 7Y6E-5 -<<< Could not download PDB/mmCIF file: 7Y8L-2 -<<< Could not download PDB/mmCIF file: 7YAG-1 -<<< Could not download PDB/mmCIF file: 7YD3-2 -<<< Could not download PDB/mmCIF file: 7YFT-1 -<<< Could not download PDB/mmCIF file: 7YID-1 -<<< Could not download PDB/mmCIF file: 7YK6-1 -<<< Could not download PDB/mmCIF file: 7YMQ-4 -<<< Could not download PDB/mmCIF file: 7YPU-1 -<<< Could not download PDB/mmCIF file: 7YTJ-1 -<<< Could not download PDB/mmCIF file: 7YZ1-1 -<<< Could not download PDB/mmCIF file: 7Z3Y-2 -<<< Could not download PDB/mmCIF file: 7Z5R-1 -<<< Could not download PDB/mmCIF file: 7Z98-1 -<<< Could not download PDB/mmCIF file: 7ZCC-1 -<<< Could not download PDB/mmCIF file: 7ZG9-1 -<<< Could not download PDB/mmCIF file: 7ZHO-1 -<<< Could not download PDB/mmCIF file: 7ZLZ-1 -<<< Could not download PDB/mmCIF file: 7ZQR-1 -<<< Could not download PDB/mmCIF file: 7ZSL-2 -<<< Could not download PDB/mmCIF file: 7ZZ9-1 -<<< Could not download PDB/mmCIF file: 8A1J-1 -<<< Could not download PDB/mmCIF file: 8A2W-1 -<<< Could not download PDB/mmCIF file: 8A4O-1 -<<< Could not download PDB/mmCIF file: 8A5S-1 -<<< Could not download PDB/mmCIF file: 8A7T-1 -<<< Could not download PDB/mmCIF file: 8A9N-1 -<<< Could not download PDB/mmCIF file: 8ABW-1 -<<< Could not download PDB/mmCIF file: 8ADK-1 -<<< Could not download PDB/mmCIF file: 8AGR-1 -<<< Could not download PDB/mmCIF file: 8AIM-2 -<<< Could not download PDB/mmCIF file: 8AOO-1 -<<< Could not download PDB/mmCIF file: 8ARA-1 -<<< Could not download PDB/mmCIF file: 8AUA-2 -<<< Could not download PDB/mmCIF file: 8AVP-1 -<<< Could not download PDB/mmCIF file: 8AY0-3 -<<< Could not download PDB/mmCIF file: 8B78-1 -<<< Could not download PDB/mmCIF file: 8BBL-2 -<<< Could not download PDB/mmCIF file: 8BCQ-5 -<<< Could not download PDB/mmCIF file: 8BE6-1 -<<< Could not download PDB/mmCIF file: 8BID-2 -<<< Could not download PDB/mmCIF file: 8BKF-1 -<<< Could not download PDB/mmCIF file: 8BOR-2 -<<< Could not download PDB/mmCIF file: 8BRT-1 -<<< Could not download PDB/mmCIF file: 8BVD-2 -<<< Could not download PDB/mmCIF file: 8BZX-1 -<<< Could not download PDB/mmCIF file: 8C4O-2 -<<< Could not download PDB/mmCIF file: 8C7Z-1 -<<< Could not download PDB/mmCIF file: 8CD8-2 -<<< Could not download PDB/mmCIF file: 8CI0-1 -<<< Could not download PDB/mmCIF file: 8COB-1 -<<< Could not download PDB/mmCIF file: 8CT0-2 -<<< Could not download PDB/mmCIF file: 8CX9-4 -<<< Could not download PDB/mmCIF file: 8D5Z-1 -<<< Could not download PDB/mmCIF file: 8D7C-1 -<<< Could not download PDB/mmCIF file: 8D8W-2 -<<< Could not download PDB/mmCIF file: 8DHW-1 -<<< Could not download PDB/mmCIF file: 8DJQ-1 -<<< Could not download PDB/mmCIF file: 8DMY-1 -<<< Could not download PDB/mmCIF file: 8DSU-1 -<<< Could not download PDB/mmCIF file: 8DXK-1 -<<< Could not download PDB/mmCIF file: 8DZC-1 -<<< Could not download PDB/mmCIF file: 8E3J-1 -<<< Could not download PDB/mmCIF file: 8EEF-1 -<<< Could not download PDB/mmCIF file: 8EN4-1 -<<< Could not download PDB/mmCIF file: 8EQ8-1 -<<< Could not download PDB/mmCIF file: 8ESE-1 -<<< Could not download PDB/mmCIF file: 8EWD-1 -<<< Could not download PDB/mmCIF file: 8EYM-1 -<<< Could not download PDB/mmCIF file: 8F11-1 -<<< Could not download PDB/mmCIF file: 8F3T-1 -<<< Could not download PDB/mmCIF file: 8F6K-1 -<<< Could not download PDB/mmCIF file: 8FCD-1 -<<< Could not download PDB/mmCIF file: 8FFX-1 -<<< Could not download PDB/mmCIF file: 8FKB-1 -<<< Could not download PDB/mmCIF file: 8FM8-3 -<<< Could not download PDB/mmCIF file: 8FQM-3 -<<< Could not download PDB/mmCIF file: 8FUQ-2 -<<< Could not download PDB/mmCIF file: 8FZB-3 -<<< Could not download PDB/mmCIF file: 8G3A-1 -<<< Could not download PDB/mmCIF file: 8G7M-1 -<<< Could not download PDB/mmCIF file: 8GJV-3 -<<< Could not download PDB/mmCIF file: 8GOB-1 -<<< Could not download PDB/mmCIF file: 8GXP-1 -<<< Could not download PDB/mmCIF file: 8H77-1 -<<< Could not download PDB/mmCIF file: 8HBR-2 -<<< Could not download PDB/mmCIF file: 8HKJ-1 -<<< Could not download PDB/mmCIF file: 8HPJ-1 -<<< Could not download PDB/mmCIF file: 8I1C-1 -<<< Could not download PDB/mmCIF file: 8I5F-1 -<<< Could not download PDB/mmCIF file: 8I8T-1 -<<< Could not download PDB/mmCIF file: 8IFJ-5 -<<< Could not download PDB/mmCIF file: 8IN9-1 -<<< Could not download PDB/mmCIF file: 8IWM-1 -<<< Could not download PDB/mmCIF file: 8JTL-1 -<<< Could not download PDB/mmCIF file: 8OJF-1 -<<< Could not download PDB/mmCIF file: 8OTO-1 -<<< Could not download PDB/mmCIF file: 8P3M-1 -<<< Could not download PDB/mmCIF file: 8PII-1 -<<< Could not download PDB/mmCIF file: 8SEW-1 -<<< Could not download PDB/mmCIF file: 8SPJ-1 -<<< Could not download PDB/mmCIF file: 7V0J-1 -<<< Could not download PDB/mmCIF file: 8AD2-4 -<<< Could not download PDB/mmCIF file: 8B8F-1 -<<< Could not download PDB/mmCIF file: 8DMI-1 -<<< Could not download PDB/mmCIF file: 8EQX-2 -<<< Could not download PDB/mmCIF file: 8FRA-3 -<<< Could not download PDB/mmCIF file: 8GTQ-1 -<<< Could not download PDB/mmCIF file: 8OWF-1 -<<< Could not download PDB/mmCIF file: 7FS7-2 -<<< Could not download PDB/mmCIF file: 7FSO-4 -<<< Could not download PDB/mmCIF file: 7FT1-2 -<<< Could not download PDB/mmCIF file: 7FTD-4 -<<< Could not download PDB/mmCIF file: 7FW7-1 -<<< Could not download PDB/mmCIF file: 7FXI-1 -<<< Could not download PDB/mmCIF file: 7FYM-1 -<<< Could not download PDB/mmCIF file: 7FZV-2 -<<< Could not download PDB/mmCIF file: 7G0U-1 -<<< Could not download PDB/mmCIF file: 7G82-1 -<<< Could not download PDB/mmCIF file: 7G9G-1 -<<< Could not download PDB/mmCIF file: 7N96-1 -<<< Could not download PDB/mmCIF file: 7R2C-1 -<<< Could not download PDB/mmCIF file: 7R3A-4 -<<< Could not download PDB/mmCIF file: 7S3P-6 -<<< Could not download PDB/mmCIF file: 7TBN-2 -<<< Could not download PDB/mmCIF file: 7TLH-3 -<<< Could not download PDB/mmCIF file: 7TME-1 -<<< Could not download PDB/mmCIF file: 7TQM-1 -<<< Could not download PDB/mmCIF file: 7TV2-1 -<<< Could not download PDB/mmCIF file: 7TXF-1 -<<< Could not download PDB/mmCIF file: 7UBT-1 -<<< Could not download PDB/mmCIF file: 7UDN-1 -<<< Could not download PDB/mmCIF file: 7UEV-1 -<<< Could not download PDB/mmCIF file: 7UG8-1 -<<< Could not download PDB/mmCIF file: 7UI1-4 -<<< Could not download PDB/mmCIF file: 7ULB-3 -<<< Could not download PDB/mmCIF file: 7UM9-1 -<<< Could not download PDB/mmCIF file: 7US2-1 -<<< Could not download PDB/mmCIF file: 7UU8-1 -<<< Could not download PDB/mmCIF file: 7UW4-1 -<<< Could not download PDB/mmCIF file: 7VRM-1 -<<< Could not download PDB/mmCIF file: 7VWD-1 -<<< Could not download PDB/mmCIF file: 7WQI-1 -<<< Could not download PDB/mmCIF file: 7WUP-1 -<<< Could not download PDB/mmCIF file: 7X4Z-1 -<<< Could not download PDB/mmCIF file: 7X8Q-1 -<<< Could not download PDB/mmCIF file: 7XAD-2 -<<< Could not download PDB/mmCIF file: 7XGW-6 -<<< Could not download PDB/mmCIF file: 7XLB-1 -<<< Could not download PDB/mmCIF file: 7XNF-1 -<<< Could not download PDB/mmCIF file: 7XPT-1 -<<< Could not download PDB/mmCIF file: 7XRQ-1 -<<< Could not download PDB/mmCIF file: 7XTO-1 -<<< Could not download PDB/mmCIF file: 7XVJ-1 -<<< Could not download PDB/mmCIF file: 7XWW-1 -<<< Could not download PDB/mmCIF file: 7XYK-1 -<<< Could not download PDB/mmCIF file: 7XZP-1 -<<< Could not download PDB/mmCIF file: 7Y4D-2 -<<< Could not download PDB/mmCIF file: 7Y6E-6 -<<< Could not download PDB/mmCIF file: 7Y8L-3 -<<< Could not download PDB/mmCIF file: 7YAH-1 -<<< Could not download PDB/mmCIF file: 7YD3-3 -<<< Could not download PDB/mmCIF file: 7YFT-2 -<<< Could not download PDB/mmCIF file: 7YIE-1 -<<< Could not download PDB/mmCIF file: 7YK7-1 -<<< Could not download PDB/mmCIF file: 7YMQ-5 -<<< Could not download PDB/mmCIF file: 7YPU-2 -<<< Could not download PDB/mmCIF file: 7YZ2-1 -<<< Could not download PDB/mmCIF file: 7Z0I-1 -<<< Could not download PDB/mmCIF file: 7Z3Y-3 -<<< Could not download PDB/mmCIF file: 7Z5R-2 -<<< Could not download PDB/mmCIF file: 7Z99-1 -<<< Could not download PDB/mmCIF file: 7ZCC-2 -<<< Could not download PDB/mmCIF file: 7ZG9-2 -<<< Could not download PDB/mmCIF file: 7ZHP-1 -<<< Could not download PDB/mmCIF file: 7ZJB-1 -<<< Could not download PDB/mmCIF file: 7ZLZ-2 -<<< Could not download PDB/mmCIF file: 7ZN0-1 -<<< Could not download PDB/mmCIF file: 7ZQR-2 -<<< Could not download PDB/mmCIF file: 7ZSM-1 -<<< Could not download PDB/mmCIF file: 7ZUC-1 -<<< Could not download PDB/mmCIF file: 7ZXT-1 -<<< Could not download PDB/mmCIF file: 7ZZA-1 -<<< Could not download PDB/mmCIF file: 8A0A-1 -<<< Could not download PDB/mmCIF file: 8A1J-2 -<<< Could not download PDB/mmCIF file: 8A2W-2 -<<< Could not download PDB/mmCIF file: 8A7U-1 -<<< Could not download PDB/mmCIF file: 8A9O-1 -<<< Could not download PDB/mmCIF file: 8ADK-2 -<<< Could not download PDB/mmCIF file: 8AGR-2 -<<< Could not download PDB/mmCIF file: 8AIN-1 -<<< Could not download PDB/mmCIF file: 8AOP-1 -<<< Could not download PDB/mmCIF file: 8ARA-2 -<<< Could not download PDB/mmCIF file: 8AUB-1 -<<< Could not download PDB/mmCIF file: 8AVP-10 -<<< Could not download PDB/mmCIF file: 8B3M-1 -<<< Could not download PDB/mmCIF file: 8B7G-1 -<<< Could not download PDB/mmCIF file: 8BBL-3 -<<< Could not download PDB/mmCIF file: 8BCR-1 -<<< Could not download PDB/mmCIF file: 8BE7-1 -<<< Could not download PDB/mmCIF file: 8BIE-1 -<<< Could not download PDB/mmCIF file: 8BLL-1 -<<< Could not download PDB/mmCIF file: 8BOV-1 -<<< Could not download PDB/mmCIF file: 8BS3-1 -<<< Could not download PDB/mmCIF file: 8BVD-3 -<<< Could not download PDB/mmCIF file: 8BZY-1 -<<< Could not download PDB/mmCIF file: 8C4P-1 -<<< Could not download PDB/mmCIF file: 8C8C-1 -<<< Could not download PDB/mmCIF file: 8CDA-1 -<<< Could not download PDB/mmCIF file: 8CI7-1 -<<< Could not download PDB/mmCIF file: 8COJ-1 -<<< Could not download PDB/mmCIF file: 8CT0-3 -<<< Could not download PDB/mmCIF file: 8D60-1 -<<< Could not download PDB/mmCIF file: 8D7D-1 -<<< Could not download PDB/mmCIF file: 8D8X-1 -<<< Could not download PDB/mmCIF file: 8DJQ-2 -<<< Could not download PDB/mmCIF file: 8DKZ-1 -<<< Could not download PDB/mmCIF file: 8DN0-1 -<<< Could not download PDB/mmCIF file: 8DXL-1 -<<< Could not download PDB/mmCIF file: 8E3J-2 -<<< Could not download PDB/mmCIF file: 8EEF-2 -<<< Could not download PDB/mmCIF file: 8EH5-1 -<<< Could not download PDB/mmCIF file: 8EK4-1 -<<< Could not download PDB/mmCIF file: 8EN5-1 -<<< Could not download PDB/mmCIF file: 8ESH-1 -<<< Could not download PDB/mmCIF file: 8EWE-1 -<<< Could not download PDB/mmCIF file: 8EYN-1 -<<< Could not download PDB/mmCIF file: 8F12-1 -<<< Could not download PDB/mmCIF file: 8F3U-1 -<<< Could not download PDB/mmCIF file: 8F6L-1 -<<< Could not download PDB/mmCIF file: 8FCE-1 -<<< Could not download PDB/mmCIF file: 8FG0-1 -<<< Could not download PDB/mmCIF file: 8FKL-1 -<<< Could not download PDB/mmCIF file: 8FM8-4 -<<< Could not download PDB/mmCIF file: 8FQM-4 -<<< Could not download PDB/mmCIF file: 8FUQ-3 -<<< Could not download PDB/mmCIF file: 8FZK-1 -<<< Could not download PDB/mmCIF file: 8G3B-1 -<<< Could not download PDB/mmCIF file: 8G7W-1 -<<< Could not download PDB/mmCIF file: 8GEZ-1 -<<< Could not download PDB/mmCIF file: 8GJV-4 -<<< Could not download PDB/mmCIF file: 8GOD-1 -<<< Could not download PDB/mmCIF file: 8GUE-1 -<<< Could not download PDB/mmCIF file: 8GY0-1 -<<< Could not download PDB/mmCIF file: 8H2J-1 -<<< Could not download PDB/mmCIF file: 8H78-1 -<<< Could not download PDB/mmCIF file: 8HBR-3 -<<< Could not download PDB/mmCIF file: 8HFS-1 -<<< Could not download PDB/mmCIF file: 8HKJ-10 -<<< Could not download PDB/mmCIF file: 8HPJ-2 -<<< Could not download PDB/mmCIF file: 8I1C-2 -<<< Could not download PDB/mmCIF file: 8I5H-1 -<<< Could not download PDB/mmCIF file: 8I8T-2 -<<< Could not download PDB/mmCIF file: 8IG0-1 -<<< Could not download PDB/mmCIF file: 8INH-1 -<<< Could not download PDB/mmCIF file: 8IXS-1 -<<< Could not download PDB/mmCIF file: 8JUK-1 -<<< Could not download PDB/mmCIF file: 8OJS-1 -<<< Could not download PDB/mmCIF file: 8OTR-1 -<<< Could not download PDB/mmCIF file: 8P3M-2 -<<< Could not download PDB/mmCIF file: 8PKY-1 -<<< Could not download PDB/mmCIF file: 8SEX-1 -<<< Could not download PDB/mmCIF file: 8SRZ-1 -<<< Could not download PDB/mmCIF file: 7V0J-2 -<<< Could not download PDB/mmCIF file: 8B97-1 -<<< Could not download PDB/mmCIF file: 8FRA-4 -<<< Could not download PDB/mmCIF file: 8OYE-1 -<<< Could not download PDB/mmCIF file: 7FS8-1 -<<< Could not download PDB/mmCIF file: 7FSP-1 -<<< Could not download PDB/mmCIF file: 7FT1-3 -<<< Could not download PDB/mmCIF file: 7FUS-1 -<<< Could not download PDB/mmCIF file: 7FW8-1 -<<< Could not download PDB/mmCIF file: 7FXJ-1 -<<< Could not download PDB/mmCIF file: 7FYO-1 -<<< Could not download PDB/mmCIF file: 7FZW-1 -<<< Could not download PDB/mmCIF file: 7G0V-1 -<<< Could not download PDB/mmCIF file: 7G83-1 -<<< Could not download PDB/mmCIF file: 7G9H-1 -<<< Could not download PDB/mmCIF file: 7QF8-1 -<<< Could not download PDB/mmCIF file: 7QNL-1 -<<< Could not download PDB/mmCIF file: 7R2C-2 -<<< Could not download PDB/mmCIF file: 7RRN-1 -<<< Could not download PDB/mmCIF file: 7S3P-7 -<<< Could not download PDB/mmCIF file: 7SZA-1 -<<< Could not download PDB/mmCIF file: 7TBO-1 -<<< Could not download PDB/mmCIF file: 7TLH-4 -<<< Could not download PDB/mmCIF file: 7TVA-1 -<<< Could not download PDB/mmCIF file: 7TXG-1 -<<< Could not download PDB/mmCIF file: 7U0O-1 -<<< Could not download 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file: 7Y1H-1 -<<< Could not download PDB/mmCIF file: 7Y4E-1 -<<< Could not download PDB/mmCIF file: 7Y6E-7 -<<< Could not download PDB/mmCIF file: 7Y8M-1 -<<< Could not download PDB/mmCIF file: 7YAI-1 -<<< Could not download PDB/mmCIF file: 7YD3-4 -<<< Could not download PDB/mmCIF file: 7YFU-1 -<<< Could not download PDB/mmCIF file: 7YIF-1 -<<< Could not download PDB/mmCIF file: 7YK9-1 -<<< Could not download PDB/mmCIF file: 7YMQ-6 -<<< Could not download PDB/mmCIF file: 7YPU-3 -<<< Could not download PDB/mmCIF file: 7YWP-1 -<<< Could not download PDB/mmCIF file: 7YZ3-1 -<<< Could not download PDB/mmCIF file: 7Z0J-1 -<<< Could not download PDB/mmCIF file: 7Z2K-1 -<<< Could not download PDB/mmCIF file: 7Z41-1 -<<< Could not download PDB/mmCIF file: 7Z5R-3 -<<< Could not download PDB/mmCIF file: 7Z9A-1 -<<< Could not download PDB/mmCIF file: 7ZCD-1 -<<< Could not download PDB/mmCIF file: 7ZGA-1 -<<< Could not download PDB/mmCIF file: 7ZHQ-1 -<<< Could not download PDB/mmCIF file: 7ZLZ-3 -<<< Could not download PDB/mmCIF file: 7ZN3-1 -<<< Could not download PDB/mmCIF file: 7ZQR-3 -<<< Could not download PDB/mmCIF file: 7ZSN-1 -<<< Could not download PDB/mmCIF file: 7ZUC-2 -<<< Could not download PDB/mmCIF file: 7ZZB-1 -<<< Could not download PDB/mmCIF file: 8A0A-2 -<<< Could not download PDB/mmCIF file: 8A1K-1 -<<< Could not download PDB/mmCIF file: 8A5V-1 -<<< Could not download PDB/mmCIF file: 8A7X-1 -<<< Could not download PDB/mmCIF file: 8A9P-1 -<<< Could not download PDB/mmCIF file: 8AC7-1 -<<< Could not download PDB/mmCIF file: 8ADK-3 -<<< Could not download PDB/mmCIF file: 8AH0-1 -<<< Could not download PDB/mmCIF file: 8AOP-2 -<<< Could not download PDB/mmCIF file: 8ARB-1 -<<< Could not download PDB/mmCIF file: 8AUB-2 -<<< Could not download PDB/mmCIF file: 8AVP-2 -<<< Could not download PDB/mmCIF file: 8AY3-1 -<<< Could not download PDB/mmCIF file: 8BBL-4 -<<< Could not download PDB/mmCIF file: 8BCR-2 -<<< Could not download PDB/mmCIF file: 8BE8-1 -<<< Could 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not download PDB/mmCIF file: 7QTZ-1 -<<< Could not download PDB/mmCIF file: 7QVJ-1 -<<< Could not download PDB/mmCIF file: 7S3P-8 -<<< Could not download PDB/mmCIF file: 7SZA-2 -<<< Could not download PDB/mmCIF file: 7TBO-2 -<<< Could not download PDB/mmCIF file: 7TCY-1 -<<< Could not download PDB/mmCIF file: 7TVA-2 -<<< Could not download PDB/mmCIF file: 7U0R-1 -<<< Could not download PDB/mmCIF file: 7UDO-1 -<<< Could not download PDB/mmCIF file: 7UEY-1 -<<< Could not download PDB/mmCIF file: 7UGB-1 -<<< Could not download PDB/mmCIF file: 7UI2-1 -<<< Could not download PDB/mmCIF file: 7UOD-1 -<<< Could not download PDB/mmCIF file: 7UUA-1 -<<< Could not download PDB/mmCIF file: 7VRO-2 -<<< Could not download PDB/mmCIF file: 7WIU-1 -<<< Could not download PDB/mmCIF file: 7WWW-1 -<<< Could not download PDB/mmCIF file: 7X50-1 -<<< Could not download PDB/mmCIF file: 7XAD-4 -<<< Could not download PDB/mmCIF file: 7XE9-1 -<<< Could not download PDB/mmCIF file: 7XGX-2 -<<< Could not download 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not download PDB/mmCIF file: 8DCN-1 -<<< Could not download PDB/mmCIF file: 8DJS-1 -<<< Could not download PDB/mmCIF file: 8DN1-1 -<<< Could not download PDB/mmCIF file: 8DXN-1 -<<< Could not download PDB/mmCIF file: 8E1G-2 -<<< Could not download PDB/mmCIF file: 8E3P-1 -<<< Could not download PDB/mmCIF file: 8EEG-2 -<<< Could not download PDB/mmCIF file: 8EN6-1 -<<< Could not download PDB/mmCIF file: 8F14-1 -<<< Could not download PDB/mmCIF file: 8F6M-2 -<<< Could not download PDB/mmCIF file: 8FAU-1 -<<< Could not download PDB/mmCIF file: 8FCM-1 -<<< Could not download PDB/mmCIF file: 8FG5-1 -<<< Could not download PDB/mmCIF file: 8FKO-2 -<<< Could not download PDB/mmCIF file: 8FMZ-1 -<<< Could not download PDB/mmCIF file: 8FQN-2 -<<< Could not download PDB/mmCIF file: 8FUR-2 -<<< Could not download PDB/mmCIF file: 8FZM-1 -<<< Could not download PDB/mmCIF file: 8G3E-1 -<<< Could not download PDB/mmCIF file: 8G7X-1 -<<< Could not download PDB/mmCIF file: 8GF1-1 -<<< Could not download 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-<<< Could not download PDB/mmCIF file: 8C9J-2 -<<< Could not download PDB/mmCIF file: 8CDA-4 -<<< Could not download PDB/mmCIF file: 8CIE-1 -<<< Could not download PDB/mmCIF file: 8CP2-1 -<<< Could not download PDB/mmCIF file: 8CUO-1 -<<< Could not download PDB/mmCIF file: 8D02-1 -<<< Could not download PDB/mmCIF file: 8D8Z-1 -<<< Could not download PDB/mmCIF file: 8DCN-2 -<<< Could not download PDB/mmCIF file: 8DJT-1 -<<< Could not download PDB/mmCIF file: 8DN6-1 -<<< Could not download PDB/mmCIF file: 8DXU-1 -<<< Could not download PDB/mmCIF file: 8E3P-2 -<<< Could not download PDB/mmCIF file: 8EEH-1 -<<< Could not download PDB/mmCIF file: 8EQH-1 -<<< Could not download PDB/mmCIF file: 8ESX-1 -<<< Could not download PDB/mmCIF file: 8EWI-1 -<<< Could not download PDB/mmCIF file: 8F15-1 -<<< Could not download PDB/mmCIF file: 8F6N-1 -<<< Could not download PDB/mmCIF file: 8FAV-1 -<<< Could not download PDB/mmCIF file: 8FCO-1 -<<< Could not download PDB/mmCIF file: 8FG7-1 -<<< Could 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-<<< Could not download PDB/mmCIF file: 7UZM-1 -<<< Could not download PDB/mmCIF file: 7W3Z-1 -<<< Could not download PDB/mmCIF file: 7W5K-1 -<<< Could not download PDB/mmCIF file: 7WIW-1 -<<< Could not download PDB/mmCIF file: 7WQM-2 -<<< Could not download PDB/mmCIF file: 7WWY-1 -<<< Could not download PDB/mmCIF file: 7X0T-1 -<<< Could not download PDB/mmCIF file: 7X52-1 -<<< Could not download PDB/mmCIF file: 7X79-1 -<<< Could not download PDB/mmCIF file: 7X8T-1 -<<< Could not download PDB/mmCIF file: 7XC9-1 -<<< Could not download PDB/mmCIF file: 7XJV-3 -<<< Could not download PDB/mmCIF file: 7XLI-1 -<<< Could not download PDB/mmCIF file: 7XRX-1 -<<< Could not download PDB/mmCIF file: 7XTR-1 -<<< Could not download PDB/mmCIF file: 7XVK-1 -<<< Could not download PDB/mmCIF file: 7XWX-3 -<<< Could not download PDB/mmCIF file: 7XYM-1 -<<< Could not download PDB/mmCIF file: 7Y1I-3 -<<< Could not download PDB/mmCIF file: 7Y4F-2 -<<< Could not download PDB/mmCIF file: 7Y8N-1 -<<< Could not download PDB/mmCIF file: 7YAN-1 -<<< Could not download PDB/mmCIF file: 7YD9-2 -<<< Could not download PDB/mmCIF file: 7YIR-1 -<<< Could not download PDB/mmCIF file: 7YMR-1 -<<< Could not download PDB/mmCIF file: 7YPV-2 -<<< Could not download PDB/mmCIF file: 7YXT-3 -<<< Could not download PDB/mmCIF file: 7YZ8-1 -<<< Could not download PDB/mmCIF file: 7Z0K-2 -<<< Could not download PDB/mmCIF file: 7Z2L-2 -<<< Could not download PDB/mmCIF file: 7Z4P-1 -<<< Could not download PDB/mmCIF file: 7ZGD-1 -<<< Could not download PDB/mmCIF file: 7ZL5-1 -<<< Could not download PDB/mmCIF file: 7ZNA-1 -<<< Could not download PDB/mmCIF file: 7ZQU-1 -<<< Could not download PDB/mmCIF file: 7ZSQ-1 -<<< Could not download PDB/mmCIF file: 7ZW2-1 -<<< Could not download PDB/mmCIF file: 7ZZE-1 -<<< Could not download PDB/mmCIF file: 8A1L-2 -<<< Could not download PDB/mmCIF file: 8A4U-2 -<<< Could not download PDB/mmCIF file: 8A5V-4 -<<< Could not download PDB/mmCIF file: 8A85-1 -<<< Could not download 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file: 8C0J-1 -<<< Could not download PDB/mmCIF file: 8C4R-1 -<<< Could not download PDB/mmCIF file: 8C9K-1 -<<< Could not download PDB/mmCIF file: 8CDF-1 -<<< Could not download PDB/mmCIF file: 8CIF-1 -<<< Could not download PDB/mmCIF file: 8CP2-2 -<<< Could not download PDB/mmCIF file: 8CUP-1 -<<< Could not download PDB/mmCIF file: 8D1P-1 -<<< Could not download PDB/mmCIF file: 8D8Z-2 -<<< Could not download PDB/mmCIF file: 8DJU-1 -<<< Could not download PDB/mmCIF file: 8DL5-1 -<<< Could not download PDB/mmCIF file: 8DN6-2 -<<< Could not download PDB/mmCIF file: 8DOV-1 -<<< Could not download PDB/mmCIF file: 8DUZ-1 -<<< Could not download PDB/mmCIF file: 8DY0-1 -<<< Could not download PDB/mmCIF file: 8DZP-1 -<<< Could not download PDB/mmCIF file: 8E3Q-1 -<<< Could not download PDB/mmCIF file: 8E9F-1 -<<< Could not download PDB/mmCIF file: 8EEH-2 -<<< Could not download PDB/mmCIF file: 8EQI-1 -<<< Could not download PDB/mmCIF file: 8ESY-1 -<<< Could not download PDB/mmCIF file: 8EWL-1 -<<< Could not download PDB/mmCIF file: 8F15-2 -<<< Could not download PDB/mmCIF file: 8F6N-2 -<<< Could not download PDB/mmCIF file: 8FAV-2 -<<< Could not download PDB/mmCIF file: 8FCT-1 -<<< Could not download PDB/mmCIF file: 8FG8-1 -<<< Could not download PDB/mmCIF file: 8FLG-1 -<<< Could not download PDB/mmCIF file: 8FN1-1 -<<< Could not download PDB/mmCIF file: 8FQO-2 -<<< Could not download PDB/mmCIF file: 8FUX-1 -<<< Could not download PDB/mmCIF file: 8FZY-1 -<<< Could not download PDB/mmCIF file: 8G3I-1 -<<< Could not download PDB/mmCIF file: 8G8F-1 -<<< Could not download PDB/mmCIF file: 8GF6-1 -<<< Could not download PDB/mmCIF file: 8GJZ-1 -<<< Could not download PDB/mmCIF file: 8GOM-1 -<<< Could not download PDB/mmCIF file: 8GYJ-1 -<<< Could not download PDB/mmCIF file: 8H2T-1 -<<< Could not download PDB/mmCIF file: 8H7F-1 -<<< Could not download PDB/mmCIF file: 8HBS-1 -<<< Could not download PDB/mmCIF file: 8HG5-1 -<<< Could not download PDB/mmCIF file: 8HKJ-3 -<<< Could not download PDB/mmCIF file: 8HS3-1 -<<< Could not download PDB/mmCIF file: 8I1E-2 -<<< Could not download PDB/mmCIF file: 8I5O-1 -<<< Could not download PDB/mmCIF file: 8IA4-1 -<<< Could not download PDB/mmCIF file: 8IGN-1 -<<< Could not download PDB/mmCIF file: 8IO8-1 -<<< Could not download PDB/mmCIF file: 8J0Q-1 -<<< Could not download PDB/mmCIF file: 8OJV-1 -<<< Could not download PDB/mmCIF file: 8OUP-2 -<<< Could not download PDB/mmCIF file: 8P3M-6 -<<< Could not download PDB/mmCIF file: 8SGD-1 -<<< Could not download PDB/mmCIF file: 8ST7-2 -<<< Could not download PDB/mmCIF file: 7WL5-1 -<<< Could not download PDB/mmCIF file: 7ZNR-1 -<<< Could not download PDB/mmCIF file: 8AEV-1 -<<< Could not download PDB/mmCIF file: 8DE4-1 -<<< Could not download PDB/mmCIF file: 8DV4-1 -<<< Could not download PDB/mmCIF file: 8ET8-1 -<<< Could not download PDB/mmCIF file: 8FRB-4 -<<< Could not download PDB/mmCIF file: 5SMJ-1 -<<< Could not download PDB/mmCIF file: 7F96-1 -<<< Could not download 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file: 7UI7-1 -<<< Could not download PDB/mmCIF file: 7ULE-1 -<<< Could not download PDB/mmCIF file: 7UOI-1 -<<< Could not download PDB/mmCIF file: 7UUD-1 -<<< Could not download PDB/mmCIF file: 7UXV-1 -<<< Could not download PDB/mmCIF file: 7W40-1 -<<< Could not download PDB/mmCIF file: 7W5L-1 -<<< Could not download PDB/mmCIF file: 7WQQ-1 -<<< Could not download PDB/mmCIF file: 7WZ5-1 -<<< Could not download PDB/mmCIF file: 7X0X-1 -<<< Could not download PDB/mmCIF file: 7X53-1 -<<< Could not download PDB/mmCIF file: 7X8T-2 -<<< Could not download PDB/mmCIF file: 7XCA-1 -<<< Could not download PDB/mmCIF file: 7XH2-1 -<<< Could not download PDB/mmCIF file: 7XJV-4 -<<< Could not download PDB/mmCIF file: 7XLJ-1 -<<< Could not download PDB/mmCIF file: 7XRX-2 -<<< Could not download PDB/mmCIF file: 7XTR-2 -<<< Could not download PDB/mmCIF file: 7XVR-1 -<<< Could not download PDB/mmCIF file: 7XWX-4 -<<< Could not download PDB/mmCIF file: 7XYO-1 -<<< Could not download PDB/mmCIF file: 7Y1J-1 -<<< Could not download PDB/mmCIF file: 7Y4G-1 -<<< Could not download PDB/mmCIF file: 7Y6O-1 -<<< Could not download PDB/mmCIF file: 7Y8O-1 -<<< Could not download PDB/mmCIF file: 7YAN-2 -<<< Could not download PDB/mmCIF file: 7YDA-1 -<<< Could not download PDB/mmCIF file: 7YIS-1 -<<< Could not download PDB/mmCIF file: 7YMR-2 -<<< Could not download PDB/mmCIF file: 7YPV-3 -<<< Could not download PDB/mmCIF file: 7YTT-1 -<<< Could not download PDB/mmCIF file: 7YXT-4 -<<< Could not download PDB/mmCIF file: 7YZ8-10 -<<< Could not download PDB/mmCIF file: 7Z2L-3 -<<< Could not download PDB/mmCIF file: 7ZJG-1 -<<< Could not download PDB/mmCIF file: 7ZL5-2 -<<< Could not download PDB/mmCIF file: 7ZNB-1 -<<< Could not download PDB/mmCIF file: 7ZOZ-1 -<<< Could not download PDB/mmCIF file: 7ZSR-1 -<<< Could not download PDB/mmCIF file: 7ZW3-1 -<<< Could not download PDB/mmCIF file: 7ZZF-1 -<<< Could not download PDB/mmCIF file: 8A0C-1 -<<< Could not download PDB/mmCIF file: 8A1M-1 -<<< Could not download PDB/mmCIF file: 8A4U-3 -<<< Could not download PDB/mmCIF file: 8A5W-1 -<<< Could not download PDB/mmCIF file: 8A85-2 -<<< Could not download PDB/mmCIF file: 8ACA-1 -<<< Could not download PDB/mmCIF file: 8AFF-10 -<<< Could not download PDB/mmCIF file: 8AIS-2 -<<< Could not download PDB/mmCIF file: 8AMH-1 -<<< Could not download PDB/mmCIF file: 8AOQ-3 -<<< Could not download PDB/mmCIF file: 8ARC-1 -<<< Could not download PDB/mmCIF file: 8AUE-1 -<<< Could not download PDB/mmCIF file: 8AVP-6 -<<< Could not download PDB/mmCIF file: 8AY9-1 -<<< Could not download PDB/mmCIF file: 8B0M-1 -<<< Could not download PDB/mmCIF file: 8B9M-1 -<<< Could not download PDB/mmCIF file: 8BBL-8 -<<< Could not download PDB/mmCIF file: 8BCT-3 -<<< Could not download PDB/mmCIF file: 8BED-1 -<<< Could not download PDB/mmCIF file: 8BIG-3 -<<< Could not download PDB/mmCIF file: 8BLL-6 -<<< Could not download PDB/mmCIF file: 8BPH-1 -<<< Could not download PDB/mmCIF file: 8BS9-2 -<<< Could not download 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file: 8E3S-1 -<<< Could not download PDB/mmCIF file: 8E6G-1 -<<< Could not download PDB/mmCIF file: 8EEI-1 -<<< Could not download PDB/mmCIF file: 8EK9-1 -<<< Could not download PDB/mmCIF file: 8ENB-1 -<<< Could not download PDB/mmCIF file: 8EQI-2 -<<< Could not download PDB/mmCIF file: 8ET4-1 -<<< Could not download PDB/mmCIF file: 8EWM-1 -<<< Could not download PDB/mmCIF file: 8F15-3 -<<< Could not download PDB/mmCIF file: 8F6O-1 -<<< Could not download PDB/mmCIF file: 8FAX-1 -<<< Could not download PDB/mmCIF file: 8FCY-1 -<<< Could not download PDB/mmCIF file: 8FG8-2 -<<< Could not download PDB/mmCIF file: 8FLH-1 -<<< Could not download PDB/mmCIF file: 8FN5-1 -<<< Could not download PDB/mmCIF file: 8FQP-1 -<<< Could not download PDB/mmCIF file: 8FUX-2 -<<< Could not download PDB/mmCIF file: 8FZY-2 -<<< Could not download PDB/mmCIF file: 8G3I-2 -<<< Could not download PDB/mmCIF file: 8G8K-1 -<<< Could not download PDB/mmCIF file: 8GF8-1 -<<< Could not download PDB/mmCIF file: 8GK0-1 -<<< Could not download PDB/mmCIF file: 8GON-1 -<<< Could not download PDB/mmCIF file: 8GRI-1 -<<< Could not download PDB/mmCIF file: 8GYN-1 -<<< Could not download PDB/mmCIF file: 8H2X-1 -<<< Could not download PDB/mmCIF file: 8H7F-2 -<<< Could not download PDB/mmCIF file: 8HBV-1 -<<< Could not download PDB/mmCIF file: 8HG6-1 -<<< Could not download PDB/mmCIF file: 8HKJ-4 -<<< Could not download PDB/mmCIF file: 8HSC-1 -<<< Could not download PDB/mmCIF file: 8I1F-1 -<<< Could not download PDB/mmCIF file: 8I5R-1 -<<< Could not download PDB/mmCIF file: 8IA5-1 -<<< Could not download PDB/mmCIF file: 8IGO-1 -<<< Could not download PDB/mmCIF file: 8IOA-1 -<<< Could not download PDB/mmCIF file: 8J18-1 -<<< Could not download PDB/mmCIF file: 8OKK-1 -<<< Could not download PDB/mmCIF file: 8OUU-1 -<<< Could not download PDB/mmCIF file: 8P3M-7 -<<< Could not download PDB/mmCIF file: 8SGD-2 -<<< Could not download PDB/mmCIF file: 8ST8-1 -<<< Could not download PDB/mmCIF file: 7Z3K-1 -<<< Could not download PDB/mmCIF file: 7ZNR-2 -<<< Could not download PDB/mmCIF file: 8AEZ-1 -<<< Could not download PDB/mmCIF file: 8DF1-1 -<<< Could not download PDB/mmCIF file: 8DV4-2 -<<< Could not download PDB/mmCIF file: 8EUQ-1 -<<< Could not download PDB/mmCIF file: 8FRC-1 -<<< Could not download PDB/mmCIF file: 8H00-1 -<<< Could not download PDB/mmCIF file: 8PCX-1 -<<< Could not download PDB/mmCIF file: 7F97-1 -<<< Could not download PDB/mmCIF file: 7FSA-2 -<<< Could not download PDB/mmCIF file: 7FSQ-2 -<<< Could not download PDB/mmCIF file: 7FT2-4 -<<< Could not download PDB/mmCIF file: 7FUX-1 -<<< Could not download PDB/mmCIF file: 7FWD-1 -<<< Could not download PDB/mmCIF file: 7FXO-1 -<<< Could not download PDB/mmCIF file: 7FYT-1 -<<< Could not download PDB/mmCIF file: 7G00-10 -<<< Could not download PDB/mmCIF file: 7G0X-1 -<<< Could not download PDB/mmCIF file: 7G88-1 -<<< Could not download PDB/mmCIF file: 7PA6-1 -<<< Could not download PDB/mmCIF file: 7QOV-1 -<<< Could not download 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-<<< Could not download PDB/mmCIF file: 7Y6W-1 -<<< Could not download PDB/mmCIF file: 7Y8S-1 -<<< Could not download PDB/mmCIF file: 7YAQ-1 -<<< Could not download PDB/mmCIF file: 7YDA-2 -<<< Could not download PDB/mmCIF file: 7YIT-1 -<<< Could not download PDB/mmCIF file: 7YL4-1 -<<< Could not download PDB/mmCIF file: 7YMR-3 -<<< Could not download PDB/mmCIF file: 7YPV-4 -<<< Could not download PDB/mmCIF file: 7YTU-1 -<<< Could not download PDB/mmCIF file: 7YXU-1 -<<< Could not download PDB/mmCIF file: 7YZ8-11 -<<< Could not download PDB/mmCIF file: 7Z0Q-1 -<<< Could not download PDB/mmCIF file: 7Z2L-4 -<<< Could not download PDB/mmCIF file: 7ZCT-1 -<<< Could not download PDB/mmCIF file: 7ZJH-1 -<<< Could not download PDB/mmCIF file: 7ZL6-1 -<<< Could not download PDB/mmCIF file: 7ZNC-1 -<<< Could not download PDB/mmCIF file: 7ZW4-1 -<<< Could not download PDB/mmCIF file: 7ZY1-1 -<<< Could not download PDB/mmCIF file: 7ZZG-1 -<<< Could not download PDB/mmCIF file: 8A0E-1 -<<< Could 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-<<< Could not download PDB/mmCIF file: 8H2X-2 -<<< Could not download PDB/mmCIF file: 8H7H-1 -<<< Could not download PDB/mmCIF file: 8HBW-1 -<<< Could not download PDB/mmCIF file: 8HKJ-5 -<<< Could not download PDB/mmCIF file: 8HSH-1 -<<< Could not download PDB/mmCIF file: 8I1F-2 -<<< Could not download PDB/mmCIF file: 8I5S-1 -<<< Could not download PDB/mmCIF file: 8IA8-1 -<<< Could not download PDB/mmCIF file: 8IGU-1 -<<< Could not download PDB/mmCIF file: 8IOM-1 -<<< Could not download PDB/mmCIF file: 8J19-1 -<<< Could not download PDB/mmCIF file: 8OKL-1 -<<< Could not download PDB/mmCIF file: 8OUU-2 -<<< Could not download PDB/mmCIF file: 8P3M-8 -<<< Could not download PDB/mmCIF file: 8SGH-1 -<<< Could not download PDB/mmCIF file: 8ST9-1 -<<< Could not download PDB/mmCIF file: 7Z3L-1 -<<< Could not download PDB/mmCIF file: 7ZNS-1 -<<< Could not download PDB/mmCIF file: 8AFO-1 -<<< Could not download PDB/mmCIF file: 8CWI-1 -<<< Could not download PDB/mmCIF file: 8DF1-2 -<<< Could not download PDB/mmCIF file: 8DVL-1 -<<< Could not download PDB/mmCIF file: 8EUQ-2 -<<< Could not download PDB/mmCIF file: 8FRC-2 -<<< Could not download PDB/mmCIF file: 8PDT-1 -<<< Could not download PDB/mmCIF file: 5SML-1 -<<< Could not download PDB/mmCIF file: 7F97-2 -<<< Could not download PDB/mmCIF file: 7FSB-1 -<<< Could not download PDB/mmCIF file: 7FSQ-3 -<<< Could not download PDB/mmCIF file: 7FT3-1 -<<< Could not download PDB/mmCIF file: 7FUY-1 -<<< Could not download PDB/mmCIF file: 7FWE-1 -<<< Could not download PDB/mmCIF file: 7FXO-2 -<<< Could not download PDB/mmCIF file: 7FYU-1 -<<< Could not download PDB/mmCIF file: 7G00-11 -<<< Could not download PDB/mmCIF file: 7G0Y-1 -<<< Could not download PDB/mmCIF file: 7G89-1 -<<< Could not download PDB/mmCIF file: 7PA6-2 -<<< Could not download PDB/mmCIF file: 7QRJ-2 -<<< Could not download PDB/mmCIF file: 7QSG-2 -<<< Could not download PDB/mmCIF file: 7QU4-2 -<<< Could not download PDB/mmCIF file: 7QVN-1 -<<< Could not download 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file: 7WOI-2 -<<< Could not download PDB/mmCIF file: 7WQR-2 -<<< Could not download PDB/mmCIF file: 7WUY-1 -<<< Could not download PDB/mmCIF file: 7WX1-1 -<<< Could not download PDB/mmCIF file: 7X3L-1 -<<< Could not download PDB/mmCIF file: 7X5B-1 -<<< Could not download PDB/mmCIF file: 7X7H-1 -<<< Could not download PDB/mmCIF file: 7X8T-4 -<<< Could not download PDB/mmCIF file: 7XCC-1 -<<< Could not download PDB/mmCIF file: 7XEE-1 -<<< Could not download PDB/mmCIF file: 7XG7-1 -<<< Could not download PDB/mmCIF file: 7XIK-1 -<<< Could not download PDB/mmCIF file: 7XJW-2 -<<< Could not download PDB/mmCIF file: 7XTS-2 -<<< Could not download PDB/mmCIF file: 7XVU-1 -<<< Could not download PDB/mmCIF file: 7XX0-2 -<<< Could not download PDB/mmCIF file: 7XYR-1 -<<< Could not download PDB/mmCIF file: 7Y1U-1 -<<< Could not download PDB/mmCIF file: 7Y4H-1 -<<< Could not download PDB/mmCIF file: 7Y6X-1 -<<< Could not download PDB/mmCIF file: 7YDB-1 -<<< Could not download PDB/mmCIF file: 7YIU-1 -<<< Could not download PDB/mmCIF file: 7YL4-2 -<<< Could not download PDB/mmCIF file: 7YMR-4 -<<< Could not download PDB/mmCIF file: 7YTW-1 -<<< Could not download PDB/mmCIF file: 7YZ8-12 -<<< Could not download PDB/mmCIF file: 7Z2M-1 -<<< Could not download PDB/mmCIF file: 7Z4S-1 -<<< Could not download PDB/mmCIF file: 7ZCT-2 -<<< Could not download PDB/mmCIF file: 7ZJI-1 -<<< Could not download PDB/mmCIF file: 7ZND-1 -<<< Could not download PDB/mmCIF file: 7ZSU-1 -<<< Could not download PDB/mmCIF file: 7ZW5-1 -<<< Could not download PDB/mmCIF file: 7ZZH-1 -<<< Could not download PDB/mmCIF file: 8A0F-1 -<<< Could not download PDB/mmCIF file: 8A1N-1 -<<< Could not download PDB/mmCIF file: 8A4V-1 -<<< Could not download PDB/mmCIF file: 8A5W-3 -<<< Could not download PDB/mmCIF file: 8ACG-1 -<<< Could not download PDB/mmCIF file: 8AFF-12 -<<< Could not download PDB/mmCIF file: 8AH4-2 -<<< Could not download PDB/mmCIF file: 8AIT-1 -<<< Could not download PDB/mmCIF file: 8AMO-1 -<<< Could not download PDB/mmCIF file: 8ARE-1 -<<< Could not download PDB/mmCIF file: 8AUF-1 -<<< Could not download PDB/mmCIF file: 8AVP-8 -<<< Could not download PDB/mmCIF file: 8AYB-1 -<<< Could not download PDB/mmCIF file: 8B0O-1 -<<< Could not download PDB/mmCIF file: 8B47-1 -<<< Could not download PDB/mmCIF file: 8B7V-1 -<<< Could not download PDB/mmCIF file: 8B9U-1 -<<< Could not download PDB/mmCIF file: 8BBO-1 -<<< Could not download PDB/mmCIF file: 8BCY-1 -<<< Could not download PDB/mmCIF file: 8BGN-1 -<<< Could not download PDB/mmCIF file: 8BIH-1 -<<< Could not download PDB/mmCIF file: 8BLL-8 -<<< Could not download PDB/mmCIF file: 8BPL-1 -<<< Could not download PDB/mmCIF file: 8BSA-2 -<<< Could not download PDB/mmCIF file: 8BVL-1 -<<< Could not download PDB/mmCIF file: 8C0N-2 -<<< Could not download PDB/mmCIF file: 8C5D-1 -<<< Could not download PDB/mmCIF file: 8C9S-1 -<<< Could not download PDB/mmCIF file: 8CDP-1 -<<< Could not download PDB/mmCIF file: 8CIP-1 -<<< Could not download 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-<<< Could not download PDB/mmCIF file: 8IGV-1 -<<< Could not download PDB/mmCIF file: 8IP3-1 -<<< Could not download PDB/mmCIF file: 8J1A-1 -<<< Could not download PDB/mmCIF file: 8ODQ-1 -<<< Could not download PDB/mmCIF file: 8OKM-1 -<<< Could not download PDB/mmCIF file: 8OUV-1 -<<< Could not download PDB/mmCIF file: 8P4Z-1 -<<< Could not download PDB/mmCIF file: 8SHI-1 -<<< Could not download PDB/mmCIF file: 8ST9-2 -<<< Could not download PDB/mmCIF file: 7WNB-1 -<<< Could not download PDB/mmCIF file: 7XJ8-1 -<<< Could not download PDB/mmCIF file: 7Y5N-1 -<<< Could not download PDB/mmCIF file: 7ZNS-2 -<<< Could not download PDB/mmCIF file: 8CWJ-1 -<<< Could not download PDB/mmCIF file: 8DF1-3 -<<< Could not download PDB/mmCIF file: 8DVM-1 -<<< Could not download PDB/mmCIF file: 8EW1-1 -<<< Could not download PDB/mmCIF file: 8FRD-1 -<<< Could not download PDB/mmCIF file: 8PE9-1 -<<< Could not download PDB/mmCIF file: 5SMM-1 -<<< Could not download PDB/mmCIF file: 7FSB-2 -<<< Could not download PDB/mmCIF file: 7FSQ-4 -<<< Could not download PDB/mmCIF file: 7FT3-2 -<<< Could not download PDB/mmCIF file: 7FUZ-1 -<<< Could not download PDB/mmCIF file: 7FWF-1 -<<< Could not download PDB/mmCIF file: 7FXP-1 -<<< Could not download PDB/mmCIF file: 7FYV-1 -<<< Could not download PDB/mmCIF file: 7G00-12 -<<< Could not download PDB/mmCIF file: 7G0Z-1 -<<< Could not download PDB/mmCIF file: 7G8A-1 -<<< Could not download PDB/mmCIF file: 7N4O-1 -<<< Could not download PDB/mmCIF file: 7PA7-1 -<<< Could not download PDB/mmCIF file: 7PV5-1 -<<< Could not download PDB/mmCIF file: 7QOX-1 -<<< Could not download PDB/mmCIF file: 7QRK-1 -<<< Could not download PDB/mmCIF file: 7QSI-1 -<<< Could not download PDB/mmCIF file: 7QVO-1 -<<< Could not download PDB/mmCIF file: 7QWN-1 -<<< Could not download PDB/mmCIF file: 7R2I-1 -<<< Could not download PDB/mmCIF file: 7RIG-1 -<<< Could not download PDB/mmCIF file: 7S2I-1 -<<< Could not download PDB/mmCIF file: 7SJU-1 -<<< Could not download 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file: 7X8U-1 -<<< Could not download PDB/mmCIF file: 7XCD-1 -<<< Could not download PDB/mmCIF file: 7XEF-1 -<<< Could not download PDB/mmCIF file: 7XG7-2 -<<< Could not download PDB/mmCIF file: 7XIL-1 -<<< Could not download PDB/mmCIF file: 7XJW-3 -<<< Could not download PDB/mmCIF file: 7XRZ-1 -<<< Could not download PDB/mmCIF file: 7XTT-1 -<<< Could not download PDB/mmCIF file: 7XVU-2 -<<< Could not download PDB/mmCIF file: 7XX1-1 -<<< Could not download PDB/mmCIF file: 7Y1W-1 -<<< Could not download PDB/mmCIF file: 7Y6X-2 -<<< Could not download PDB/mmCIF file: 7YDB-2 -<<< Could not download PDB/mmCIF file: 7YIY-1 -<<< Could not download PDB/mmCIF file: 7YL5-1 -<<< Could not download PDB/mmCIF file: 7YQ0-1 -<<< Could not download PDB/mmCIF file: 7YTY-1 -<<< Could not download PDB/mmCIF file: 7YZ8-2 -<<< Could not download PDB/mmCIF file: 7Z2M-2 -<<< Could not download PDB/mmCIF file: 7Z4T-1 -<<< Could not download PDB/mmCIF file: 7ZJJ-1 -<<< Could not download PDB/mmCIF file: 7ZNE-1 -<<< Could not download PDB/mmCIF file: 7ZSU-2 -<<< Could not download PDB/mmCIF file: 7ZUM-1 -<<< Could not download PDB/mmCIF file: 7ZW7-1 -<<< Could not download PDB/mmCIF file: 7ZY3-1 -<<< Could not download PDB/mmCIF file: 7ZZJ-1 -<<< Could not download PDB/mmCIF file: 8A0G-1 -<<< Could not download PDB/mmCIF file: 8A1N-2 -<<< Could not download PDB/mmCIF file: 8A33-1 -<<< Could not download PDB/mmCIF file: 8A4V-2 -<<< Could not download PDB/mmCIF file: 8A5W-4 -<<< Could not download PDB/mmCIF file: 8A8D-1 -<<< Could not download PDB/mmCIF file: 8A9V-1 -<<< Could not download PDB/mmCIF file: 8ACG-2 -<<< Could not download PDB/mmCIF file: 8AFF-2 -<<< Could not download PDB/mmCIF file: 8AH4-3 -<<< Could not download PDB/mmCIF file: 8AIW-1 -<<< Could not download PDB/mmCIF file: 8AMP-1 -<<< Could not download PDB/mmCIF file: 8AUG-1 -<<< Could not download PDB/mmCIF file: 8AVP-9 -<<< Could not download PDB/mmCIF file: 8AYC-1 -<<< Could not download PDB/mmCIF file: 8B0P-1 -<<< Could not download PDB/mmCIF file: 8B9W-1 -<<< Could not download PDB/mmCIF file: 8BCZ-1 -<<< Could not download PDB/mmCIF file: 8BGP-1 -<<< Could not download PDB/mmCIF file: 8BIH-2 -<<< Could not download PDB/mmCIF file: 8BLM-1 -<<< Could not download PDB/mmCIF file: 8BPN-1 -<<< Could not download PDB/mmCIF file: 8BSB-1 -<<< Could not download PDB/mmCIF file: 8BVL-2 -<<< Could not download PDB/mmCIF file: 8C0N-3 -<<< Could not download PDB/mmCIF file: 8C5E-1 -<<< Could not download PDB/mmCIF file: 8C9T-1 -<<< Could not download PDB/mmCIF file: 8CDQ-1 -<<< Could not download PDB/mmCIF file: 8CIP-2 -<<< Could not download PDB/mmCIF file: 8CPH-1 -<<< Could not download PDB/mmCIF file: 8CT8-2 -<<< Could not download PDB/mmCIF file: 8CUR-1 -<<< Could not download PDB/mmCIF file: 8CXJ-3 -<<< Could not download PDB/mmCIF file: 8D1T-1 -<<< Could not download PDB/mmCIF file: 8D91-2 -<<< Could not download PDB/mmCIF file: 8DE8-1 -<<< Could not download PDB/mmCIF file: 8DGD-1 -<<< Could not download 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file: 8G3L-1 -<<< Could not download PDB/mmCIF file: 8G94-1 -<<< Could not download PDB/mmCIF file: 8GFB-1 -<<< Could not download PDB/mmCIF file: 8GLB-1 -<<< Could not download PDB/mmCIF file: 8GP6-1 -<<< Could not download PDB/mmCIF file: 8GRS-1 -<<< Could not download PDB/mmCIF file: 8H2X-4 -<<< Could not download PDB/mmCIF file: 8H7T-1 -<<< Could not download PDB/mmCIF file: 8HCQ-1 -<<< Could not download PDB/mmCIF file: 8HGV-1 -<<< Could not download PDB/mmCIF file: 8HKJ-7 -<<< Could not download PDB/mmCIF file: 8HTW-1 -<<< Could not download PDB/mmCIF file: 8I1G-2 -<<< Could not download PDB/mmCIF file: 8I5W-1 -<<< Could not download PDB/mmCIF file: 8IAN-2 -<<< Could not download PDB/mmCIF file: 8II1-1 -<<< Could not download PDB/mmCIF file: 8IP4-1 -<<< Could not download PDB/mmCIF file: 8J1N-1 -<<< Could not download PDB/mmCIF file: 8ODR-1 -<<< Could not download PDB/mmCIF file: 8OKN-1 -<<< Could not download PDB/mmCIF file: 8OUV-2 -<<< Could not download PDB/mmCIF file: 8P4Z-2 -<<< Could not download PDB/mmCIF file: 8SHI-2 -<<< Could not download PDB/mmCIF file: 8STE-1 -<<< Could not download PDB/mmCIF file: 7TKZ-1 -<<< Could not download PDB/mmCIF file: 7XJF-1 -<<< Could not download PDB/mmCIF file: 7ZNV-1 -<<< Could not download PDB/mmCIF file: 8CWJ-2 -<<< Could not download PDB/mmCIF file: 8DF1-4 -<<< Could not download PDB/mmCIF file: 8DVN-1 -<<< Could not download PDB/mmCIF file: 8EW1-2 -<<< Could not download PDB/mmCIF file: 8FRD-2 -<<< Could not download PDB/mmCIF file: 8PED-1 -<<< Could not download PDB/mmCIF file: 5SMN-1 -<<< Could not download PDB/mmCIF file: 7FSC-1 -<<< Could not download PDB/mmCIF file: 7FSR-1 -<<< Could not download PDB/mmCIF file: 7FT3-3 -<<< Could not download PDB/mmCIF file: 7FV0-1 -<<< Could not download PDB/mmCIF file: 7FWG-1 -<<< Could not download PDB/mmCIF file: 7FXQ-1 -<<< Could not download PDB/mmCIF file: 7FYW-1 -<<< Could not download PDB/mmCIF file: 7G00-13 -<<< Could not download PDB/mmCIF file: 7G10-1 -<<< Could not download PDB/mmCIF file: 7G8B-1 -<<< Could not download PDB/mmCIF file: 7LOY-3 -<<< Could not download PDB/mmCIF file: 7OYM-1 -<<< Could not download PDB/mmCIF file: 7PA7-2 -<<< Could not download PDB/mmCIF file: 7PD5-1 -<<< Could not download PDB/mmCIF file: 7PRX-1 -<<< Could not download PDB/mmCIF file: 7PV5-2 -<<< Could not download PDB/mmCIF file: 7QDX-1 -<<< Could not download PDB/mmCIF file: 7QOX-2 -<<< Could not download PDB/mmCIF file: 7QRL-1 -<<< Could not download PDB/mmCIF file: 7QSJ-1 -<<< Could not download PDB/mmCIF file: 7QU6-1 -<<< Could not download PDB/mmCIF file: 7QWN-2 -<<< Could not download PDB/mmCIF file: 7QZM-1 -<<< Could not download PDB/mmCIF file: 7R2J-1 -<<< Could not download PDB/mmCIF file: 7R5B-1 -<<< Could not download PDB/mmCIF file: 7RAV-1 -<<< Could not download PDB/mmCIF file: 7S2J-1 -<<< Could not download PDB/mmCIF file: 7SJV-1 -<<< Could not download PDB/mmCIF file: 7T87-1 -<<< Could not download PDB/mmCIF file: 7T9E-2 -<<< Could not download 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file: 7XRZ-2 -<<< Could not download PDB/mmCIF file: 7XTT-2 -<<< Could not download PDB/mmCIF file: 7XVV-1 -<<< Could not download PDB/mmCIF file: 7XX4-1 -<<< Could not download PDB/mmCIF file: 7Y1X-1 -<<< Could not download PDB/mmCIF file: 7Y4J-1 -<<< Could not download PDB/mmCIF file: 7Y6X-3 -<<< Could not download PDB/mmCIF file: 7YDC-1 -<<< Could not download PDB/mmCIF file: 7YJ0-1 -<<< Could not download PDB/mmCIF file: 7YL5-2 -<<< Could not download PDB/mmCIF file: 7YQ1-1 -<<< Could not download PDB/mmCIF file: 7YU0-1 -<<< Could not download PDB/mmCIF file: 7YZ8-3 -<<< Could not download PDB/mmCIF file: 7ZCY-1 -<<< Could not download PDB/mmCIF file: 7ZJK-1 -<<< Could not download PDB/mmCIF file: 7ZL9-1 -<<< Could not download PDB/mmCIF file: 7ZNG-1 -<<< Could not download PDB/mmCIF file: 7ZQZ-1 -<<< Could not download PDB/mmCIF file: 7ZSU-3 -<<< Could not download PDB/mmCIF file: 7ZW8-1 -<<< Could not download PDB/mmCIF file: 8A0H-1 -<<< Could not download PDB/mmCIF file: 8A1O-1 -<<< Could not download PDB/mmCIF file: 8A35-1 -<<< Could not download PDB/mmCIF file: 8A4V-3 -<<< Could not download PDB/mmCIF file: 8A8G-1 -<<< Could not download PDB/mmCIF file: 8A9W-1 -<<< Could not download PDB/mmCIF file: 8ACG-3 -<<< Could not download PDB/mmCIF file: 8AFF-3 -<<< Could not download PDB/mmCIF file: 8AH4-4 -<<< Could not download PDB/mmCIF file: 8AMQ-1 -<<< Could not download PDB/mmCIF file: 8AUH-1 -<<< Could not download PDB/mmCIF file: 8AYD-1 -<<< Could not download PDB/mmCIF file: 8B0Q-1 -<<< Could not download PDB/mmCIF file: 8B7X-1 -<<< Could not download PDB/mmCIF file: 8B9Y-1 -<<< Could not download PDB/mmCIF file: 8BBS-1 -<<< Could not download PDB/mmCIF file: 8BIH-3 -<<< Could not download PDB/mmCIF file: 8BLM-2 -<<< Could not download PDB/mmCIF file: 8BPN-2 -<<< Could not download PDB/mmCIF file: 8BSB-2 -<<< Could not download PDB/mmCIF file: 8BVO-1 -<<< Could not download PDB/mmCIF file: 8C0N-4 -<<< Could not download PDB/mmCIF file: 8C5F-1 -<<< Could not download PDB/mmCIF file: 8C9T-2 -<<< Could not download PDB/mmCIF file: 8CE6-1 -<<< Could not download PDB/mmCIF file: 8CIR-1 -<<< Could not download PDB/mmCIF file: 8CPI-1 -<<< Could not download PDB/mmCIF file: 8CTA-1 -<<< Could not download PDB/mmCIF file: 8CUY-1 -<<< Could not download PDB/mmCIF file: 8CXJ-4 -<<< Could not download PDB/mmCIF file: 8D69-1 -<<< Could not download PDB/mmCIF file: 8D7J-1 -<<< Could not download PDB/mmCIF file: 8DE9-1 -<<< Could not download PDB/mmCIF file: 8DGE-1 -<<< Could not download PDB/mmCIF file: 8DI7-1 -<<< Could not download PDB/mmCIF file: 8DJZ-1 -<<< Could not download PDB/mmCIF file: 8DLB-1 -<<< Could not download PDB/mmCIF file: 8DNH-1 -<<< Could not download PDB/mmCIF file: 8DOZ-2 -<<< Could not download PDB/mmCIF file: 8DQM-2 -<<< Could not download PDB/mmCIF file: 8DY2-2 -<<< Could not download PDB/mmCIF file: 8E3W-1 -<<< Could not download PDB/mmCIF file: 8E6L-1 -<<< Could not download PDB/mmCIF file: 8EBL-2 -<<< Could not download 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file: 8HCX-1 -<<< Could not download PDB/mmCIF file: 8HGW-1 -<<< Could not download PDB/mmCIF file: 8HKJ-8 -<<< Could not download PDB/mmCIF file: 8HTY-1 -<<< Could not download PDB/mmCIF file: 8I1H-1 -<<< Could not download PDB/mmCIF file: 8I61-1 -<<< Could not download PDB/mmCIF file: 8IAS-1 -<<< Could not download PDB/mmCIF file: 8II2-1 -<<< Could not download PDB/mmCIF file: 8IP5-1 -<<< Could not download PDB/mmCIF file: 8J3W-1 -<<< Could not download PDB/mmCIF file: 8ODW-1 -<<< Could not download PDB/mmCIF file: 8OM8-1 -<<< Could not download PDB/mmCIF file: 8OUY-1 -<<< Could not download PDB/mmCIF file: 8P5F-1 -<<< Could not download PDB/mmCIF file: 8S97-1 -<<< Could not download PDB/mmCIF file: 8SHJ-1 -<<< Could not download PDB/mmCIF file: 8STX-1 -<<< Could not download PDB/mmCIF file: 7XLQ-1 -<<< Could not download PDB/mmCIF file: 7ZPB-1 -<<< Could not download PDB/mmCIF file: 8BFY-1 -<<< Could not download PDB/mmCIF file: 8DF1-5 -<<< Could not download PDB/mmCIF file: 8EW1-3 -<<< Could not download PDB/mmCIF file: 8FRG-1 -<<< Could not download PDB/mmCIF file: 8SDB-1 -<<< Could not download PDB/mmCIF file: 4FPQ-1 -<<< Could not download PDB/mmCIF file: 7FAK-1 -<<< Could not download PDB/mmCIF file: 7FSC-2 -<<< Could not download PDB/mmCIF file: 7FSR-2 -<<< Could not download PDB/mmCIF file: 7FT3-4 -<<< Could not download PDB/mmCIF file: 7FV1-1 -<<< Could not download PDB/mmCIF file: 7FWH-1 -<<< Could not download PDB/mmCIF file: 7FXR-1 -<<< Could not download PDB/mmCIF file: 7FYW-2 -<<< Could not download PDB/mmCIF file: 7G00-14 -<<< Could not download PDB/mmCIF file: 7G11-1 -<<< Could not download PDB/mmCIF file: 7G8C-1 -<<< Could not download PDB/mmCIF file: 7OYN-1 -<<< Could not download PDB/mmCIF file: 7PAA-1 -<<< Could not download PDB/mmCIF file: 7QAJ-1 -<<< Could not download PDB/mmCIF file: 7QOY-1 -<<< Could not download PDB/mmCIF file: 7QRL-2 -<<< Could not download PDB/mmCIF file: 7QSJ-2 -<<< Could not download PDB/mmCIF file: 7QU6-2 -<<< Could not download PDB/mmCIF file: 7QWN-3 -<<< Could not download PDB/mmCIF file: 7R1H-1 -<<< Could not download PDB/mmCIF file: 7R2L-1 -<<< Could not download PDB/mmCIF file: 7S2J-2 -<<< Could not download PDB/mmCIF file: 7SJW-1 -<<< Could not download PDB/mmCIF file: 7T5Q-1 -<<< Could not download PDB/mmCIF file: 7TBQ-5 -<<< Could not download PDB/mmCIF file: 7THS-1 -<<< Could not download PDB/mmCIF file: 7TP6-1 -<<< Could not download PDB/mmCIF file: 7U63-1 -<<< Could not download PDB/mmCIF file: 7UGI-1 -<<< Could not download PDB/mmCIF file: 7UIE-4 -<<< Could not download PDB/mmCIF file: 7ULG-4 -<<< Could not download PDB/mmCIF file: 7UOR-2 -<<< Could not download PDB/mmCIF file: 7UQ2-1 -<<< Could not download PDB/mmCIF file: 7USG-1 -<<< Could not download PDB/mmCIF file: 7UUK-1 -<<< Could not download PDB/mmCIF file: 7V3E-2 -<<< Could not download PDB/mmCIF file: 7VS0-1 -<<< Could not download PDB/mmCIF file: 7W1A-1 -<<< Could not download PDB/mmCIF file: 7WJ4-1 -<<< Could not download 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file: 7Y8Z-1 -<<< Could not download PDB/mmCIF file: 7YB1-1 -<<< Could not download PDB/mmCIF file: 7YDC-2 -<<< Could not download PDB/mmCIF file: 7YGI-1 -<<< Could not download PDB/mmCIF file: 7YJ0-2 -<<< Could not download PDB/mmCIF file: 7YLE-1 -<<< Could not download PDB/mmCIF file: 7YQ1-2 -<<< Could not download PDB/mmCIF file: 7YU1-1 -<<< Could not download PDB/mmCIF file: 7YZ8-4 -<<< Could not download PDB/mmCIF file: 7Z2O-1 -<<< Could not download PDB/mmCIF file: 7Z62-1 -<<< Could not download PDB/mmCIF file: 7ZJK-2 -<<< Could not download PDB/mmCIF file: 7ZNH-1 -<<< Could not download PDB/mmCIF file: 7ZSV-1 -<<< Could not download PDB/mmCIF file: 7ZUO-1 -<<< Could not download PDB/mmCIF file: 8A1P-1 -<<< Could not download PDB/mmCIF file: 8A35-2 -<<< Could not download PDB/mmCIF file: 8A4V-4 -<<< Could not download PDB/mmCIF file: 8A5Z-1 -<<< Could not download PDB/mmCIF file: 8A8H-1 -<<< Could not download PDB/mmCIF file: 8A9X-1 -<<< Could not download PDB/mmCIF file: 8ACG-4 -<<< Could not download PDB/mmCIF file: 8AFF-4 -<<< Could not download PDB/mmCIF file: 8AH4-5 -<<< Could not download PDB/mmCIF file: 8AJ2-1 -<<< Could not download PDB/mmCIF file: 8AMT-1 -<<< Could not download PDB/mmCIF file: 8ARK-1 -<<< Could not download PDB/mmCIF file: 8AUI-1 -<<< Could not download PDB/mmCIF file: 8B4Q-1 -<<< Could not download PDB/mmCIF file: 8B9Y-2 -<<< Could not download PDB/mmCIF file: 8BBS-2 -<<< Could not download PDB/mmCIF file: 8BGR-1 -<<< Could not download PDB/mmCIF file: 8BIH-4 -<<< Could not download PDB/mmCIF file: 8BLM-3 -<<< Could not download PDB/mmCIF file: 8BPS-1 -<<< Could not download PDB/mmCIF file: 8BVP-1 -<<< Could not download PDB/mmCIF file: 8C0Q-1 -<<< Could not download PDB/mmCIF file: 8C5M-1 -<<< Could not download PDB/mmCIF file: 8C9V-1 -<<< Could not download PDB/mmCIF file: 8CE7-1 -<<< Could not download PDB/mmCIF file: 8CIR-2 -<<< Could not download PDB/mmCIF file: 8CPJ-1 -<<< Could not download PDB/mmCIF file: 8CTA-2 -<<< Could 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not download PDB/mmCIF file: 7QRL-3 -<<< Could not download PDB/mmCIF file: 7QSP-1 -<<< Could not download PDB/mmCIF file: 7QU6-3 -<<< Could not download PDB/mmCIF file: 7R1H-2 -<<< Could not download PDB/mmCIF file: 7R2M-1 -<<< Could not download PDB/mmCIF file: 7R5D-1 -<<< Could not download PDB/mmCIF file: 7RAX-1 -<<< Could not download PDB/mmCIF file: 7RMP-1 -<<< Could not download PDB/mmCIF file: 7S2K-1 -<<< Could not download PDB/mmCIF file: 7T2J-1 -<<< Could not download PDB/mmCIF file: 7T89-1 -<<< Could not download PDB/mmCIF file: 7TBR-1 -<<< Could not download PDB/mmCIF file: 7THS-2 -<<< Could not download PDB/mmCIF file: 7TJO-1 -<<< Could not download PDB/mmCIF file: 7U63-2 -<<< Could not download PDB/mmCIF file: 7UC6-1 -<<< Could not download PDB/mmCIF file: 7UGI-2 -<<< Could not download PDB/mmCIF file: 7UIE-5 -<<< Could not download PDB/mmCIF file: 7UOR-3 -<<< Could not download PDB/mmCIF file: 7USH-1 -<<< Could not download PDB/mmCIF file: 7V3E-3 -<<< Could not download 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not download PDB/mmCIF file: 8C5N-1 -<<< Could not download PDB/mmCIF file: 8C9W-1 -<<< Could not download PDB/mmCIF file: 8CE9-1 -<<< Could not download PDB/mmCIF file: 8CIS-1 -<<< Could not download PDB/mmCIF file: 8CPN-1 -<<< Could not download PDB/mmCIF file: 8CTA-3 -<<< Could not download PDB/mmCIF file: 8CV0-1 -<<< Could not download PDB/mmCIF file: 8D7K-2 -<<< Could not download PDB/mmCIF file: 8DB3-1 -<<< Could not download PDB/mmCIF file: 8DGE-3 -<<< Could not download PDB/mmCIF file: 8DI7-3 -<<< Could not download PDB/mmCIF file: 8DLD-1 -<<< Could not download PDB/mmCIF file: 8DP4-1 -<<< Could not download PDB/mmCIF file: 8DQO-1 -<<< Could not download PDB/mmCIF file: 8DTA-1 -<<< Could not download PDB/mmCIF file: 8DY2-4 -<<< Could not download PDB/mmCIF file: 8E1M-1 -<<< Could not download PDB/mmCIF file: 8E6N-1 -<<< Could not download PDB/mmCIF file: 8EBM-2 -<<< Could not download PDB/mmCIF file: 8EEL-2 -<<< Could not download PDB/mmCIF file: 8ENM-1 -<<< Could not download 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-<<< Could not download PDB/mmCIF file: 8F0H-1 -<<< Could not download PDB/mmCIF file: 8FWR-1 -<<< Could not download PDB/mmCIF file: 8HEC-1 -<<< Could not download PDB/mmCIF file: 8SDB-3 -<<< Could not download PDB/mmCIF file: 4FPQ-3 -<<< Could not download PDB/mmCIF file: 7FSD-2 -<<< Could not download PDB/mmCIF file: 7FSR-4 -<<< Could not download PDB/mmCIF file: 7FT4-2 -<<< Could not download PDB/mmCIF file: 7FV3-1 -<<< Could not download PDB/mmCIF file: 7FWI-2 -<<< Could not download PDB/mmCIF file: 7FXT-1 -<<< Could not download PDB/mmCIF file: 7FYW-4 -<<< Could not download PDB/mmCIF file: 7G00-16 -<<< Could not download PDB/mmCIF file: 7G13-1 -<<< Could not download PDB/mmCIF file: 7G8E-1 -<<< Could not download PDB/mmCIF file: 7OYP-1 -<<< Could not download PDB/mmCIF file: 7QAJ-3 -<<< Could not download PDB/mmCIF file: 7QOZ-2 -<<< Could not download PDB/mmCIF file: 7QQ4-1 -<<< Could not download PDB/mmCIF file: 7QRL-4 -<<< Could not download PDB/mmCIF file: 7QSQ-1 -<<< Could not download PDB/mmCIF file: 7QU6-4 -<<< Could not download PDB/mmCIF file: 7R1I-1 -<<< Could not download PDB/mmCIF file: 7R2M-2 -<<< Could not download PDB/mmCIF file: 7R3L-1 -<<< Could not download PDB/mmCIF file: 7S1C-1 -<<< Could not download PDB/mmCIF file: 7S2L-1 -<<< Could not download PDB/mmCIF file: 7T2J-2 -<<< Could not download PDB/mmCIF file: 7T8D-1 -<<< Could not download PDB/mmCIF file: 7TJO-2 -<<< Could not download PDB/mmCIF file: 7TVI-1 -<<< Could not download PDB/mmCIF file: 7U63-3 -<<< Could not download PDB/mmCIF file: 7U8E-1 -<<< Could not download PDB/mmCIF file: 7UA7-1 -<<< Could not download PDB/mmCIF file: 7UC7-1 -<<< Could not download PDB/mmCIF file: 7UF8-1 -<<< Could not download PDB/mmCIF file: 7UGJ-1 -<<< Could not download PDB/mmCIF file: 7UIH-1 -<<< Could not download PDB/mmCIF file: 7UOR-4 -<<< Could not download PDB/mmCIF file: 7UQ9-1 -<<< Could not download PDB/mmCIF file: 7USI-1 -<<< Could not download PDB/mmCIF file: 7UWP-1 -<<< Could not download 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-<<< Could not download PDB/mmCIF file: 8APQ-2 -<<< Could not download PDB/mmCIF file: 8ARK-3 -<<< Could not download PDB/mmCIF file: 8AUJ-2 -<<< Could not download PDB/mmCIF file: 8B54-2 -<<< Could not download PDB/mmCIF file: 8BA3-1 -<<< Could not download PDB/mmCIF file: 8BBU-1 -<<< Could not download PDB/mmCIF file: 8BDE-1 -<<< Could not download PDB/mmCIF file: 8BGT-1 -<<< Could not download PDB/mmCIF file: 8BIH-6 -<<< Could not download PDB/mmCIF file: 8BLM-5 -<<< Could not download PDB/mmCIF file: 8BSF-1 -<<< Could not download PDB/mmCIF file: 8C0Z-1 -<<< Could not download PDB/mmCIF file: 8C5P-1 -<<< Could not download PDB/mmCIF file: 8C9Y-1 -<<< Could not download PDB/mmCIF file: 8CE9-2 -<<< Could not download PDB/mmCIF file: 8CIT-1 -<<< Could not download PDB/mmCIF file: 8CPO-1 -<<< Could not download PDB/mmCIF file: 8CTA-4 -<<< Could not download PDB/mmCIF file: 8CV1-1 -<<< Could not download PDB/mmCIF file: 8D1Y-1 -<<< Could not download PDB/mmCIF file: 8D7K-3 -<<< Could not download PDB/mmCIF file: 8DB4-1 -<<< Could not download PDB/mmCIF file: 8DGE-4 -<<< Could not download PDB/mmCIF file: 8DI7-4 -<<< Could not download PDB/mmCIF file: 8DK4-1 -<<< Could not download PDB/mmCIF file: 8DLE-1 -<<< Could not download PDB/mmCIF file: 8DP5-1 -<<< Could not download PDB/mmCIF file: 8DQP-1 -<<< Could not download PDB/mmCIF file: 8DTB-1 -<<< Could not download PDB/mmCIF file: 8DY3-1 -<<< Could not download PDB/mmCIF file: 8E72-1 -<<< Could not download PDB/mmCIF file: 8EBR-1 -<<< Could not download PDB/mmCIF file: 8EEM-1 -<<< Could not download PDB/mmCIF file: 8EKW-1 -<<< Could not download PDB/mmCIF file: 8ENN-1 -<<< Could not download PDB/mmCIF file: 8EQP-4 -<<< Could not download PDB/mmCIF file: 8ETO-1 -<<< Could not download PDB/mmCIF file: 8EWR-1 -<<< Could not download PDB/mmCIF file: 8F1B-3 -<<< Could not download PDB/mmCIF file: 8F4W-1 -<<< Could not download PDB/mmCIF file: 8F7B-1 -<<< Could not download PDB/mmCIF file: 8FBC-1 -<<< Could not download 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-<<< Could not download PDB/mmCIF file: 7FSE-1 -<<< Could not download PDB/mmCIF file: 7FSS-1 -<<< Could not download PDB/mmCIF file: 7FT4-3 -<<< Could not download PDB/mmCIF file: 7FV4-1 -<<< Could not download PDB/mmCIF file: 7FWI-3 -<<< Could not download PDB/mmCIF file: 7FXU-1 -<<< Could not download PDB/mmCIF file: 7FYX-1 -<<< Could not download PDB/mmCIF file: 7G00-2 -<<< Could not download PDB/mmCIF file: 7G14-1 -<<< Could not download PDB/mmCIF file: 7G8F-1 -<<< Could not download PDB/mmCIF file: 7N6C-1 -<<< Could not download PDB/mmCIF file: 7OYQ-1 -<<< Could not download PDB/mmCIF file: 7QAJ-4 -<<< Could not download PDB/mmCIF file: 7QP0-1 -<<< Could not download PDB/mmCIF file: 7QQ4-2 -<<< Could not download PDB/mmCIF file: 7QSQ-2 -<<< Could not download PDB/mmCIF file: 7QU6-5 -<<< Could not download PDB/mmCIF file: 7QWV-1 -<<< Could not download PDB/mmCIF file: 7R1I-2 -<<< Could not download PDB/mmCIF file: 7R2O-1 -<<< Could not download PDB/mmCIF file: 7R3L-2 -<<< Could not download PDB/mmCIF file: 7S1C-2 -<<< Could not download PDB/mmCIF file: 7S2L-2 -<<< Could not download PDB/mmCIF file: 7SC4-1 -<<< Could not download PDB/mmCIF file: 7T2K-1 -<<< Could not download PDB/mmCIF file: 7T8E-1 -<<< Could not download PDB/mmCIF file: 7TJO-3 -<<< Could not download PDB/mmCIF file: 7TVJ-1 -<<< Could not download PDB/mmCIF file: 7TXR-1 -<<< Could not download PDB/mmCIF file: 7U4Q-1 -<<< Could not download PDB/mmCIF file: 7U64-1 -<<< Could not download PDB/mmCIF file: 7U8F-1 -<<< Could not download PDB/mmCIF file: 7UA8-1 -<<< Could not download PDB/mmCIF file: 7UC8-1 -<<< Could not download PDB/mmCIF file: 7UIJ-1 -<<< Could not download PDB/mmCIF file: 7UK4-1 -<<< Could not download PDB/mmCIF file: 7UOR-5 -<<< Could not download PDB/mmCIF file: 7UQJ-1 -<<< Could not download PDB/mmCIF file: 7USI-2 -<<< Could not download PDB/mmCIF file: 7UWP-2 -<<< Could not download PDB/mmCIF file: 7VS6-1 -<<< Could not download PDB/mmCIF file: 7WCC-1 -<<< Could not download 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-<<< Could not download PDB/mmCIF file: 8APQ-3 -<<< Could not download PDB/mmCIF file: 8AUL-1 -<<< Could not download PDB/mmCIF file: 8AW8-1 -<<< Could not download PDB/mmCIF file: 8BA4-1 -<<< Could not download PDB/mmCIF file: 8BBV-1 -<<< Could not download PDB/mmCIF file: 8BDF-1 -<<< Could not download PDB/mmCIF file: 8BGT-2 -<<< Could not download PDB/mmCIF file: 8BII-1 -<<< Could not download PDB/mmCIF file: 8BLM-6 -<<< Could not download PDB/mmCIF file: 8BSG-1 -<<< Could not download PDB/mmCIF file: 8C10-1 -<<< Could not download PDB/mmCIF file: 8C60-1 -<<< Could not download PDB/mmCIF file: 8C9Z-1 -<<< Could not download PDB/mmCIF file: 8CEB-1 -<<< Could not download PDB/mmCIF file: 8CIT-2 -<<< Could not download PDB/mmCIF file: 8CV2-1 -<<< Could not download PDB/mmCIF file: 8D20-1 -<<< Could not download PDB/mmCIF file: 8D7K-4 -<<< Could not download PDB/mmCIF file: 8DB4-2 -<<< Could not download PDB/mmCIF file: 8DIB-1 -<<< Could not download PDB/mmCIF file: 8DK8-1 -<<< Could not download PDB/mmCIF file: 8DQQ-1 -<<< Could not download PDB/mmCIF file: 8DY4-1 -<<< Could not download PDB/mmCIF file: 8E4F-1 -<<< Could not download PDB/mmCIF file: 8EBZ-1 -<<< Could not download PDB/mmCIF file: 8EEM-2 -<<< Could not download PDB/mmCIF file: 8EL7-1 -<<< Could not download PDB/mmCIF file: 8ENO-1 -<<< Could not download PDB/mmCIF file: 8EQQ-1 -<<< Could not download PDB/mmCIF file: 8ETO-2 -<<< Could not download PDB/mmCIF file: 8EWS-1 -<<< Could not download PDB/mmCIF file: 8F1B-4 -<<< Could not download PDB/mmCIF file: 8F4Z-1 -<<< Could not download PDB/mmCIF file: 8F7N-1 -<<< Could not download PDB/mmCIF file: 8FBC-2 -<<< Could not download PDB/mmCIF file: 8FDL-1 -<<< Could not download PDB/mmCIF file: 8FH4-3 -<<< Could not download PDB/mmCIF file: 8FLU-1 -<<< Could not download PDB/mmCIF file: 8FNB-1 -<<< Could not download PDB/mmCIF file: 8FQU-1 -<<< Could not download PDB/mmCIF file: 8FVB-1 -<<< Could not download PDB/mmCIF file: 8FZZ-2 -<<< Could not download 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file: 8OV3-1 -<<< Could not download PDB/mmCIF file: 8P5O-4 -<<< Could not download PDB/mmCIF file: 8SA9-1 -<<< Could not download PDB/mmCIF file: 8SI3-1 -<<< Could not download PDB/mmCIF file: 8SV5-1 -<<< Could not download PDB/mmCIF file: 7UAJ-1 -<<< Could not download PDB/mmCIF file: 7XMN-1 -<<< Could not download PDB/mmCIF file: 7Y69-1 -<<< Could not download PDB/mmCIF file: 7ZSS-1 -<<< Could not download PDB/mmCIF file: 8AI7-1 -<<< Could not download PDB/mmCIF file: 8BHH-1 -<<< Could not download PDB/mmCIF file: 8DFW-1 -<<< Could not download PDB/mmCIF file: 8E07-1 -<<< Could not download PDB/mmCIF file: 8F0Q-1 -<<< Could not download PDB/mmCIF file: 8FWT-1 -<<< Could not download PDB/mmCIF file: 8HHY-1 -<<< Could not download PDB/mmCIF file: 8SK7-1 -<<< Could not download PDB/mmCIF file: 4FPQ-5 -<<< Could not download PDB/mmCIF file: 7FSF-1 -<<< Could not download PDB/mmCIF file: 7FSS-2 -<<< Could not download PDB/mmCIF file: 7FT4-4 -<<< Could not download PDB/mmCIF file: 7FV5-1 -<<< Could not download PDB/mmCIF file: 7FWJ-1 -<<< Could not download PDB/mmCIF file: 7FXV-1 -<<< Could not download PDB/mmCIF file: 7FYY-1 -<<< Could not download PDB/mmCIF file: 7G00-3 -<<< Could not download PDB/mmCIF file: 7G15-1 -<<< Could not download PDB/mmCIF file: 7G8G-1 -<<< Could not download PDB/mmCIF file: 7OYR-1 -<<< Could not download PDB/mmCIF file: 7QP0-2 -<<< Could not download PDB/mmCIF file: 7QRR-1 -<<< Could not download PDB/mmCIF file: 7QU6-6 -<<< Could not download PDB/mmCIF file: 7R1I-3 -<<< Could not download PDB/mmCIF file: 7R2O-2 -<<< Could not download PDB/mmCIF file: 7R3O-1 -<<< Could not download PDB/mmCIF file: 7RIS-1 -<<< Could not download PDB/mmCIF file: 7S1D-1 -<<< Could not download PDB/mmCIF file: 7S2M-1 -<<< Could not download PDB/mmCIF file: 7SC4-2 -<<< Could not download PDB/mmCIF file: 7SIJ-1 -<<< Could not download PDB/mmCIF file: 7SLH-1 -<<< Could not download PDB/mmCIF file: 7T2K-2 -<<< Could not download PDB/mmCIF file: 7T8F-1 -<<< Could not download PDB/mmCIF file: 7TJO-4 -<<< Could not download PDB/mmCIF file: 7TMW-1 -<<< Could not download PDB/mmCIF file: 7TVJ-2 -<<< Could not download PDB/mmCIF file: 7TXR-2 -<<< Could not download PDB/mmCIF file: 7U64-2 -<<< Could not download PDB/mmCIF file: 7U8F-2 -<<< Could not download PDB/mmCIF file: 7UA8-2 -<<< Could not download PDB/mmCIF file: 7UC8-2 -<<< Could not download PDB/mmCIF file: 7ULJ-1 -<<< Could not download PDB/mmCIF file: 7UMX-1 -<<< Could not download PDB/mmCIF file: 7UOR-6 -<<< Could not download PDB/mmCIF file: 7UQK-1 -<<< Could not download PDB/mmCIF file: 7USI-3 -<<< Could not download PDB/mmCIF file: 7V50-1 -<<< Could not download PDB/mmCIF file: 7WCC-2 -<<< Could not download PDB/mmCIF file: 7WMZ-4 -<<< Could not download PDB/mmCIF file: 7WR1-1 -<<< Could not download PDB/mmCIF file: 7WVI-2 -<<< Could not download PDB/mmCIF file: 7WXE-1 -<<< Could not download PDB/mmCIF file: 7WZF-1 -<<< Could not download PDB/mmCIF file: 7X3O-2 -<<< Could not download 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file: 7ZD3-1 -<<< Could not download PDB/mmCIF file: 7ZI2-1 -<<< Could not download PDB/mmCIF file: 7ZLG-1 -<<< Could not download PDB/mmCIF file: 7ZWK-1 -<<< Could not download PDB/mmCIF file: 7ZY7-1 -<<< Could not download PDB/mmCIF file: 7ZZL-4 -<<< Could not download PDB/mmCIF file: 8A1W-1 -<<< Could not download PDB/mmCIF file: 8A39-1 -<<< Could not download PDB/mmCIF file: 8A4W-4 -<<< Could not download PDB/mmCIF file: 8A8K-2 -<<< Could not download PDB/mmCIF file: 8A9Y-1 -<<< Could not download PDB/mmCIF file: 8ACK-2 -<<< Could not download PDB/mmCIF file: 8AFF-8 -<<< Could not download PDB/mmCIF file: 8AH7-1 -<<< Could not download PDB/mmCIF file: 8AN6-1 -<<< Could not download PDB/mmCIF file: 8ARN-1 -<<< Could not download PDB/mmCIF file: 8AUL-2 -<<< Could not download PDB/mmCIF file: 8AW9-1 -<<< Could not download PDB/mmCIF file: 8AYL-1 -<<< Could not download PDB/mmCIF file: 8B58-1 -<<< Could not download PDB/mmCIF file: 8BA4-2 -<<< Could not download PDB/mmCIF file: 8BBW-1 -<<< Could not download PDB/mmCIF file: 8BDG-1 -<<< Could not download PDB/mmCIF file: 8BEP-1 -<<< Could not download PDB/mmCIF file: 8BGV-1 -<<< Could not download PDB/mmCIF file: 8BII-2 -<<< Could not download PDB/mmCIF file: 8BLM-7 -<<< Could not download PDB/mmCIF file: 8BQF-1 -<<< Could not download PDB/mmCIF file: 8BSK-1 -<<< Could not download PDB/mmCIF file: 8C68-1 -<<< Could not download PDB/mmCIF file: 8CEI-1 -<<< Could not download PDB/mmCIF file: 8CIT-3 -<<< Could not download PDB/mmCIF file: 8CQG-1 -<<< Could not download PDB/mmCIF file: 8CTC-1 -<<< Could not download PDB/mmCIF file: 8CV3-1 -<<< Could not download PDB/mmCIF file: 8D22-1 -<<< Could not download PDB/mmCIF file: 8D4W-1 -<<< Could not download PDB/mmCIF file: 8D7L-1 -<<< Could not download PDB/mmCIF file: 8DIC-1 -<<< Could not download PDB/mmCIF file: 8DK9-1 -<<< Could not download PDB/mmCIF file: 8DQR-1 -<<< Could not download PDB/mmCIF file: 8DVC-1 -<<< Could not download PDB/mmCIF file: 8DY5-1 -<<< Could not download PDB/mmCIF file: 8E4I-1 -<<< Could not download PDB/mmCIF file: 8E76-1 -<<< Could not download PDB/mmCIF file: 8EC3-1 -<<< Could not download PDB/mmCIF file: 8EEN-1 -<<< Could not download PDB/mmCIF file: 8EL8-1 -<<< Could not download PDB/mmCIF file: 8EOB-1 -<<< Could not download PDB/mmCIF file: 8EQQ-2 -<<< Could not download PDB/mmCIF file: 8EZ1-1 -<<< Could not download PDB/mmCIF file: 8F1B-5 -<<< Could not download PDB/mmCIF file: 8F51-1 -<<< Could not download PDB/mmCIF file: 8F7P-1 -<<< Could not download PDB/mmCIF file: 8FDM-1 -<<< Could not download PDB/mmCIF file: 8FH4-4 -<<< Could not download PDB/mmCIF file: 8FLV-1 -<<< Could not download PDB/mmCIF file: 8FNB-2 -<<< Could not download PDB/mmCIF file: 8FQU-2 -<<< Could not download PDB/mmCIF file: 8FVC-1 -<<< Could not download PDB/mmCIF file: 8G0F-1 -<<< Could not download PDB/mmCIF file: 8G4C-1 -<<< Could not download PDB/mmCIF file: 8GAE-1 -<<< Could not download PDB/mmCIF file: 8GFH-1 -<<< Could not download 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file: 8SWD-1 -<<< Could not download PDB/mmCIF file: 7QQB-1 -<<< Could not download PDB/mmCIF file: 7UP9-1 -<<< Could not download PDB/mmCIF file: 7WQV-1 -<<< Could not download PDB/mmCIF file: 7XN1-1 -<<< Could not download PDB/mmCIF file: 7Z6T-1 -<<< Could not download PDB/mmCIF file: 8AIC-1 -<<< Could not download PDB/mmCIF file: 8BHH-2 -<<< Could not download PDB/mmCIF file: 8E08-1 -<<< Could not download PDB/mmCIF file: 8F0R-1 -<<< Could not download PDB/mmCIF file: 8FWU-1 -<<< Could not download PDB/mmCIF file: 8I2G-1 -<<< Could not download PDB/mmCIF file: 8SMT-1 -<<< Could not download PDB/mmCIF file: 4FPQ-6 -<<< Could not download PDB/mmCIF file: 7FSG-1 -<<< Could not download PDB/mmCIF file: 7FSS-3 -<<< Could not download PDB/mmCIF file: 7FT5-1 -<<< Could not download PDB/mmCIF file: 7FV6-1 -<<< Could not download PDB/mmCIF file: 7FWK-1 -<<< Could not download PDB/mmCIF file: 7FXW-1 -<<< Could not download PDB/mmCIF file: 7FYZ-1 -<<< Could not download PDB/mmCIF file: 7G00-4 -<<< Could not download PDB/mmCIF file: 7G16-1 -<<< Could not download PDB/mmCIF file: 7G8H-1 -<<< Could not download PDB/mmCIF file: 7PU4-1 -<<< Could not download PDB/mmCIF file: 7QP1-1 -<<< Could not download PDB/mmCIF file: 7QRR-2 -<<< Could not download PDB/mmCIF file: 7QW4-1 -<<< Could not download PDB/mmCIF file: 7QYK-1 -<<< Could not download PDB/mmCIF file: 7QZS-1 -<<< Could not download PDB/mmCIF file: 7R1J-1 -<<< Could not download PDB/mmCIF file: 7R2O-3 -<<< Could not download PDB/mmCIF file: 7S1D-2 -<<< Could not download PDB/mmCIF file: 7S2M-2 -<<< Could not download PDB/mmCIF file: 7SLI-1 -<<< Could not download PDB/mmCIF file: 7T2L-1 -<<< Could not download PDB/mmCIF file: 7T8G-1 -<<< Could not download PDB/mmCIF file: 7TJP-1 -<<< Could not download PDB/mmCIF file: 7U64-3 -<<< Could not download PDB/mmCIF file: 7UAG-1 -<<< Could not download PDB/mmCIF file: 7UC8-3 -<<< Could not download PDB/mmCIF file: 7UGL-1 -<<< Could not download PDB/mmCIF file: 7UK6-1 -<<< Could not download PDB/mmCIF file: 7ULJ-2 -<<< Could not download PDB/mmCIF file: 7UMX-2 -<<< Could not download PDB/mmCIF file: 7UOS-1 -<<< Could not download PDB/mmCIF file: 7UQL-1 -<<< Could not download PDB/mmCIF file: 7USI-4 -<<< Could not download PDB/mmCIF file: 7V03-1 -<<< Could not download PDB/mmCIF file: 7V3N-1 -<<< Could not download PDB/mmCIF file: 7V51-1 -<<< Could not download PDB/mmCIF file: 7WMZ-5 -<<< Could not download PDB/mmCIF file: 7WR1-2 -<<< Could not download PDB/mmCIF file: 7WZG-1 -<<< Could not download PDB/mmCIF file: 7X3Z-1 -<<< Could not download PDB/mmCIF file: 7X5P-1 -<<< Could not download PDB/mmCIF file: 7X98-1 -<<< Could not download PDB/mmCIF file: 7XB6-1 -<<< Could not download PDB/mmCIF file: 7XD2-1 -<<< Could not download PDB/mmCIF file: 7XEK-1 -<<< Could not download PDB/mmCIF file: 7XHG-1 -<<< Could not download PDB/mmCIF file: 7XIO-3 -<<< Could not download PDB/mmCIF file: 7XQA-2 -<<< Could not download PDB/mmCIF file: 7XSA-1 -<<< Could not download 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-<<< Could not download PDB/mmCIF file: 8BW6-1 -<<< Could not download PDB/mmCIF file: 8C17-1 -<<< Could not download PDB/mmCIF file: 8C6E-1 -<<< Could not download PDB/mmCIF file: 8CAA-1 -<<< Could not download PDB/mmCIF file: 8CEI-2 -<<< Could not download PDB/mmCIF file: 8CIU-1 -<<< Could not download PDB/mmCIF file: 8CQX-1 -<<< Could not download PDB/mmCIF file: 8CTD-1 -<<< Could not download PDB/mmCIF file: 8CV4-1 -<<< Could not download PDB/mmCIF file: 8D4X-1 -<<< Could not download PDB/mmCIF file: 8D7M-1 -<<< Could not download PDB/mmCIF file: 8DEH-1 -<<< Could not download PDB/mmCIF file: 8DGM-1 -<<< Could not download PDB/mmCIF file: 8DID-1 -<<< Could not download PDB/mmCIF file: 8DK9-2 -<<< Could not download PDB/mmCIF file: 8DTJ-1 -<<< Could not download PDB/mmCIF file: 8DVC-2 -<<< Could not download PDB/mmCIF file: 8DY5-2 -<<< Could not download PDB/mmCIF file: 8E4I-2 -<<< Could not download PDB/mmCIF file: 8EC4-1 -<<< Could not download PDB/mmCIF file: 8EEN-2 -<<< Could not download PDB/mmCIF file: 8ELA-1 -<<< Could not download PDB/mmCIF file: 8EOC-1 -<<< Could not download PDB/mmCIF file: 8EQQ-3 -<<< Could not download PDB/mmCIF file: 8EU4-1 -<<< Could not download PDB/mmCIF file: 8EWZ-1 -<<< Could not download PDB/mmCIF file: 8EZ1-2 -<<< Could not download PDB/mmCIF file: 8F1B-6 -<<< Could not download PDB/mmCIF file: 8F55-1 -<<< Could not download PDB/mmCIF file: 8FDN-1 -<<< Could not download PDB/mmCIF file: 8FHJ-1 -<<< Could not download PDB/mmCIF file: 8FLY-1 -<<< Could not download PDB/mmCIF file: 8FNR-1 -<<< Could not download PDB/mmCIF file: 8FQV-1 -<<< Could not download PDB/mmCIF file: 8FVD-1 -<<< Could not download PDB/mmCIF file: 8G0G-1 -<<< Could not download PDB/mmCIF file: 8G4J-1 -<<< Could not download PDB/mmCIF file: 8GAI-1 -<<< Could not download PDB/mmCIF file: 8GFI-1 -<<< Could not download PDB/mmCIF file: 8GM4-1 -<<< Could not download PDB/mmCIF file: 8GPV-1 -<<< Could not download PDB/mmCIF file: 8GS9-1 -<<< Could not download 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file: 7WQV-2 -<<< Could not download PDB/mmCIF file: 8AIC-2 -<<< Could not download PDB/mmCIF file: 8BON-1 -<<< Could not download PDB/mmCIF file: 8D0O-1 -<<< Could not download PDB/mmCIF file: 8E0P-1 -<<< Could not download PDB/mmCIF file: 8F0S-1 -<<< Could not download PDB/mmCIF file: 8FWV-1 -<<< Could not download PDB/mmCIF file: 8I5B-1 -<<< Could not download PDB/mmCIF file: 8SMT-2 -<<< Could not download PDB/mmCIF file: 7FSG-2 -<<< Could not download PDB/mmCIF file: 7FSS-4 -<<< Could not download PDB/mmCIF file: 7FT5-2 -<<< Could not download PDB/mmCIF file: 7FV7-1 -<<< Could not download PDB/mmCIF file: 7FWL-1 -<<< Could not download PDB/mmCIF file: 7FXX-1 -<<< Could not download PDB/mmCIF file: 7FZ0-1 -<<< Could not download PDB/mmCIF file: 7G00-5 -<<< Could not download PDB/mmCIF file: 7G17-1 -<<< Could not download PDB/mmCIF file: 7G8I-1 -<<< Could not download PDB/mmCIF file: 7PU4-2 -<<< Could not download PDB/mmCIF file: 7QP1-2 -<<< Could not download PDB/mmCIF file: 7QRR-3 -<<< Could not download PDB/mmCIF file: 7QW4-10 -<<< Could not download PDB/mmCIF file: 7R1J-2 -<<< Could not download PDB/mmCIF file: 7R2O-4 -<<< Could not download PDB/mmCIF file: 7RB3-1 -<<< Could not download PDB/mmCIF file: 7S1F-1 -<<< Could not download PDB/mmCIF file: 7T2L-2 -<<< Could not download PDB/mmCIF file: 7T8H-1 -<<< Could not download PDB/mmCIF file: 7T9Q-1 -<<< Could not download PDB/mmCIF file: 7TJP-2 -<<< Could not download PDB/mmCIF file: 7TRK-1 -<<< Could not download PDB/mmCIF file: 7TXT-1 -<<< Could not download PDB/mmCIF file: 7U64-4 -<<< Could not download PDB/mmCIF file: 7UAH-1 -<<< Could not download PDB/mmCIF file: 7UGL-2 -<<< Could not download PDB/mmCIF file: 7UK7-1 -<<< Could not download PDB/mmCIF file: 7ULJ-3 -<<< Could not download PDB/mmCIF file: 7UMY-1 -<<< Could not download PDB/mmCIF file: 7UOX-1 -<<< Could not download PDB/mmCIF file: 7UQM-1 -<<< Could not download PDB/mmCIF file: 7USI-5 -<<< Could not download PDB/mmCIF file: 7V03-2 -<<< Could not download PDB/mmCIF file: 7V3O-1 -<<< Could not download PDB/mmCIF file: 7WH8-1 -<<< Could not download PDB/mmCIF file: 7WMZ-6 -<<< Could not download PDB/mmCIF file: 7WR1-3 -<<< Could not download PDB/mmCIF file: 7WZL-1 -<<< Could not download PDB/mmCIF file: 7X1B-1 -<<< Could not download PDB/mmCIF file: 7X41-1 -<<< Could not download PDB/mmCIF file: 7X5Q-1 -<<< Could not download PDB/mmCIF file: 7X98-2 -<<< Could not download PDB/mmCIF file: 7XB6-2 -<<< Could not download PDB/mmCIF file: 7XDA-1 -<<< Could not download PDB/mmCIF file: 7XEL-1 -<<< Could not download PDB/mmCIF file: 7XHG-2 -<<< Could not download PDB/mmCIF file: 7XQC-1 -<<< Could not download PDB/mmCIF file: 7XSA-2 -<<< Could not download PDB/mmCIF file: 7XTV-3 -<<< Could not download PDB/mmCIF file: 7XW0-1 -<<< Could not download PDB/mmCIF file: 7XXH-1 -<<< Could not download PDB/mmCIF file: 7Y0B-1 -<<< Could not download PDB/mmCIF file: 7Y35-1 -<<< Could not download PDB/mmCIF file: 7Y77-1 -<<< Could not download 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file: 8AFG-1 -<<< Could not download PDB/mmCIF file: 8AHC-1 -<<< Could not download PDB/mmCIF file: 8APT-1 -<<< Could not download PDB/mmCIF file: 8ARP-1 -<<< Could not download PDB/mmCIF file: 8AUM-2 -<<< Could not download PDB/mmCIF file: 8AWC-1 -<<< Could not download PDB/mmCIF file: 8AYN-1 -<<< Could not download PDB/mmCIF file: 8B5A-1 -<<< Could not download PDB/mmCIF file: 8BBY-2 -<<< Could not download PDB/mmCIF file: 8BDI-2 -<<< Could not download PDB/mmCIF file: 8BF1-1 -<<< Could not download PDB/mmCIF file: 8BGX-2 -<<< Could not download PDB/mmCIF file: 8BII-4 -<<< Could not download PDB/mmCIF file: 8BLS-1 -<<< Could not download PDB/mmCIF file: 8BQF-3 -<<< Could not download PDB/mmCIF file: 8BSM-1 -<<< Could not download PDB/mmCIF file: 8BWC-1 -<<< Could not download PDB/mmCIF file: 8C19-1 -<<< Could not download PDB/mmCIF file: 8C6G-1 -<<< Could not download PDB/mmCIF file: 8CAG-1 -<<< Could not download PDB/mmCIF file: 8CEJ-1 -<<< Could not download PDB/mmCIF file: 8CIW-1 -<<< Could not download PDB/mmCIF file: 8CQX-2 -<<< Could not download PDB/mmCIF file: 8CV4-2 -<<< Could not download PDB/mmCIF file: 8D24-1 -<<< Could not download PDB/mmCIF file: 8D7M-2 -<<< Could not download PDB/mmCIF file: 8DEI-1 -<<< Could not download PDB/mmCIF file: 8DGN-1 -<<< Could not download PDB/mmCIF file: 8DIE-1 -<<< Could not download PDB/mmCIF file: 8DKA-1 -<<< Could not download PDB/mmCIF file: 8DNN-1 -<<< Could not download PDB/mmCIF file: 8DQT-1 -<<< Could not download PDB/mmCIF file: 8DVC-3 -<<< Could not download PDB/mmCIF file: 8DYB-1 -<<< Could not download PDB/mmCIF file: 8E78-1 -<<< Could not download PDB/mmCIF file: 8EEO-1 -<<< Could not download PDB/mmCIF file: 8EHP-1 -<<< Could not download PDB/mmCIF file: 8ELA-2 -<<< Could not download PDB/mmCIF file: 8EOC-2 -<<< Could not download PDB/mmCIF file: 8EQQ-4 -<<< Could not download PDB/mmCIF file: 8EU4-2 -<<< Could not download PDB/mmCIF file: 8EX0-1 -<<< Could not download PDB/mmCIF file: 8EZ2-1 -<<< Could not download PDB/mmCIF file: 8F1G-1 -<<< Could not download PDB/mmCIF file: 8FDS-1 -<<< Could not download PDB/mmCIF file: 8FHL-1 -<<< Could not download PDB/mmCIF file: 8FLY-2 -<<< Could not download PDB/mmCIF file: 8FNR-2 -<<< Could not download PDB/mmCIF file: 8FQV-2 -<<< Could not download PDB/mmCIF file: 8FVE-1 -<<< Could not download PDB/mmCIF file: 8G0K-1 -<<< Could not download PDB/mmCIF file: 8G4J-2 -<<< Could not download PDB/mmCIF file: 8GAI-2 -<<< Could not download PDB/mmCIF file: 8GFJ-1 -<<< Could not download PDB/mmCIF file: 8GM5-1 -<<< Could not download PDB/mmCIF file: 8GSO-1 -<<< Could not download PDB/mmCIF file: 8GUZ-2 -<<< Could not download PDB/mmCIF file: 8GZE-1 -<<< Could not download PDB/mmCIF file: 8H3J-1 -<<< Could not download PDB/mmCIF file: 8H8A-1 -<<< Could not download PDB/mmCIF file: 8HDF-1 -<<< Could not download PDB/mmCIF file: 8HHK-1 -<<< Could not download PDB/mmCIF file: 8HLO-1 -<<< Could not download PDB/mmCIF file: 8HUT-1 -<<< Could not download 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file: 8SMT-3 -<<< Could not download PDB/mmCIF file: 7FSG-3 -<<< Could not download PDB/mmCIF file: 7FST-1 -<<< Could not download PDB/mmCIF file: 7FT5-3 -<<< Could not download PDB/mmCIF file: 7FV8-1 -<<< Could not download PDB/mmCIF file: 7FWM-1 -<<< Could not download PDB/mmCIF file: 7FXY-1 -<<< Could not download PDB/mmCIF file: 7FZ1-1 -<<< Could not download PDB/mmCIF file: 7G00-6 -<<< Could not download PDB/mmCIF file: 7G18-1 -<<< Could not download PDB/mmCIF file: 7G8J-1 -<<< Could not download PDB/mmCIF file: 7PN4-1 -<<< Could not download PDB/mmCIF file: 7PQK-1 -<<< Could not download PDB/mmCIF file: 7PSC-1 -<<< Could not download PDB/mmCIF file: 7QP3-1 -<<< Could not download PDB/mmCIF file: 7QQ7-1 -<<< Could not download PDB/mmCIF file: 7QRR-4 -<<< Could not download PDB/mmCIF file: 7QW4-11 -<<< Could not download PDB/mmCIF file: 7R2P-1 -<<< Could not download PDB/mmCIF file: 7RIZ-1 -<<< Could not download PDB/mmCIF file: 7S1F-2 -<<< Could not download PDB/mmCIF file: 7T2M-1 -<<< Could not download PDB/mmCIF file: 7T9R-1 -<<< Could not download PDB/mmCIF file: 7TI1-1 -<<< Could not download PDB/mmCIF file: 7TJP-3 -<<< Could not download PDB/mmCIF file: 7TN1-1 -<<< Could not download PDB/mmCIF file: 7TPK-1 -<<< Could not download PDB/mmCIF file: 7TRN-1 -<<< Could not download PDB/mmCIF file: 7TWU-1 -<<< Could not download PDB/mmCIF file: 7TXW-1 -<<< Could not download PDB/mmCIF file: 7U1B-1 -<<< Could not download PDB/mmCIF file: 7U64-5 -<<< Could not download PDB/mmCIF file: 7UAH-2 -<<< Could not download PDB/mmCIF file: 7UK8-1 -<<< Could not download PDB/mmCIF file: 7ULJ-4 -<<< Could not download PDB/mmCIF file: 7UMY-2 -<<< Could not download PDB/mmCIF file: 7UOX-2 -<<< Could not download PDB/mmCIF file: 7UQN-1 -<<< Could not download PDB/mmCIF file: 7USI-6 -<<< Could not download PDB/mmCIF file: 7WH9-1 -<<< Could not download PDB/mmCIF file: 7WJG-1 -<<< Could not download PDB/mmCIF file: 7WL2-1 -<<< Could not download PDB/mmCIF file: 7WN1-1 -<<< Could not download PDB/mmCIF file: 7WR1-4 -<<< Could not download PDB/mmCIF file: 7WSX-1 -<<< Could not download PDB/mmCIF file: 7WZM-1 -<<< Could not download PDB/mmCIF file: 7X1C-1 -<<< Could not download PDB/mmCIF file: 7X43-1 -<<< Could not download PDB/mmCIF file: 7X7Z-1 -<<< Could not download PDB/mmCIF file: 7XB6-3 -<<< Could not download PDB/mmCIF file: 7XHH-1 -<<< Could not download PDB/mmCIF file: 7XK8-1 -<<< Could not download PDB/mmCIF file: 7XQC-2 -<<< Could not download PDB/mmCIF file: 7XSB-1 -<<< Could not download PDB/mmCIF file: 7XTV-4 -<<< Could not download PDB/mmCIF file: 7XW0-2 -<<< Could not download PDB/mmCIF file: 7XXI-1 -<<< Could not download PDB/mmCIF file: 7XZ0-1 -<<< Could not download PDB/mmCIF file: 7Y0D-1 -<<< Could not download PDB/mmCIF file: 7Y36-1 -<<< Could not download PDB/mmCIF file: 7Y4X-1 -<<< Could not download PDB/mmCIF file: 7YBC-1 -<<< Could not download PDB/mmCIF file: 7YH9-2 -<<< Could not download PDB/mmCIF file: 7YLS-1 -<<< Could not download 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file: 8AJ7-1 -<<< Could not download PDB/mmCIF file: 8APU-1 -<<< Could not download PDB/mmCIF file: 8ARV-1 -<<< Could not download PDB/mmCIF file: 8AUN-1 -<<< Could not download PDB/mmCIF file: 8AWD-1 -<<< Could not download PDB/mmCIF file: 8AYO-1 -<<< Could not download PDB/mmCIF file: 8B1O-1 -<<< Could not download PDB/mmCIF file: 8B5B-1 -<<< Could not download PDB/mmCIF file: 8B8E-1 -<<< Could not download PDB/mmCIF file: 8BAB-1 -<<< Could not download PDB/mmCIF file: 8BDI-3 -<<< Could not download PDB/mmCIF file: 8BF2-1 -<<< Could not download PDB/mmCIF file: 8BGY-1 -<<< Could not download PDB/mmCIF file: 8BIJ-1 -<<< Could not download PDB/mmCIF file: 8BLS-2 -<<< Could not download PDB/mmCIF file: 8BQF-4 -<<< Could not download PDB/mmCIF file: 8BSN-1 -<<< Could not download PDB/mmCIF file: 8BX7-1 -<<< Could not download PDB/mmCIF file: 8C19-2 -<<< Could not download PDB/mmCIF file: 8C6G-2 -<<< Could not download PDB/mmCIF file: 8CAR-1 -<<< Could not download PDB/mmCIF file: 8CEJ-2 -<<< Could not download PDB/mmCIF file: 8CJ0-1 -<<< Could not download PDB/mmCIF file: 8CQY-1 -<<< Could not download PDB/mmCIF file: 8CTM-1 -<<< Could not download PDB/mmCIF file: 8CV5-1 -<<< Could not download PDB/mmCIF file: 8D0A-1 -<<< Could not download PDB/mmCIF file: 8D7N-1 -<<< Could not download PDB/mmCIF file: 8DD5-1 -<<< Could not download PDB/mmCIF file: 8DEI-2 -<<< Could not download PDB/mmCIF file: 8DGO-1 -<<< Could not download PDB/mmCIF file: 8DIF-1 -<<< Could not download PDB/mmCIF file: 8DKB-1 -<<< Could not download PDB/mmCIF file: 8DQV-1 -<<< Could not download PDB/mmCIF file: 8DTN-1 -<<< Could not download PDB/mmCIF file: 8DVC-4 -<<< Could not download PDB/mmCIF file: 8E1U-1 -<<< Could not download PDB/mmCIF file: 8E4K-1 -<<< Could not download PDB/mmCIF file: 8E7A-1 -<<< Could not download PDB/mmCIF file: 8EEO-2 -<<< Could not download PDB/mmCIF file: 8EHP-2 -<<< Could not download PDB/mmCIF file: 8ELB-1 -<<< Could not download PDB/mmCIF file: 8EOJ-1 -<<< Could not download PDB/mmCIF file: 8EQR-1 -<<< Could not download PDB/mmCIF file: 8EU9-1 -<<< Could not download PDB/mmCIF file: 8EX1-1 -<<< Could not download PDB/mmCIF file: 8EZ4-1 -<<< Could not download PDB/mmCIF file: 8F1G-2 -<<< Could not download PDB/mmCIF file: 8F57-1 -<<< Could not download PDB/mmCIF file: 8FDT-1 -<<< Could not download PDB/mmCIF file: 8FHN-1 -<<< Could not download PDB/mmCIF file: 8FLY-3 -<<< Could not download PDB/mmCIF file: 8FNS-1 -<<< Could not download PDB/mmCIF file: 8FQW-1 -<<< Could not download PDB/mmCIF file: 8FW1-1 -<<< Could not download PDB/mmCIF file: 8G0K-2 -<<< Could not download PDB/mmCIF file: 8G4U-1 -<<< Could not download PDB/mmCIF file: 8GAR-1 -<<< Could not download PDB/mmCIF file: 8GFK-1 -<<< Could not download PDB/mmCIF file: 8GM9-1 -<<< Could not download PDB/mmCIF file: 8GPY-1 -<<< Could not download PDB/mmCIF file: 8GSQ-1 -<<< Could not download PDB/mmCIF file: 8GV0-1 -<<< Could not download PDB/mmCIF file: 8GZE-2 -<<< Could not download PDB/mmCIF file: 8H3M-1 -<<< Could not download PDB/mmCIF file: 8H8B-1 -<<< Could not download PDB/mmCIF file: 8HHK-2 -<<< Could not download PDB/mmCIF file: 8HLZ-1 -<<< Could not download PDB/mmCIF file: 8HUU-1 -<<< Could not download PDB/mmCIF file: 8I1N-2 -<<< Could not download PDB/mmCIF file: 8I69-1 -<<< Could not download PDB/mmCIF file: 8IBI-1 -<<< Could not download PDB/mmCIF file: 8IIF-1 -<<< Could not download PDB/mmCIF file: 8IQ7-1 -<<< Could not download PDB/mmCIF file: 8J6V-4 -<<< Could not download PDB/mmCIF file: 8OF9-2 -<<< Could not download PDB/mmCIF file: 8OO3-1 -<<< Could not download PDB/mmCIF file: 8OVN-1 -<<< Could not download PDB/mmCIF file: 8P7J-2 -<<< Could not download PDB/mmCIF file: 8SAD-1 -<<< Could not download PDB/mmCIF file: 8SI7-1 -<<< Could not download PDB/mmCIF file: 8SWD-4 -<<< Could not download PDB/mmCIF file: 7RD2-1 -<<< Could not download PDB/mmCIF file: 7WQV-4 -<<< Could not download PDB/mmCIF file: 8AM1-1 -<<< Could not download PDB/mmCIF file: 8D0Q-1 -<<< Could not download PDB/mmCIF file: 8DIR-1 -<<< Could not download PDB/mmCIF file: 8E0P-3 -<<< Could not download PDB/mmCIF file: 8F60-1 -<<< Could not download PDB/mmCIF file: 8G18-1 -<<< Could not download PDB/mmCIF file: 8I5P-1 -<<< Could not download PDB/mmCIF file: 8SMT-4 -<<< Could not download PDB/mmCIF file: 7FSG-4 -<<< Could not download PDB/mmCIF file: 7FST-2 -<<< Could not download PDB/mmCIF file: 7FT5-4 -<<< Could not download PDB/mmCIF file: 7FV9-1 -<<< Could not download PDB/mmCIF file: 7FWN-1 -<<< Could not download PDB/mmCIF file: 7FXZ-1 -<<< Could not download PDB/mmCIF file: 7FZ2-1 -<<< Could not download PDB/mmCIF file: 7G00-7 -<<< Could not download PDB/mmCIF file: 7G19-1 -<<< Could not download PDB/mmCIF file: 7G8K-1 -<<< Could not download PDB/mmCIF file: 7PN5-1 -<<< Could not download PDB/mmCIF file: 7PZQ-1 -<<< Could not download PDB/mmCIF file: 7Q98-1 -<<< Could not download PDB/mmCIF file: 7QAR-1 -<<< Could not download PDB/mmCIF file: 7QU9-1 -<<< Could not download PDB/mmCIF file: 7QW4-12 -<<< Could not download PDB/mmCIF file: 7R1M-1 -<<< Could not download PDB/mmCIF file: 7R2P-2 -<<< Could not download PDB/mmCIF file: 7R5M-1 -<<< Could not download PDB/mmCIF file: 7S1L-1 -<<< Could not download PDB/mmCIF file: 7T2M-2 -<<< Could not download PDB/mmCIF file: 7T9R-2 -<<< Could not download PDB/mmCIF file: 7TJP-4 -<<< Could not download PDB/mmCIF file: 7TPM-1 -<<< Could not download PDB/mmCIF file: 7TRN-2 -<<< Could not download PDB/mmCIF file: 7TXY-1 -<<< Could not download PDB/mmCIF file: 7U1C-1 -<<< Could not download PDB/mmCIF file: 7U64-6 -<<< Could not download PDB/mmCIF file: 7UAK-1 -<<< Could not download PDB/mmCIF file: 7UCC-1 -<<< Could not download PDB/mmCIF file: 7UKA-1 -<<< Could not download PDB/mmCIF file: 7ULK-1 -<<< Could not download PDB/mmCIF file: 7UMZ-1 -<<< Could not download PDB/mmCIF file: 7UOY-1 -<<< Could not download PDB/mmCIF file: 7UQO-1 -<<< Could not download PDB/mmCIF file: 7USJ-1 -<<< Could not download PDB/mmCIF file: 7UUR-1 -<<< Could not download PDB/mmCIF file: 7UWU-1 -<<< Could not download PDB/mmCIF file: 7UY4-1 -<<< Could not download PDB/mmCIF file: 7WHA-1 -<<< Could not download PDB/mmCIF file: 7WN2-1 -<<< Could not download PDB/mmCIF file: 7WR2-1 -<<< Could not download PDB/mmCIF file: 7WZO-1 -<<< Could not download PDB/mmCIF file: 7X44-1 -<<< Could not download PDB/mmCIF file: 7X7Z-2 -<<< Could not download PDB/mmCIF file: 7XB6-4 -<<< Could not download PDB/mmCIF file: 7XDE-1 -<<< Could not download PDB/mmCIF file: 7XEN-1 -<<< Could not download PDB/mmCIF file: 7XK9-1 -<<< Could not download PDB/mmCIF file: 7XQE-1 -<<< Could not download PDB/mmCIF file: 7XSB-2 -<<< Could not download PDB/mmCIF file: 7XTW-1 -<<< Could not download PDB/mmCIF file: 7XZ2-1 -<<< Could not download PDB/mmCIF file: 7Y37-1 -<<< Could not download PDB/mmCIF file: 7YDH-1 -<<< Could not download PDB/mmCIF file: 7YH9-3 -<<< Could not download PDB/mmCIF file: 7YLT-1 -<<< Could not download 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file: 8AS2-1 -<<< Could not download PDB/mmCIF file: 8AUN-2 -<<< Could not download PDB/mmCIF file: 8AWE-1 -<<< Could not download PDB/mmCIF file: 8AYP-1 -<<< Could not download PDB/mmCIF file: 8B1P-1 -<<< Could not download PDB/mmCIF file: 8B5B-2 -<<< Could not download PDB/mmCIF file: 8B8E-2 -<<< Could not download PDB/mmCIF file: 8BAC-1 -<<< Could not download PDB/mmCIF file: 8BDI-4 -<<< Could not download PDB/mmCIF file: 8BF2-2 -<<< Could not download PDB/mmCIF file: 8BGY-2 -<<< Could not download PDB/mmCIF file: 8BLT-1 -<<< Could not download PDB/mmCIF file: 8BQF-5 -<<< Could not download PDB/mmCIF file: 8BXA-1 -<<< Could not download PDB/mmCIF file: 8C1A-1 -<<< Could not download PDB/mmCIF file: 8C6O-1 -<<< Could not download PDB/mmCIF file: 8CEJ-3 -<<< Could not download PDB/mmCIF file: 8CJ2-1 -<<< Could not download PDB/mmCIF file: 8CR0-1 -<<< Could not download PDB/mmCIF file: 8CTP-1 -<<< Could not download PDB/mmCIF file: 8CV6-1 -<<< Could not download PDB/mmCIF file: 8CYH-1 -<<< Could not download PDB/mmCIF file: 8D51-1 -<<< Could not download PDB/mmCIF file: 8D7N-2 -<<< Could not download PDB/mmCIF file: 8DD7-1 -<<< Could not download PDB/mmCIF file: 8DEI-3 -<<< Could not download PDB/mmCIF file: 8DGP-1 -<<< Could not download PDB/mmCIF file: 8DIG-1 -<<< Could not download PDB/mmCIF file: 8DKB-2 -<<< Could not download PDB/mmCIF file: 8DTN-2 -<<< Could not download PDB/mmCIF file: 8DVC-5 -<<< Could not download PDB/mmCIF file: 8E1U-2 -<<< Could not download PDB/mmCIF file: 8E4K-2 -<<< Could not download PDB/mmCIF file: 8E7B-1 -<<< Could not download PDB/mmCIF file: 8EHR-1 -<<< Could not download PDB/mmCIF file: 8ELB-2 -<<< Could not download PDB/mmCIF file: 8EOL-1 -<<< Could not download PDB/mmCIF file: 8EQR-2 -<<< Could not download PDB/mmCIF file: 8EUA-1 -<<< Could not download PDB/mmCIF file: 8EX2-1 -<<< Could not download PDB/mmCIF file: 8EZ4-2 -<<< Could not download PDB/mmCIF file: 8F23-1 -<<< Could not download PDB/mmCIF file: 8F58-1 -<<< Could not download PDB/mmCIF file: 8F7U-1 -<<< Could not download PDB/mmCIF file: 8FDU-1 -<<< Could not download PDB/mmCIF file: 8FHO-1 -<<< Could not download PDB/mmCIF file: 8FLY-4 -<<< Could not download PDB/mmCIF file: 8FNT-1 -<<< Could not download PDB/mmCIF file: 8FQW-2 -<<< Could not download PDB/mmCIF file: 8FW1-2 -<<< Could not download PDB/mmCIF file: 8G0L-1 -<<< Could not download PDB/mmCIF file: 8G4U-2 -<<< Could not download PDB/mmCIF file: 8GB1-1 -<<< Could not download PDB/mmCIF file: 8GFL-1 -<<< Could not download PDB/mmCIF file: 8GM9-2 -<<< Could not download PDB/mmCIF file: 8GPY-2 -<<< Could not download PDB/mmCIF file: 8GSQ-2 -<<< Could not download PDB/mmCIF file: 8GV0-2 -<<< Could not download PDB/mmCIF file: 8GZF-1 -<<< Could not download PDB/mmCIF file: 8H3N-1 -<<< Could not download PDB/mmCIF file: 8H8C-1 -<<< Could not download PDB/mmCIF file: 8HHO-1 -<<< Could not download PDB/mmCIF file: 8HM0-1 -<<< Could not download PDB/mmCIF file: 8HUV-1 -<<< Could not download 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file: 8G18-2 -<<< Could not download PDB/mmCIF file: 8I5P-2 -<<< Could not download PDB/mmCIF file: 7FSH-1 -<<< Could not download PDB/mmCIF file: 7FST-3 -<<< Could not download PDB/mmCIF file: 7FT6-1 -<<< Could not download PDB/mmCIF file: 7FVA-1 -<<< Could not download PDB/mmCIF file: 7FWO-1 -<<< Could not download PDB/mmCIF file: 7FY0-1 -<<< Could not download PDB/mmCIF file: 7FZ3-1 -<<< Could not download PDB/mmCIF file: 7G00-8 -<<< Could not download PDB/mmCIF file: 7G1A-1 -<<< Could not download PDB/mmCIF file: 7G8L-1 -<<< Could not download PDB/mmCIF file: 7PN6-1 -<<< Could not download PDB/mmCIF file: 7Q98-2 -<<< Could not download PDB/mmCIF file: 7QP5-1 -<<< Could not download PDB/mmCIF file: 7QU9-2 -<<< Could not download PDB/mmCIF file: 7QW4-13 -<<< Could not download PDB/mmCIF file: 7QZX-1 -<<< Could not download PDB/mmCIF file: 7R1N-1 -<<< Could not download PDB/mmCIF file: 7R2R-1 -<<< Could not download PDB/mmCIF file: 7R3T-1 -<<< Could not download PDB/mmCIF file: 7S1L-2 -<<< Could not download PDB/mmCIF file: 7T9R-3 -<<< Could not download PDB/mmCIF file: 7TRP-1 -<<< Could not download PDB/mmCIF file: 7TU9-1 -<<< Could not download PDB/mmCIF file: 7TXY-2 -<<< Could not download PDB/mmCIF file: 7U64-7 -<<< Could not download PDB/mmCIF file: 7UCD-1 -<<< Could not download PDB/mmCIF file: 7UKB-1 -<<< Could not download PDB/mmCIF file: 7ULK-2 -<<< Could not download PDB/mmCIF file: 7UOY-2 -<<< Could not download PDB/mmCIF file: 7UQU-1 -<<< Could not download PDB/mmCIF file: 7USJ-2 -<<< Could not download PDB/mmCIF file: 7UWU-2 -<<< Could not download PDB/mmCIF file: 7UY4-2 -<<< Could not download PDB/mmCIF file: 7WHA-2 -<<< Could not download PDB/mmCIF file: 7WN2-2 -<<< Could not download PDB/mmCIF file: 7WR4-1 -<<< Could not download PDB/mmCIF file: 7WZU-1 -<<< Could not download PDB/mmCIF file: 7X80-1 -<<< Could not download PDB/mmCIF file: 7XDF-1 -<<< Could not download PDB/mmCIF file: 7XHK-1 -<<< Could not download PDB/mmCIF file: 7XK9-2 -<<< Could not download PDB/mmCIF file: 7XOF-1 -<<< Could not download PDB/mmCIF file: 7XQE-2 -<<< Could not download PDB/mmCIF file: 7XSB-3 -<<< Could not download PDB/mmCIF file: 7XTX-1 -<<< Could not download PDB/mmCIF file: 7XZ2-2 -<<< Could not download PDB/mmCIF file: 7Y7N-1 -<<< Could not download PDB/mmCIF file: 7Y9C-1 -<<< Could not download PDB/mmCIF file: 7YDJ-1 -<<< Could not download PDB/mmCIF file: 7YH9-4 -<<< Could not download PDB/mmCIF file: 7YLT-2 -<<< Could not download PDB/mmCIF file: 7YQF-1 -<<< Could not download PDB/mmCIF file: 7YVK-1 -<<< Could not download PDB/mmCIF file: 7YX7-1 -<<< Could not download PDB/mmCIF file: 7Z58-1 -<<< Could not download PDB/mmCIF file: 7Z6D-2 -<<< Could not download PDB/mmCIF file: 7ZI8-1 -<<< Could not download PDB/mmCIF file: 7ZLM-2 -<<< Could not download PDB/mmCIF file: 7ZPF-2 -<<< Could not download PDB/mmCIF file: 7ZT4-1 -<<< Could not download PDB/mmCIF file: 7ZUV-3 -<<< Could not download PDB/mmCIF file: 7ZYB-1 -<<< Could not download 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-<<< Could not download PDB/mmCIF file: 8EHS-1 -<<< Could not download PDB/mmCIF file: 8ELC-1 -<<< Could not download PDB/mmCIF file: 8EOM-1 -<<< Could not download PDB/mmCIF file: 8EQR-3 -<<< Could not download PDB/mmCIF file: 8EUD-1 -<<< Could not download PDB/mmCIF file: 8EX3-1 -<<< Could not download PDB/mmCIF file: 8EZD-1 -<<< Could not download PDB/mmCIF file: 8F24-1 -<<< Could not download PDB/mmCIF file: 8F5D-1 -<<< Could not download PDB/mmCIF file: 8F7U-2 -<<< Could not download PDB/mmCIF file: 8FBG-1 -<<< Could not download PDB/mmCIF file: 8FDX-1 -<<< Could not download PDB/mmCIF file: 8FHP-1 -<<< Could not download PDB/mmCIF file: 8FLZ-1 -<<< Could not download PDB/mmCIF file: 8FNU-1 -<<< Could not download PDB/mmCIF file: 8FQX-1 -<<< Could not download PDB/mmCIF file: 8FW1-3 -<<< Could not download PDB/mmCIF file: 8G0P-1 -<<< Could not download PDB/mmCIF file: 8G4V-1 -<<< Could not download PDB/mmCIF file: 8GB1-2 -<<< Could not download PDB/mmCIF file: 8GFM-1 -<<< Could not download PDB/mmCIF file: 8GMC-1 -<<< Could not download PDB/mmCIF file: 8GPZ-1 -<<< Could not download PDB/mmCIF file: 8GSQ-3 -<<< Could not download PDB/mmCIF file: 8GV0-3 -<<< Could not download PDB/mmCIF file: 8GZF-2 -<<< Could not download PDB/mmCIF file: 8H3W-1 -<<< Could not download PDB/mmCIF file: 8HHT-1 -<<< Could not download PDB/mmCIF file: 8HMP-1 -<<< Could not download PDB/mmCIF file: 8HUW-1 -<<< Could not download PDB/mmCIF file: 8I1O-2 -<<< Could not download PDB/mmCIF file: 8I6B-1 -<<< Could not download PDB/mmCIF file: 8IBJ-1 -<<< Could not download PDB/mmCIF file: 8IIH-1 -<<< Could not download PDB/mmCIF file: 8IQU-1 -<<< Could not download PDB/mmCIF file: 8J6V-6 -<<< Could not download PDB/mmCIF file: 8OFD-1 -<<< Could not download PDB/mmCIF file: 8OO5-1 -<<< Could not download PDB/mmCIF file: 8OVP-1 -<<< Could not download PDB/mmCIF file: 8P82-1 -<<< Could not download PDB/mmCIF file: 8SAH-1 -<<< Could not download PDB/mmCIF file: 8SIA-1 -<<< Could not download 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file: 7PDO-1 -<<< Could not download PDB/mmCIF file: 7PN7-1 -<<< Could not download PDB/mmCIF file: 7Q98-3 -<<< Could not download PDB/mmCIF file: 7QNR-1 -<<< Could not download PDB/mmCIF file: 7QP5-2 -<<< Could not download PDB/mmCIF file: 7QU9-3 -<<< Could not download PDB/mmCIF file: 7QW4-14 -<<< Could not download PDB/mmCIF file: 7QZY-1 -<<< Could not download PDB/mmCIF file: 7R2R-2 -<<< Could not download PDB/mmCIF file: 7R3U-1 -<<< Could not download PDB/mmCIF file: 7SZR-1 -<<< Could not download PDB/mmCIF file: 7T4F-1 -<<< Could not download PDB/mmCIF file: 7T9R-4 -<<< Could not download PDB/mmCIF file: 7TRQ-1 -<<< Could not download PDB/mmCIF file: 7TUA-1 -<<< Could not download PDB/mmCIF file: 7TXY-3 -<<< Could not download PDB/mmCIF file: 7U64-8 -<<< Could not download PDB/mmCIF file: 7U8S-1 -<<< Could not download PDB/mmCIF file: 7UJ2-1 -<<< Could not download PDB/mmCIF file: 7ULL-1 -<<< Could not download PDB/mmCIF file: 7UP1-1 -<<< Could not download PDB/mmCIF file: 7UQU-2 -<<< Could not download PDB/mmCIF file: 7USK-1 -<<< Could not download PDB/mmCIF file: 7UYA-1 -<<< Could not download PDB/mmCIF file: 7V0B-1 -<<< Could not download PDB/mmCIF file: 7WJK-1 -<<< Could not download PDB/mmCIF file: 7WPG-1 -<<< Could not download PDB/mmCIF file: 7WR5-1 -<<< Could not download PDB/mmCIF file: 7WZU-2 -<<< Could not download PDB/mmCIF file: 7X48-1 -<<< Could not download PDB/mmCIF file: 7X81-1 -<<< Could not download PDB/mmCIF file: 7XBC-1 -<<< Could not download PDB/mmCIF file: 7XDG-1 -<<< Could not download PDB/mmCIF file: 7XEP-1 -<<< Could not download PDB/mmCIF file: 7XHL-1 -<<< Could not download PDB/mmCIF file: 7XKA-1 -<<< Could not download PDB/mmCIF file: 7XON-1 -<<< Could not download PDB/mmCIF file: 7XQK-1 -<<< Could not download PDB/mmCIF file: 7XSB-4 -<<< Could not download PDB/mmCIF file: 7XTY-1 -<<< Could not download PDB/mmCIF file: 7XZ3-1 -<<< Could not download PDB/mmCIF file: 7Y54-1 -<<< Could not download PDB/mmCIF file: 7Y7O-1 -<<< Could not download PDB/mmCIF file: 7Y9C-2 -<<< Could not download PDB/mmCIF file: 7YDL-1 -<<< Could not download PDB/mmCIF file: 7YH9-5 -<<< Could not download PDB/mmCIF file: 7YLT-3 -<<< Could not download PDB/mmCIF file: 7YNX-1 -<<< Could not download PDB/mmCIF file: 7YQM-1 -<<< Could not download PDB/mmCIF file: 7YVL-1 -<<< Could not download PDB/mmCIF file: 7YX9-1 -<<< Could not download PDB/mmCIF file: 7Z58-2 -<<< Could not download PDB/mmCIF file: 7Z6E-1 -<<< Could not download PDB/mmCIF file: 7Z9Z-1 -<<< Could not download PDB/mmCIF file: 7ZDA-1 -<<< Could not download PDB/mmCIF file: 7ZI9-1 -<<< Could not download PDB/mmCIF file: 7ZJS-1 -<<< Could not download PDB/mmCIF file: 7ZLM-3 -<<< Could not download PDB/mmCIF file: 7ZNY-1 -<<< Could not download PDB/mmCIF file: 7ZPF-3 -<<< Could not download PDB/mmCIF file: 7ZT5-1 -<<< Could not download PDB/mmCIF file: 7ZUV-4 -<<< Could not download PDB/mmCIF file: 7ZYC-1 -<<< Could not download PDB/mmCIF file: 8A24-1 -<<< Could not download 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file: 8C6P-1 -<<< Could not download PDB/mmCIF file: 8CBH-1 -<<< Could not download PDB/mmCIF file: 8CEK-2 -<<< Could not download PDB/mmCIF file: 8CJD-1 -<<< Could not download PDB/mmCIF file: 8CR4-1 -<<< Could not download PDB/mmCIF file: 8CV7-2 -<<< Could not download PDB/mmCIF file: 8D2T-1 -<<< Could not download PDB/mmCIF file: 8D6H-1 -<<< Could not download PDB/mmCIF file: 8D7O-2 -<<< Could not download PDB/mmCIF file: 8DII-1 -<<< Could not download PDB/mmCIF file: 8DKB-4 -<<< Could not download PDB/mmCIF file: 8DM6-1 -<<< Could not download PDB/mmCIF file: 8DNV-1 -<<< Could not download PDB/mmCIF file: 8DP8-1 -<<< Could not download PDB/mmCIF file: 8DTN-4 -<<< Could not download PDB/mmCIF file: 8E1U-4 -<<< Could not download PDB/mmCIF file: 8E7C-1 -<<< Could not download PDB/mmCIF file: 8EHT-1 -<<< Could not download PDB/mmCIF file: 8ELE-1 -<<< Could not download PDB/mmCIF file: 8EOO-1 -<<< Could not download PDB/mmCIF file: 8EQR-4 -<<< Could not download PDB/mmCIF file: 8EUD-2 -<<< Could not download PDB/mmCIF file: 8EX4-1 -<<< Could not download PDB/mmCIF file: 8EZE-1 -<<< Could not download PDB/mmCIF file: 8F28-1 -<<< Could not download PDB/mmCIF file: 8F5F-1 -<<< Could not download PDB/mmCIF file: 8F7V-1 -<<< Could not download PDB/mmCIF file: 8FBG-2 -<<< Could not download PDB/mmCIF file: 8FDY-1 -<<< Could not download PDB/mmCIF file: 8FHQ-1 -<<< Could not download PDB/mmCIF file: 8FLZ-2 -<<< Could not download PDB/mmCIF file: 8FNY-1 -<<< Could not download PDB/mmCIF file: 8FQY-1 -<<< Could not download PDB/mmCIF file: 8FWA-2 -<<< Could not download PDB/mmCIF file: 8G0Q-1 -<<< Could not download PDB/mmCIF file: 8G52-1 -<<< Could not download PDB/mmCIF file: 8GB2-1 -<<< Could not download PDB/mmCIF file: 8GFN-1 -<<< Could not download PDB/mmCIF file: 8GMC-2 -<<< Could not download PDB/mmCIF file: 8GQ0-1 -<<< Could not download PDB/mmCIF file: 8GSQ-4 -<<< Could not download PDB/mmCIF file: 8GV0-4 -<<< Could not download PDB/mmCIF file: 8GZO-1 -<<< Could not download PDB/mmCIF file: 8H3X-1 -<<< Could not download PDB/mmCIF file: 8HHU-1 -<<< Could not download PDB/mmCIF file: 8HMQ-1 -<<< Could not download PDB/mmCIF file: 8HUX-1 -<<< Could not download PDB/mmCIF file: 8I1T-1 -<<< Could not download PDB/mmCIF file: 8I6C-1 -<<< Could not download PDB/mmCIF file: 8IBL-1 -<<< Could not download PDB/mmCIF file: 8III-1 -<<< Could not download PDB/mmCIF file: 8IRR-1 -<<< Could not download PDB/mmCIF file: 8J6V-7 -<<< Could not download PDB/mmCIF file: 8OFG-1 -<<< Could not download PDB/mmCIF file: 8OOD-1 -<<< Could not download PDB/mmCIF file: 8OVR-1 -<<< Could not download PDB/mmCIF file: 8P8P-1 -<<< Could not download PDB/mmCIF file: 8SBI-1 -<<< Could not download PDB/mmCIF file: 8SIB-1 -<<< Could not download PDB/mmCIF file: 8SXO-1 -<<< Could not download PDB/mmCIF file: 7RDG-2 -<<< Could not download PDB/mmCIF file: 7WQV-7 -<<< Could not download PDB/mmCIF file: 7Y9A-1 -<<< Could not download PDB/mmCIF file: 8AQU-1 -<<< Could not download 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-<<< Could not download PDB/mmCIF file: 7XEQ-1 -<<< Could not download PDB/mmCIF file: 7XHL-2 -<<< Could not download PDB/mmCIF file: 7XKA-2 -<<< Could not download PDB/mmCIF file: 7XOO-1 -<<< Could not download PDB/mmCIF file: 7XQL-1 -<<< Could not download PDB/mmCIF file: 7XSC-1 -<<< Could not download PDB/mmCIF file: 7XTY-2 -<<< Could not download PDB/mmCIF file: 7XXM-1 -<<< Could not download PDB/mmCIF file: 7XZ3-2 -<<< Could not download PDB/mmCIF file: 7Y9G-1 -<<< Could not download PDB/mmCIF file: 7YBR-1 -<<< Could not download PDB/mmCIF file: 7YDL-2 -<<< Could not download PDB/mmCIF file: 7YH9-6 -<<< Could not download PDB/mmCIF file: 7YLT-4 -<<< Could not download PDB/mmCIF file: 7YNX-2 -<<< Could not download PDB/mmCIF file: 7YQN-1 -<<< Could not download PDB/mmCIF file: 7YVM-1 -<<< Could not download PDB/mmCIF file: 7YX9-2 -<<< Could not download PDB/mmCIF file: 7Z58-3 -<<< Could not download PDB/mmCIF file: 7Z6E-2 -<<< Could not download PDB/mmCIF file: 7ZA0-1 -<<< Could not download PDB/mmCIF file: 7ZB9-1 -<<< Could not download PDB/mmCIF file: 7ZDB-1 -<<< Could not download PDB/mmCIF file: 7ZIA-1 -<<< Could not download PDB/mmCIF file: 7ZJS-2 -<<< Could not download PDB/mmCIF file: 7ZLM-4 -<<< Could not download PDB/mmCIF file: 7ZNZ-1 -<<< Could not download PDB/mmCIF file: 7ZPF-4 -<<< Could not download PDB/mmCIF file: 7ZT6-1 -<<< Could not download PDB/mmCIF file: 8A25-1 -<<< Could not download PDB/mmCIF file: 8A51-1 -<<< Could not download PDB/mmCIF file: 8AA9-1 -<<< Could not download PDB/mmCIF file: 8AFI-5 -<<< Could not download PDB/mmCIF file: 8AJI-3 -<<< Could not download PDB/mmCIF file: 8ANP-2 -<<< Could not download PDB/mmCIF file: 8AS4-2 -<<< Could not download PDB/mmCIF file: 8AUP-1 -<<< Could not download PDB/mmCIF file: 8AWI-1 -<<< Could not download PDB/mmCIF file: 8AYQ-2 -<<< Could not download PDB/mmCIF file: 8B8E-5 -<<< Could not download PDB/mmCIF file: 8BC4-1 -<<< Could not download PDB/mmCIF file: 8BDJ-3 -<<< Could not download 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not download PDB/mmCIF file: 8AQ2-1 -<<< Could not download PDB/mmCIF file: 8AUP-2 -<<< Could not download PDB/mmCIF file: 8AWN-1 -<<< Could not download PDB/mmCIF file: 8AYR-1 -<<< Could not download PDB/mmCIF file: 8BAK-1 -<<< Could not download PDB/mmCIF file: 8BC5-1 -<<< Could not download PDB/mmCIF file: 8BDJ-4 -<<< Could not download PDB/mmCIF file: 8BFA-1 -<<< Could not download PDB/mmCIF file: 8BH0-2 -<<< Could not download PDB/mmCIF file: 8BIU-1 -<<< Could not download PDB/mmCIF file: 8BQI-1 -<<< Could not download PDB/mmCIF file: 8BXR-1 -<<< Could not download PDB/mmCIF file: 8C23-2 -<<< Could not download PDB/mmCIF file: 8C6S-1 -<<< Could not download PDB/mmCIF file: 8CBR-1 -<<< Could not download PDB/mmCIF file: 8CEQ-1 -<<< Could not download PDB/mmCIF file: 8CJE-1 -<<< Could not download PDB/mmCIF file: 8CR7-2 -<<< Could not download PDB/mmCIF file: 8D2W-1 -<<< Could not download PDB/mmCIF file: 8D7P-2 -<<< Could not download PDB/mmCIF file: 8D9Y-1 -<<< Could not download 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-<<< Could not download PDB/mmCIF file: 8IBM-1 -<<< Could not download PDB/mmCIF file: 8IIL-1 -<<< Could not download PDB/mmCIF file: 8IRT-1 -<<< Could not download PDB/mmCIF file: 8J6V-9 -<<< Could not download PDB/mmCIF file: 8OFH-2 -<<< Could not download PDB/mmCIF file: 8OOV-1 -<<< Could not download PDB/mmCIF file: 8OVZ-2 -<<< Could not download PDB/mmCIF file: 8P9G-1 -<<< Could not download PDB/mmCIF file: 8SBN-1 -<<< Could not download PDB/mmCIF file: 8SJF-1 -<<< Could not download PDB/mmCIF file: 8SZB-1 -<<< Could not download PDB/mmCIF file: 7WR3-1 -<<< Could not download PDB/mmCIF file: 8AQW-1 -<<< Could not download PDB/mmCIF file: 8C1V-1 -<<< Could not download PDB/mmCIF file: 8D0X-1 -<<< Could not download PDB/mmCIF file: 8DL1-1 -<<< Could not download PDB/mmCIF file: 8F8W-2 -<<< Could not download PDB/mmCIF file: 8G27-1 -<<< Could not download PDB/mmCIF file: 8I5U-1 -<<< Could not download PDB/mmCIF file: 7FSI-1 -<<< Could not download PDB/mmCIF file: 7FSU-3 -<<< Could not download PDB/mmCIF file: 7FT7-1 -<<< Could not download PDB/mmCIF file: 7FVE-1 -<<< Could not download PDB/mmCIF file: 7FWS-1 -<<< Could not download PDB/mmCIF file: 7FY4-1 -<<< Could not download PDB/mmCIF file: 7FZ7-1 -<<< Could not download PDB/mmCIF file: 7G03-1 -<<< Could not download PDB/mmCIF file: 7G1E-1 -<<< Could not download PDB/mmCIF file: 7G8P-1 -<<< Could not download PDB/mmCIF file: 7PLJ-1 -<<< Could not download PDB/mmCIF file: 7PNA-1 -<<< Could not download PDB/mmCIF file: 7Q8E-2 -<<< Could not download PDB/mmCIF file: 7Q99-1 -<<< Could not download PDB/mmCIF file: 7QNT-1 -<<< Could not download PDB/mmCIF file: 7QQI-1 -<<< Could not download PDB/mmCIF file: 7QT3-1 -<<< Could not download PDB/mmCIF file: 7QW4-17 -<<< Could not download PDB/mmCIF file: 7R2T-1 -<<< Could not download PDB/mmCIF file: 7SH7-1 -<<< Could not download PDB/mmCIF file: 7SKF-1 -<<< Could not download PDB/mmCIF file: 7SXH-1 -<<< Could not download PDB/mmCIF file: 7T8P-1 -<<< Could not download 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-<<< Could not download PDB/mmCIF file: 7ZPH-1 -<<< Could not download PDB/mmCIF file: 7ZT8-1 -<<< Could not download PDB/mmCIF file: 7ZV1-2 -<<< Could not download PDB/mmCIF file: 8A53-2 -<<< Could not download PDB/mmCIF file: 8A6U-1 -<<< Could not download PDB/mmCIF file: 8A8S-1 -<<< Could not download PDB/mmCIF file: 8ACW-1 -<<< Could not download PDB/mmCIF file: 8AFI-7 -<<< Could not download PDB/mmCIF file: 8AJJ-1 -<<< Could not download PDB/mmCIF file: 8ANP-4 -<<< Could not download PDB/mmCIF file: 8AQ3-1 -<<< Could not download PDB/mmCIF file: 8ASI-1 -<<< Could not download PDB/mmCIF file: 8AUQ-1 -<<< Could not download PDB/mmCIF file: 8AWO-1 -<<< Could not download PDB/mmCIF file: 8AYR-2 -<<< Could not download PDB/mmCIF file: 8B8H-1 -<<< Could not download PDB/mmCIF file: 8BAL-1 -<<< Could not download PDB/mmCIF file: 8BC6-1 -<<< Could not download PDB/mmCIF file: 8BDK-1 -<<< Could not download PDB/mmCIF file: 8BFB-1 -<<< Could not download PDB/mmCIF file: 8BH0-3 -<<< Could not download PDB/mmCIF file: 8BIV-1 -<<< Could not download PDB/mmCIF file: 8BQJ-1 -<<< Could not download PDB/mmCIF file: 8BT1-1 -<<< Could not download PDB/mmCIF file: 8BXU-1 -<<< Could not download PDB/mmCIF file: 8C25-1 -<<< Could not download PDB/mmCIF file: 8C6T-1 -<<< Could not download PDB/mmCIF file: 8CBS-1 -<<< Could not download PDB/mmCIF file: 8CEQ-2 -<<< Could not download PDB/mmCIF file: 8CJE-2 -<<< Could not download PDB/mmCIF file: 8CRG-1 -<<< Could not download PDB/mmCIF file: 8CVQ-1 -<<< Could not download PDB/mmCIF file: 8CYX-1 -<<< Could not download PDB/mmCIF file: 8D2X-1 -<<< Could not download PDB/mmCIF file: 8D58-1 -<<< Could not download PDB/mmCIF file: 8D6L-1 -<<< Could not download PDB/mmCIF file: 8D7Q-1 -<<< Could not download PDB/mmCIF file: 8D9Y-2 -<<< Could not download PDB/mmCIF file: 8DBC-1 -<<< Could not download PDB/mmCIF file: 8DGU-1 -<<< Could not download PDB/mmCIF file: 8DKB-7 -<<< Could not download PDB/mmCIF file: 8DMD-1 -<<< Could not download 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file: 8FWN-1 -<<< Could not download PDB/mmCIF file: 8G0S-1 -<<< Could not download PDB/mmCIF file: 8G59-1 -<<< Could not download PDB/mmCIF file: 8GBB-1 -<<< Could not download PDB/mmCIF file: 8GFQ-1 -<<< Could not download PDB/mmCIF file: 8GMF-1 -<<< Could not download PDB/mmCIF file: 8GQC-1 -<<< Could not download PDB/mmCIF file: 8GSR-2 -<<< Could not download PDB/mmCIF file: 8H3Y-3 -<<< Could not download PDB/mmCIF file: 8H8J-1 -<<< Could not download PDB/mmCIF file: 8HDJ-3 -<<< Could not download PDB/mmCIF file: 8HI6-1 -<<< Could not download PDB/mmCIF file: 8HMU-1 -<<< Could not download PDB/mmCIF file: 8I1Z-1 -<<< Could not download PDB/mmCIF file: 8I6G-1 -<<< Could not download PDB/mmCIF file: 8IBM-2 -<<< Could not download PDB/mmCIF file: 8IIM-1 -<<< Could not download PDB/mmCIF file: 8IRU-1 -<<< Could not download PDB/mmCIF file: 8J79-1 -<<< Could not download PDB/mmCIF file: 8OFH-3 -<<< Could not download PDB/mmCIF file: 8OP0-1 -<<< Could not download PDB/mmCIF file: 8OW2-1 -<<< Could not download PDB/mmCIF file: 8P9H-1 -<<< Could not download PDB/mmCIF file: 8SBO-1 -<<< Could not download PDB/mmCIF file: 8SJG-1 -<<< Could not download PDB/mmCIF file: 8SZD-1 -<<< Could not download PDB/mmCIF file: 7WR3-2 -<<< Could not download PDB/mmCIF file: 7ZBC-1 -<<< Could not download PDB/mmCIF file: 8C3V-1 -<<< Could not download PDB/mmCIF file: 8DL1-2 -<<< Could not download PDB/mmCIF file: 8F8X-1 -<<< Could not download PDB/mmCIF file: 8G2J-1 -<<< Could not download PDB/mmCIF file: 8I5X-1 -<<< Could not download PDB/mmCIF file: 7E45-1 -<<< Could not download PDB/mmCIF file: 7FSI-2 -<<< Could not download PDB/mmCIF file: 7FSU-4 -<<< Could not download PDB/mmCIF file: 7FT7-2 -<<< Could not download PDB/mmCIF file: 7FVF-1 -<<< Could not download PDB/mmCIF file: 7FWT-1 -<<< Could not download PDB/mmCIF file: 7FY5-1 -<<< Could not download PDB/mmCIF file: 7FZ8-1 -<<< Could not download PDB/mmCIF file: 7G04-1 -<<< Could not download PDB/mmCIF file: 7G1F-1 -<<< Could not download PDB/mmCIF file: 7G8Q-1 -<<< Could not download PDB/mmCIF file: 7PLJ-2 -<<< Could not download PDB/mmCIF file: 7Q4J-1 -<<< Could not download PDB/mmCIF file: 7Q9A-1 -<<< Could not download PDB/mmCIF file: 7QNT-2 -<<< Could not download PDB/mmCIF file: 7QQJ-1 -<<< Could not download PDB/mmCIF file: 7QT3-2 -<<< Could not download PDB/mmCIF file: 7QW4-18 -<<< Could not download PDB/mmCIF file: 7R2U-1 -<<< Could not download PDB/mmCIF file: 7R3Z-1 -<<< Could not download PDB/mmCIF file: 7SH8-1 -<<< Could not download PDB/mmCIF file: 7SKG-1 -<<< Could not download PDB/mmCIF file: 7SXJ-1 -<<< Could not download PDB/mmCIF file: 7T1D-1 -<<< Could not download PDB/mmCIF file: 7T8P-2 -<<< Could not download PDB/mmCIF file: 7TKX-1 -<<< Could not download PDB/mmCIF file: 7TRU-1 -<<< Could not download PDB/mmCIF file: 7TZO-1 -<<< Could not download PDB/mmCIF file: 7UE3-1 -<<< Could not download PDB/mmCIF file: 7UFN-2 -<<< Could not download PDB/mmCIF file: 7UH3-1 -<<< Could not download 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file: 7Y57-1 -<<< Could not download PDB/mmCIF file: 7Y7Y-1 -<<< Could not download PDB/mmCIF file: 7Y9J-1 -<<< Could not download PDB/mmCIF file: 7YC0-2 -<<< Could not download PDB/mmCIF file: 7YDP-1 -<<< Could not download PDB/mmCIF file: 7YHA-3 -<<< Could not download PDB/mmCIF file: 7YJF-1 -<<< Could not download PDB/mmCIF file: 7YM0-1 -<<< Could not download PDB/mmCIF file: 7YRP-1 -<<< Could not download PDB/mmCIF file: 7YVR-1 -<<< Could not download PDB/mmCIF file: 7YXB-1 -<<< Could not download PDB/mmCIF file: 7Z35-1 -<<< Could not download PDB/mmCIF file: 7Z5B-1 -<<< Could not download PDB/mmCIF file: 7Z6E-5 -<<< Could not download PDB/mmCIF file: 7Z89-2 -<<< Could not download PDB/mmCIF file: 7ZBB-1 -<<< Could not download PDB/mmCIF file: 7ZDE-1 -<<< Could not download PDB/mmCIF file: 7ZIC-2 -<<< Could not download PDB/mmCIF file: 7ZLP-1 -<<< Could not download PDB/mmCIF file: 7ZO3-1 -<<< Could not download PDB/mmCIF file: 7ZT9-1 -<<< Could not download PDB/mmCIF file: 7ZV1-3 -<<< Could not download PDB/mmCIF file: 8A53-3 -<<< Could not download PDB/mmCIF file: 8A6V-1 -<<< Could not download PDB/mmCIF file: 8A8T-1 -<<< Could not download PDB/mmCIF file: 8AAE-1 -<<< Could not download PDB/mmCIF file: 8ACY-1 -<<< Could not download PDB/mmCIF file: 8AFI-8 -<<< Could not download PDB/mmCIF file: 8AJJ-2 -<<< Could not download PDB/mmCIF file: 8ANQ-1 -<<< Could not download PDB/mmCIF file: 8AQ4-1 -<<< Could not download PDB/mmCIF file: 8AUQ-2 -<<< Could not download PDB/mmCIF file: 8AWP-1 -<<< Could not download PDB/mmCIF file: 8B28-1 -<<< Could not download PDB/mmCIF file: 8BAL-2 -<<< Could not download PDB/mmCIF file: 8BC6-2 -<<< Could not download PDB/mmCIF file: 8BDK-2 -<<< Could not download PDB/mmCIF file: 8BFC-1 -<<< Could not download PDB/mmCIF file: 8BH0-4 -<<< Could not download PDB/mmCIF file: 8BIW-1 -<<< Could not download PDB/mmCIF file: 8BQK-1 -<<< Could not download PDB/mmCIF file: 8BXV-1 -<<< Could not download PDB/mmCIF file: 8C25-2 -<<< Could not download PDB/mmCIF file: 8C6Z-1 -<<< Could not download PDB/mmCIF file: 8CBT-1 -<<< Could not download PDB/mmCIF file: 8CER-1 -<<< Could not download PDB/mmCIF file: 8CJE-3 -<<< Could not download PDB/mmCIF file: 8CRI-1 -<<< Could not download PDB/mmCIF file: 8CTT-1 -<<< Could not download PDB/mmCIF file: 8CVQ-2 -<<< Could not download PDB/mmCIF file: 8D59-1 -<<< Could not download PDB/mmCIF file: 8D7S-1 -<<< Could not download PDB/mmCIF file: 8D9Y-3 -<<< Could not download PDB/mmCIF file: 8DBE-1 -<<< Could not download PDB/mmCIF file: 8DEO-1 -<<< Could not download PDB/mmCIF file: 8DGV-1 -<<< Could not download PDB/mmCIF file: 8DKB-8 -<<< Could not download PDB/mmCIF file: 8DMJ-1 -<<< Could not download PDB/mmCIF file: 8DNZ-1 -<<< Could not download PDB/mmCIF file: 8DP9-2 -<<< Could not download PDB/mmCIF file: 8DS9-1 -<<< Could not download PDB/mmCIF file: 8E0N-2 -<<< Could not download PDB/mmCIF file: 8E7Q-1 -<<< Could not download PDB/mmCIF file: 8ECM-3 -<<< Could not download 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file: 8H4I-1 -<<< Could not download PDB/mmCIF file: 8H97-1 -<<< Could not download PDB/mmCIF file: 8HDJ-4 -<<< Could not download PDB/mmCIF file: 8HIQ-1 -<<< Could not download PDB/mmCIF file: 8HMV-1 -<<< Could not download PDB/mmCIF file: 8HWP-1 -<<< Could not download PDB/mmCIF file: 8I27-1 -<<< Could not download PDB/mmCIF file: 8I6G-2 -<<< Could not download PDB/mmCIF file: 8IBR-1 -<<< Could not download PDB/mmCIF file: 8IIN-1 -<<< Could not download PDB/mmCIF file: 8IRV-1 -<<< Could not download PDB/mmCIF file: 8J8P-1 -<<< Could not download PDB/mmCIF file: 8OFJ-1 -<<< Could not download PDB/mmCIF file: 8OPI-1 -<<< Could not download PDB/mmCIF file: 8OW3-1 -<<< Could not download PDB/mmCIF file: 8P9I-1 -<<< Could not download PDB/mmCIF file: 8SBO-2 -<<< Could not download PDB/mmCIF file: 8SJG-2 -<<< Could not download PDB/mmCIF file: 8SZE-1 -<<< Could not download PDB/mmCIF file: 7ZBE-1 -<<< Could not download PDB/mmCIF file: 8C3V-2 -<<< Could not download PDB/mmCIF file: 8D3T-1 -<<< Could not download PDB/mmCIF file: 8DL1-3 -<<< Could not download PDB/mmCIF file: 8FBW-1 -<<< Could not download PDB/mmCIF file: 8G3M-1 -<<< Could not download PDB/mmCIF file: 8I5Y-1 -<<< Could not download PDB/mmCIF file: 7FRV-1 -<<< Could not download PDB/mmCIF file: 7FSI-3 -<<< Could not download PDB/mmCIF file: 7FSV-1 -<<< Could not download PDB/mmCIF file: 7FT7-3 -<<< Could not download PDB/mmCIF file: 7FVG-1 -<<< Could not download PDB/mmCIF file: 7FWT-2 -<<< Could not download PDB/mmCIF file: 7FY6-1 -<<< Could not download PDB/mmCIF file: 7FZ9-1 -<<< Could not download PDB/mmCIF file: 7G04-2 -<<< Could not download PDB/mmCIF file: 7G1G-1 -<<< Could not download PDB/mmCIF file: 7G8R-1 -<<< Could not download PDB/mmCIF file: 7Q9B-1 -<<< Could not download PDB/mmCIF file: 7QNT-3 -<<< Could not download PDB/mmCIF file: 7QQJ-2 -<<< Could not download PDB/mmCIF file: 7QT4-1 -<<< Could not download PDB/mmCIF file: 7QW4-19 -<<< Could not download PDB/mmCIF file: 7R3Z-2 -<<< Could not download PDB/mmCIF file: 7SH9-1 -<<< Could not download PDB/mmCIF file: 7SVE-1 -<<< Could not download PDB/mmCIF file: 7T8Q-1 -<<< Could not download PDB/mmCIF file: 7TKY-1 -<<< Could not download PDB/mmCIF file: 7TNC-1 -<<< Could not download PDB/mmCIF file: 7TSV-1 -<<< Could not download PDB/mmCIF file: 7UE4-1 -<<< Could not download PDB/mmCIF file: 7UFO-1 -<<< Could not download PDB/mmCIF file: 7UJ6-1 -<<< Could not download PDB/mmCIF file: 7ULQ-10 -<<< Could not download PDB/mmCIF file: 7UN2-1 -<<< Could not download PDB/mmCIF file: 7UR2-1 -<<< Could not download PDB/mmCIF file: 7UV8-1 -<<< Could not download PDB/mmCIF file: 7VE0-2 -<<< Could not download PDB/mmCIF file: 7W7O-1 -<<< Could not download PDB/mmCIF file: 7WN8-1 -<<< Could not download PDB/mmCIF file: 7X1Y-1 -<<< Could not download PDB/mmCIF file: 7X86-1 -<<< Could not download PDB/mmCIF file: 7X9G-1 -<<< Could not download PDB/mmCIF file: 7XBJ-1 -<<< Could not download PDB/mmCIF file: 7XDR-1 -<<< Could not download 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file: 7YZT-1 -<<< Could not download PDB/mmCIF file: 7Z5B-2 -<<< Could not download PDB/mmCIF file: 7Z6G-1 -<<< Could not download PDB/mmCIF file: 7Z8A-1 -<<< Could not download PDB/mmCIF file: 7ZBB-2 -<<< Could not download PDB/mmCIF file: 7ZDF-1 -<<< Could not download PDB/mmCIF file: 7ZIC-3 -<<< Could not download PDB/mmCIF file: 7ZLR-1 -<<< Could not download PDB/mmCIF file: 7ZO4-1 -<<< Could not download PDB/mmCIF file: 7ZPN-1 -<<< Could not download PDB/mmCIF file: 8A53-4 -<<< Could not download PDB/mmCIF file: 8A6W-1 -<<< Could not download PDB/mmCIF file: 8AAI-1 -<<< Could not download PDB/mmCIF file: 8AD0-1 -<<< Could not download PDB/mmCIF file: 8AFJ-1 -<<< Could not download PDB/mmCIF file: 8AJJ-3 -<<< Could not download PDB/mmCIF file: 8ANQ-2 -<<< Could not download PDB/mmCIF file: 8AWS-1 -<<< Could not download PDB/mmCIF file: 8AYV-1 -<<< Could not download PDB/mmCIF file: 8B29-1 -<<< Could not download PDB/mmCIF file: 8B5P-1 -<<< Could not download PDB/mmCIF file: 8BAL-3 -<<< Could not download PDB/mmCIF file: 8BC6-3 -<<< Could not download PDB/mmCIF file: 8BDL-1 -<<< Could not download PDB/mmCIF file: 8BHC-1 -<<< Could not download PDB/mmCIF file: 8BIX-1 -<<< Could not download PDB/mmCIF file: 8BQL-1 -<<< Could not download PDB/mmCIF file: 8BXW-1 -<<< Could not download PDB/mmCIF file: 8C2G-1 -<<< Could not download PDB/mmCIF file: 8C70-1 -<<< Could not download PDB/mmCIF file: 8CBU-1 -<<< Could not download PDB/mmCIF file: 8CER-2 -<<< Could not download PDB/mmCIF file: 8CJE-4 -<<< Could not download PDB/mmCIF file: 8CRI-2 -<<< Could not download PDB/mmCIF file: 8CTT-2 -<<< Could not download PDB/mmCIF file: 8CZ8-1 -<<< Could not download PDB/mmCIF file: 8D2Z-1 -<<< Could not download PDB/mmCIF file: 8D5B-1 -<<< Could not download PDB/mmCIF file: 8D6N-1 -<<< Could not download PDB/mmCIF file: 8D9Y-4 -<<< Could not download PDB/mmCIF file: 8DBG-1 -<<< Could not download PDB/mmCIF file: 8DEO-2 -<<< Could not download PDB/mmCIF file: 8DGW-1 -<<< Could not download PDB/mmCIF file: 8DKC-1 -<<< Could not download PDB/mmCIF file: 8DML-1 -<<< Could not download PDB/mmCIF file: 8DO0-1 -<<< Could not download PDB/mmCIF file: 8DPA-1 -<<< Could not download PDB/mmCIF file: 8DSA-1 -<<< Could not download PDB/mmCIF file: 8E0O-1 -<<< Could not download PDB/mmCIF file: 8E4T-1 -<<< Could not download PDB/mmCIF file: 8E7R-1 -<<< Could not download PDB/mmCIF file: 8EA5-1 -<<< Could not download PDB/mmCIF file: 8ECM-4 -<<< Could not download PDB/mmCIF file: 8EIL-2 -<<< Could not download PDB/mmCIF file: 8ELO-1 -<<< Could not download PDB/mmCIF file: 8ER0-1 -<<< Could not download PDB/mmCIF file: 8EXF-1 -<<< Could not download PDB/mmCIF file: 8EZP-1 -<<< Could not download PDB/mmCIF file: 8F2L-2 -<<< Could not download PDB/mmCIF file: 8F5K-3 -<<< Could not download PDB/mmCIF file: 8F88-2 -<<< Could not download PDB/mmCIF file: 8FBM-1 -<<< Could not download PDB/mmCIF file: 8FEE-1 -<<< Could not download PDB/mmCIF file: 8FM0-3 -<<< Could not download 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file: 8J8Q-1 -<<< Could not download PDB/mmCIF file: 8OFL-1 -<<< Could not download PDB/mmCIF file: 8OPQ-1 -<<< Could not download PDB/mmCIF file: 8OWA-1 -<<< Could not download PDB/mmCIF file: 8P9I-2 -<<< Could not download PDB/mmCIF file: 8SBR-1 -<<< Could not download PDB/mmCIF file: 8SJH-1 -<<< Could not download PDB/mmCIF file: 8SZE-2 -<<< Could not download PDB/mmCIF file: 7WR9-1 -<<< Could not download PDB/mmCIF file: 8C3V-3 -<<< Could not download PDB/mmCIF file: 8D3T-2 -<<< Could not download PDB/mmCIF file: 8DL1-4 -<<< Could not download PDB/mmCIF file: 8FBW-2 -<<< Could not download PDB/mmCIF file: 8G3O-1 -<<< Could not download PDB/mmCIF file: 8IBK-1 -<<< Could not download PDB/mmCIF file: 7FRV-2 -<<< Could not download PDB/mmCIF file: 7FSI-4 -<<< Could not download PDB/mmCIF file: 7FSV-2 -<<< Could not download PDB/mmCIF file: 7FT7-4 -<<< Could not download PDB/mmCIF file: 7FVH-1 -<<< Could not download PDB/mmCIF file: 7FWU-1 -<<< Could not download PDB/mmCIF file: 7FY7-1 -<<< Could not download PDB/mmCIF file: 7FZA-1 -<<< Could not download PDB/mmCIF file: 7G05-1 -<<< Could not download PDB/mmCIF file: 7G1H-1 -<<< Could not download PDB/mmCIF file: 7G8S-1 -<<< Could not download PDB/mmCIF file: 7QNT-4 -<<< Could not download PDB/mmCIF file: 7QPF-1 -<<< Could not download PDB/mmCIF file: 7QW4-2 -<<< Could not download PDB/mmCIF file: 7R3Z-3 -<<< Could not download PDB/mmCIF file: 7SVF-1 -<<< Could not download PDB/mmCIF file: 7T8Q-2 -<<< Could not download PDB/mmCIF file: 7TND-1 -<<< Could not download PDB/mmCIF file: 7TSW-1 -<<< Could not download PDB/mmCIF file: 7UCQ-1 -<<< Could not download PDB/mmCIF file: 7UE5-1 -<<< Could not download PDB/mmCIF file: 7UJ6-2 -<<< Could not download PDB/mmCIF file: 7ULQ-11 -<<< Could not download PDB/mmCIF file: 7UR2-2 -<<< Could not download PDB/mmCIF file: 7UVA-1 -<<< Could not download PDB/mmCIF file: 7VE2-1 -<<< Could not download PDB/mmCIF file: 7VX2-1 -<<< Could not download PDB/mmCIF file: 7WJQ-1 -<<< Could not download PDB/mmCIF file: 7WN8-2 -<<< Could not download PDB/mmCIF file: 7X1Z-1 -<<< Could not download PDB/mmCIF file: 7X4F-1 -<<< Could not download PDB/mmCIF file: 7X86-2 -<<< Could not download PDB/mmCIF file: 7XBJ-2 -<<< Could not download PDB/mmCIF file: 7XDR-2 -<<< Could not download PDB/mmCIF file: 7XHQ-2 -<<< Could not download PDB/mmCIF file: 7XJA-1 -<<< Could not download PDB/mmCIF file: 7XME-4 -<<< Could not download PDB/mmCIF file: 7XOT-1 -<<< Could not download PDB/mmCIF file: 7XQX-1 -<<< Could not download PDB/mmCIF file: 7XUC-1 -<<< Could not download PDB/mmCIF file: 7XWF-1 -<<< Could not download PDB/mmCIF file: 7XXP-2 -<<< Could not download PDB/mmCIF file: 7Y0S-1 -<<< Could not download PDB/mmCIF file: 7Y3H-1 -<<< Could not download PDB/mmCIF file: 7Y86-1 -<<< Could not download PDB/mmCIF file: 7Y9K-1 -<<< Could not download PDB/mmCIF file: 7YDT-2 -<<< Could not download PDB/mmCIF file: 7YHB-1 -<<< Could not download PDB/mmCIF file: 7YJG-1 -<<< Could not download PDB/mmCIF file: 7YM8-1 -<<< Could not download PDB/mmCIF file: 7YRQ-1 -<<< Could not download PDB/mmCIF file: 7YYE-2 -<<< Could not download PDB/mmCIF file: 7YZT-2 -<<< Could not download PDB/mmCIF file: 7Z5B-3 -<<< Could not download PDB/mmCIF file: 7Z6G-2 -<<< Could not download PDB/mmCIF file: 7ZBD-1 -<<< Could not download PDB/mmCIF file: 7ZDG-1 -<<< Could not download PDB/mmCIF file: 7ZLS-1 -<<< Could not download PDB/mmCIF file: 7ZO5-1 -<<< Could not download PDB/mmCIF file: 7ZPO-1 -<<< Could not download PDB/mmCIF file: 8A29-1 -<<< Could not download PDB/mmCIF file: 8A6W-2 -<<< Could not download PDB/mmCIF file: 8AAI-2 -<<< Could not download PDB/mmCIF file: 8AD3-1 -<<< Could not download PDB/mmCIF file: 8AFN-1 -<<< Could not download PDB/mmCIF file: 8AHS-1 -<<< Could not download PDB/mmCIF file: 8AJK-1 -<<< Could not download PDB/mmCIF file: 8ANR-1 -<<< Could not download PDB/mmCIF file: 8ASR-1 -<<< Could not download PDB/mmCIF file: 8AWU-1 -<<< Could not download PDB/mmCIF file: 8B2A-1 -<<< Could not download PDB/mmCIF file: 8BAL-4 -<<< Could not download PDB/mmCIF file: 8BC7-1 -<<< Could not download PDB/mmCIF file: 8BDL-2 -<<< Could not download PDB/mmCIF file: 8BHC-2 -<<< Could not download PDB/mmCIF file: 8BIZ-1 -<<< Could not download PDB/mmCIF file: 8BM5-1 -<<< Could not download PDB/mmCIF file: 8BQM-1 -<<< Could not download PDB/mmCIF file: 8BT6-1 -<<< Could not download PDB/mmCIF file: 8BXX-1 -<<< Could not download PDB/mmCIF file: 8C2O-1 -<<< Could not download PDB/mmCIF file: 8C71-1 -<<< Could not download PDB/mmCIF file: 8CBV-1 -<<< Could not download PDB/mmCIF file: 8CES-1 -<<< Could not download PDB/mmCIF file: 8CJF-1 -<<< Could not download PDB/mmCIF file: 8CRJ-1 -<<< Could not download PDB/mmCIF file: 8CTV-1 -<<< Could not download PDB/mmCIF file: 8CZ8-2 -<<< Could not download PDB/mmCIF file: 8D2Z-2 -<<< Could not download PDB/mmCIF file: 8D9Z-1 -<<< Could not download PDB/mmCIF file: 8DBI-1 -<<< Could not download PDB/mmCIF file: 8DGW-2 -<<< Could not download PDB/mmCIF file: 8DIP-1 -<<< Could not download PDB/mmCIF file: 8DKD-1 -<<< Could not download PDB/mmCIF file: 8DML-2 -<<< Could not download PDB/mmCIF file: 8DO1-1 -<<< Could not download PDB/mmCIF file: 8DPB-1 -<<< Could not download PDB/mmCIF file: 8DSC-1 -<<< Could not download PDB/mmCIF file: 8DTU-1 -<<< Could not download PDB/mmCIF file: 8E0Q-1 -<<< Could not download PDB/mmCIF file: 8E7W-1 -<<< Could not download PDB/mmCIF file: 8EA6-1 -<<< Could not download PDB/mmCIF file: 8ECM-5 -<<< Could not download PDB/mmCIF file: 8EFM-1 -<<< Could not download PDB/mmCIF file: 8EIL-3 -<<< Could not download PDB/mmCIF file: 8ELP-1 -<<< Could not download PDB/mmCIF file: 8ER0-2 -<<< Could not download PDB/mmCIF file: 8EUR-1 -<<< Could not download PDB/mmCIF file: 8EXG-1 -<<< Could not download PDB/mmCIF file: 8EZU-1 -<<< Could not download PDB/mmCIF file: 8F2L-3 -<<< Could not download PDB/mmCIF file: 8F5K-4 -<<< Could not download PDB/mmCIF file: 8F88-3 -<<< Could not download PDB/mmCIF file: 8FBM-2 -<<< Could not download PDB/mmCIF file: 8FEF-1 -<<< Could not download PDB/mmCIF file: 8FM0-4 -<<< Could not download PDB/mmCIF file: 8FO3-4 -<<< Could not download PDB/mmCIF file: 8FT6-1 -<<< Could not download PDB/mmCIF file: 8FWX-2 -<<< Could not download PDB/mmCIF file: 8G0V-1 -<<< Could not download PDB/mmCIF file: 8G5E-1 -<<< Could not download PDB/mmCIF file: 8GBV-2 -<<< Could not download PDB/mmCIF file: 8GFU-1 -<<< Could not download PDB/mmCIF file: 8GMF-4 -<<< Could not download PDB/mmCIF file: 8GQR-2 -<<< Could not download PDB/mmCIF file: 8GST-1 -<<< Could not download PDB/mmCIF file: 8GV8-1 -<<< Could not download PDB/mmCIF file: 8H0F-1 -<<< Could not download PDB/mmCIF file: 8H4L-1 -<<< Could not download PDB/mmCIF file: 8H99-1 -<<< Could not download PDB/mmCIF file: 8HDP-1 -<<< Could not download PDB/mmCIF file: 8HIV-1 -<<< Could not download PDB/mmCIF file: 8HN3-1 -<<< Could not download PDB/mmCIF file: 8HX3-2 -<<< Could not download PDB/mmCIF file: 8I29-1 -<<< Could not download PDB/mmCIF file: 8I6H-2 -<<< Could not download PDB/mmCIF file: 8IBS-2 -<<< Could not download PDB/mmCIF file: 8IIP-1 -<<< Could not download PDB/mmCIF file: 8ITH-1 -<<< Could not download PDB/mmCIF file: 8JAT-1 -<<< Could not download PDB/mmCIF file: 8OFO-1 -<<< Could not download PDB/mmCIF file: 8OPZ-1 -<<< Could not download PDB/mmCIF file: 8OWG-1 -<<< Could not download PDB/mmCIF file: 8P9J-1 -<<< Could not download PDB/mmCIF file: 8SBV-1 -<<< Could not download PDB/mmCIF file: 8SJI-1 -<<< Could not download PDB/mmCIF file: 8T1A-1 -<<< Could not download PDB/mmCIF file: 7QUO-1 -<<< Could not download PDB/mmCIF file: 7WRH-1 -<<< Could not download PDB/mmCIF file: 7X2N-1 -<<< Could not download PDB/mmCIF file: 7YCK-1 -<<< Could not download PDB/mmCIF file: 7ZYL-1 -<<< Could not download PDB/mmCIF file: 8C6I-1 -<<< Could not download PDB/mmCIF file: 8D3Z-1 -<<< Could not download PDB/mmCIF file: 8DL2-1 -<<< Could not download PDB/mmCIF file: 8FD7-1 -<<< Could not download PDB/mmCIF file: 8G3Q-1 -<<< Could not download PDB/mmCIF file: 8IBT-1 -<<< Could not download PDB/mmCIF file: 7E47-1 -<<< Could not download PDB/mmCIF file: 7FRW-1 -<<< Could not download PDB/mmCIF file: 7FSJ-1 -<<< Could not download PDB/mmCIF file: 7FSV-3 -<<< Could not download PDB/mmCIF file: 7FT8-1 -<<< Could not download PDB/mmCIF file: 7FVI-1 -<<< Could not download PDB/mmCIF file: 7FWV-1 -<<< Could not download PDB/mmCIF file: 7FY8-1 -<<< Could not download PDB/mmCIF file: 7FZA-2 -<<< Could not download PDB/mmCIF file: 7G06-1 -<<< Could not download PDB/mmCIF file: 7G1I-1 -<<< Could not download PDB/mmCIF file: 7G8T-1 -<<< Could not download PDB/mmCIF file: 7PVL-1 -<<< Could not download PDB/mmCIF file: 7QNU-1 -<<< Could not download PDB/mmCIF file: 7QPF-2 -<<< Could not download PDB/mmCIF file: 7QW4-20 -<<< Could not download PDB/mmCIF file: 7R3Z-4 -<<< Could not download PDB/mmCIF file: 7R5X-1 -<<< Could not download PDB/mmCIF file: 7RYD-1 -<<< Could not download PDB/mmCIF file: 7SCS-1 -<<< Could not download PDB/mmCIF file: 7SVG-1 -<<< Could not download PDB/mmCIF file: 7TDY-1 -<<< Could not download PDB/mmCIF file: 7TGP-1 -<<< Could not download PDB/mmCIF file: 7TSW-2 -<<< Could not download PDB/mmCIF file: 7TUI-1 -<<< Could not download PDB/mmCIF file: 7UCQ-2 -<<< Could not download PDB/mmCIF file: 7UE6-1 -<<< Could not download PDB/mmCIF file: 7UFQ-1 -<<< Could not download PDB/mmCIF file: 7UH6-1 -<<< Could not download PDB/mmCIF file: 7ULQ-12 -<<< Could not download PDB/mmCIF file: 7UR2-3 -<<< Could not download PDB/mmCIF file: 7UVA-2 -<<< Could not download PDB/mmCIF file: 7VA1-1 -<<< Could not download PDB/mmCIF file: 7VX2-2 -<<< Could not download PDB/mmCIF file: 7WJR-1 -<<< Could not download PDB/mmCIF file: 7WZZ-1 -<<< Could not download PDB/mmCIF file: 7X4G-1 -<<< Could not download PDB/mmCIF file: 7X63-1 -<<< Could not download PDB/mmCIF file: 7X88-1 -<<< Could not download PDB/mmCIF file: 7X9P-1 -<<< Could not download PDB/mmCIF file: 7XBL-1 -<<< Could not download PDB/mmCIF file: 7XDR-3 -<<< Could not download PDB/mmCIF file: 7XHS-1 -<<< Could not download PDB/mmCIF file: 7XJB-1 -<<< Could not download PDB/mmCIF file: 7XMH-1 -<<< Could not download PDB/mmCIF file: 7XQY-1 -<<< Could not download PDB/mmCIF file: 7XUD-1 -<<< Could not download PDB/mmCIF file: 7XWG-1 -<<< Could not download PDB/mmCIF file: 7XXR-1 -<<< Could not download PDB/mmCIF file: 7Y0T-1 -<<< Could not download PDB/mmCIF file: 7Y5F-1 -<<< Could not download PDB/mmCIF file: 7Y9K-2 -<<< Could not download PDB/mmCIF file: 7YC4-1 -<<< Could not download PDB/mmCIF file: 7YDX-1 -<<< Could not download PDB/mmCIF file: 7YHB-2 -<<< Could not download PDB/mmCIF file: 7YJG-2 -<<< Could not download PDB/mmCIF file: 7YM9-1 -<<< Could not download PDB/mmCIF file: 7YON-1 -<<< Could not download PDB/mmCIF file: 7YYE-3 -<<< Could not download PDB/mmCIF file: 7Z6I-1 -<<< Could not download PDB/mmCIF file: 7Z8D-1 -<<< Could not download PDB/mmCIF file: 7ZBD-2 -<<< Could not download PDB/mmCIF file: 7ZDK-1 -<<< Could not download PDB/mmCIF file: 7ZK4-1 -<<< Could not download PDB/mmCIF file: 7ZLS-2 -<<< Could not download PDB/mmCIF file: 7ZO6-1 -<<< Could not download PDB/mmCIF file: 7ZPS-1 -<<< Could not download PDB/mmCIF file: 7ZTF-1 -<<< Could not download PDB/mmCIF file: 7ZV4-1 -<<< Could not download PDB/mmCIF file: 8A29-2 -<<< Could not download PDB/mmCIF file: 8A6Z-1 -<<< Could not download PDB/mmCIF file: 8AAK-1 -<<< Could not download PDB/mmCIF file: 8AD3-2 -<<< Could not download PDB/mmCIF file: 8AFP-1 -<<< Could not download PDB/mmCIF file: 8AHT-1 -<<< Could not download PDB/mmCIF file: 8ASR-2 -<<< Could not download PDB/mmCIF file: 8AWV-1 -<<< Could not download PDB/mmCIF file: 8B2A-2 -<<< Could not download PDB/mmCIF file: 8B8N-1 -<<< Could not download PDB/mmCIF file: 8BAL-5 -<<< Could not download PDB/mmCIF file: 8BC7-2 -<<< Could not download PDB/mmCIF file: 8BDL-3 -<<< Could not download PDB/mmCIF file: 8BHD-1 -<<< Could not download PDB/mmCIF file: 8BJ1-1 -<<< Could not download PDB/mmCIF file: 8BN6-1 -<<< Could not download PDB/mmCIF file: 8BQO-1 -<<< Could not download PDB/mmCIF file: 8BXX-2 -<<< Could not download PDB/mmCIF file: 8C2O-2 -<<< Could not download PDB/mmCIF file: 8C72-1 -<<< Could not download PDB/mmCIF file: 8CBX-1 -<<< Could not download PDB/mmCIF file: 8CES-2 -<<< Could not download PDB/mmCIF file: 8CJF-2 -<<< Could not download PDB/mmCIF file: 8CRL-1 -<<< Could not download PDB/mmCIF file: 8CTV-2 -<<< Could not download PDB/mmCIF file: 8CZ9-1 -<<< Could not download PDB/mmCIF file: 8D0V-1 -<<< Could not download PDB/mmCIF file: 8DA0-1 -<<< Could not download PDB/mmCIF file: 8DBK-1 -<<< Could not download PDB/mmCIF file: 8DGW-3 -<<< Could not download PDB/mmCIF file: 8DIQ-1 -<<< Could not download PDB/mmCIF file: 8DML-3 -<<< Could not download PDB/mmCIF file: 8DO2-1 -<<< Could not download PDB/mmCIF file: 8DSD-1 -<<< Could not download PDB/mmCIF file: 8DWI-1 -<<< Could not download PDB/mmCIF file: 8E0R-1 -<<< Could not download PDB/mmCIF file: 8E4Z-1 -<<< Could not download PDB/mmCIF file: 8E7W-2 -<<< Could not download PDB/mmCIF file: 8EA7-1 -<<< Could not download PDB/mmCIF file: 8ECM-6 -<<< Could not download PDB/mmCIF file: 8EFN-1 -<<< Could not download PDB/mmCIF file: 8EIL-4 -<<< Could not download PDB/mmCIF file: 8ELP-2 -<<< Could not download PDB/mmCIF file: 8ER1-1 -<<< Could not download PDB/mmCIF file: 8EUR-2 -<<< Could not download PDB/mmCIF file: 8EXI-1 -<<< Could not download PDB/mmCIF file: 8EZW-1 -<<< Could not download PDB/mmCIF file: 8F2L-4 -<<< Could not download PDB/mmCIF file: 8F5L-1 -<<< Could not download PDB/mmCIF file: 8F8E-1 -<<< Could not download PDB/mmCIF file: 8FBN-1 -<<< Could not download PDB/mmCIF file: 8FEI-1 -<<< Could not download PDB/mmCIF file: 8FM2-1 -<<< Could not download PDB/mmCIF file: 8FO3-5 -<<< Could not download PDB/mmCIF file: 8FT7-1 -<<< Could not download PDB/mmCIF file: 8FX6-1 -<<< Could not download PDB/mmCIF file: 8G1E-1 -<<< Could not download PDB/mmCIF file: 8G5W-1 -<<< Could not download PDB/mmCIF file: 8GBW-1 -<<< Could not download PDB/mmCIF file: 8GH7-1 -<<< Could not download PDB/mmCIF file: 8GMI-1 -<<< Could not download PDB/mmCIF file: 8GQU-1 -<<< Could not download PDB/mmCIF file: 8GST-2 -<<< Could not download PDB/mmCIF file: 8GV9-1 -<<< Could not download PDB/mmCIF file: 8H0M-1 -<<< Could not download PDB/mmCIF file: 8H9A-1 -<<< Could not download PDB/mmCIF file: 8HDU-1 -<<< Could not download PDB/mmCIF file: 8HIX-1 -<<< Could not download PDB/mmCIF file: 8HN3-2 -<<< Could not download PDB/mmCIF file: 8HXM-1 -<<< Could not download PDB/mmCIF file: 8I2A-1 -<<< Could not download PDB/mmCIF file: 8I6V-1 -<<< Could not download PDB/mmCIF file: 8IBV-1 -<<< Could not download PDB/mmCIF file: 8IIQ-1 -<<< Could not download PDB/mmCIF file: 8IU8-1 -<<< Could not download PDB/mmCIF file: 8JBJ-1 -<<< Could not download PDB/mmCIF file: 8OG3-1 -<<< Could not download 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file: 7FVJ-1 -<<< Could not download PDB/mmCIF file: 7FWW-1 -<<< Could not download PDB/mmCIF file: 7FY8-2 -<<< Could not download PDB/mmCIF file: 7FZB-1 -<<< Could not download PDB/mmCIF file: 7G07-1 -<<< Could not download PDB/mmCIF file: 7G1J-1 -<<< Could not download PDB/mmCIF file: 7G8U-1 -<<< Could not download PDB/mmCIF file: 7QNV-1 -<<< Could not download PDB/mmCIF file: 7QPH-1 -<<< Could not download PDB/mmCIF file: 7QUG-1 -<<< Could not download PDB/mmCIF file: 7QW4-3 -<<< Could not download PDB/mmCIF file: 7R2X-1 -<<< Could not download PDB/mmCIF file: 7R5X-2 -<<< Could not download PDB/mmCIF file: 7RYD-2 -<<< Could not download PDB/mmCIF file: 7SCT-1 -<<< Could not download PDB/mmCIF file: 7SPQ-1 -<<< Could not download PDB/mmCIF file: 7SVH-1 -<<< Could not download PDB/mmCIF file: 7T4T-1 -<<< Could not download PDB/mmCIF file: 7T8S-1 -<<< Could not download PDB/mmCIF file: 7TNF-1 -<<< Could not download PDB/mmCIF file: 7TQ1-1 -<<< Could not download PDB/mmCIF file: 7TSW-3 -<<< Could not download PDB/mmCIF file: 7TZW-1 -<<< Could not download PDB/mmCIF file: 7U6H-1 -<<< Could not download PDB/mmCIF file: 7UCQ-3 -<<< Could not download PDB/mmCIF file: 7UE7-1 -<<< Could not download PDB/mmCIF file: 7UFQ-2 -<<< Could not download PDB/mmCIF file: 7ULQ-2 -<<< Could not download PDB/mmCIF file: 7UR2-4 -<<< Could not download PDB/mmCIF file: 7UVB-1 -<<< Could not download PDB/mmCIF file: 7VA1-2 -<<< Could not download PDB/mmCIF file: 7X00-1 -<<< Could not download PDB/mmCIF file: 7X4H-1 -<<< Could not download PDB/mmCIF file: 7X8B-1 -<<< Could not download PDB/mmCIF file: 7XBM-1 -<<< Could not download PDB/mmCIF file: 7XHU-1 -<<< Could not download PDB/mmCIF file: 7XJB-2 -<<< Could not download PDB/mmCIF file: 7XMJ-1 -<<< Could not download PDB/mmCIF file: 7XQZ-1 -<<< Could not download PDB/mmCIF file: 7XXR-2 -<<< Could not download PDB/mmCIF file: 7Y0U-1 -<<< Could not download PDB/mmCIF file: 7Y3P-1 -<<< Could not download PDB/mmCIF file: 7Y5I-1 -<<< Could not download PDB/mmCIF file: 7Y9L-1 -<<< Could not download PDB/mmCIF file: 7YC4-2 -<<< Could not download PDB/mmCIF file: 7YE3-1 -<<< Could not download PDB/mmCIF file: 7YHC-1 -<<< Could not download PDB/mmCIF file: 7YJH-1 -<<< Could not download PDB/mmCIF file: 7YM9-2 -<<< Could not download PDB/mmCIF file: 7YOO-1 -<<< Could not download PDB/mmCIF file: 7YYE-4 -<<< Could not download PDB/mmCIF file: 7Z6J-1 -<<< Could not download PDB/mmCIF file: 7Z8E-1 -<<< Could not download PDB/mmCIF file: 7ZBF-1 -<<< Could not download PDB/mmCIF file: 7ZDL-1 -<<< Could not download PDB/mmCIF file: 7ZK5-1 -<<< Could not download PDB/mmCIF file: 7ZLS-3 -<<< Could not download PDB/mmCIF file: 7ZO7-1 -<<< Could not download PDB/mmCIF file: 7ZPT-1 -<<< Could not download PDB/mmCIF file: 7ZRW-1 -<<< Could not download PDB/mmCIF file: 7ZTI-1 -<<< Could not download PDB/mmCIF file: 7ZYM-1 -<<< Could not download PDB/mmCIF file: 8A29-3 -<<< Could not download PDB/mmCIF file: 8A58-1 -<<< Could not download PDB/mmCIF file: 8A6Z-2 -<<< Could not download PDB/mmCIF file: 8A8Y-1 -<<< Could not download PDB/mmCIF file: 8AAM-1 -<<< Could not download PDB/mmCIF file: 8AD4-1 -<<< Could not download PDB/mmCIF file: 8AFR-1 -<<< Could not download PDB/mmCIF file: 8AHT-2 -<<< Could not download PDB/mmCIF file: 8AQ8-1 -<<< Could not download PDB/mmCIF file: 8ASS-1 -<<< Could not download PDB/mmCIF file: 8AWW-1 -<<< Could not download PDB/mmCIF file: 8B2B-1 -<<< Could not download PDB/mmCIF file: 8BAQ-1 -<<< Could not download PDB/mmCIF file: 8BC7-3 -<<< Could not download PDB/mmCIF file: 8BDL-4 -<<< Could not download PDB/mmCIF file: 8BHD-2 -<<< Could not download PDB/mmCIF file: 8BJ2-1 -<<< Could not download PDB/mmCIF file: 8BNQ-1 -<<< Could not download PDB/mmCIF file: 8BQP-1 -<<< Could not download PDB/mmCIF file: 8BYA-1 -<<< Could not download PDB/mmCIF file: 8C2P-1 -<<< Could not download PDB/mmCIF file: 8C74-1 -<<< Could not download PDB/mmCIF file: 8CBY-1 -<<< Could not download PDB/mmCIF file: 8CET-1 -<<< Could not download PDB/mmCIF file: 8CJG-1 -<<< Could not download PDB/mmCIF file: 8CRL-2 -<<< Could not download PDB/mmCIF file: 8CTW-1 -<<< Could not download PDB/mmCIF file: 8D0V-2 -<<< Could not download PDB/mmCIF file: 8DA0-2 -<<< Could not download PDB/mmCIF file: 8DBL-1 -<<< Could not download PDB/mmCIF file: 8DDJ-1 -<<< Could not download PDB/mmCIF file: 8DGW-4 -<<< Could not download PDB/mmCIF file: 8DIZ-1 -<<< Could not download PDB/mmCIF file: 8DKF-1 -<<< Could not download PDB/mmCIF file: 8DML-4 -<<< Could not download PDB/mmCIF file: 8DO3-1 -<<< Could not download PDB/mmCIF file: 8DRE-1 -<<< Could not download PDB/mmCIF file: 8DSE-1 -<<< Could not download PDB/mmCIF file: 8DWK-1 -<<< Could not download PDB/mmCIF file: 8E0R-2 -<<< Could not download PDB/mmCIF file: 8E4Z-2 -<<< Could not download PDB/mmCIF file: 8E7X-1 -<<< Could not download PDB/mmCIF file: 8EA8-1 -<<< Could not download PDB/mmCIF file: 8ECM-7 -<<< Could not download PDB/mmCIF file: 8EIM-1 -<<< Could not download PDB/mmCIF file: 8ELQ-1 -<<< Could not download PDB/mmCIF file: 8ER4-1 -<<< Could not download PDB/mmCIF file: 8EUS-1 -<<< Could not download PDB/mmCIF file: 8EXJ-1 -<<< Could not download PDB/mmCIF file: 8EZW-2 -<<< Could not download PDB/mmCIF file: 8F2L-5 -<<< Could not download PDB/mmCIF file: 8F5L-2 -<<< Could not download PDB/mmCIF file: 8F8E-2 -<<< Could not download PDB/mmCIF file: 8FBN-2 -<<< Could not download PDB/mmCIF file: 8FF0-1 -<<< Could not download PDB/mmCIF file: 8FM2-2 -<<< Could not download PDB/mmCIF file: 8FO3-6 -<<< Could not download PDB/mmCIF file: 8FT7-2 -<<< Could not download PDB/mmCIF file: 8FX6-2 -<<< Could not download PDB/mmCIF file: 8G1F-1 -<<< Could not download PDB/mmCIF file: 8G5X-1 -<<< Could not download PDB/mmCIF file: 8GBX-1 -<<< Could not download PDB/mmCIF file: 8GH7-2 -<<< Could not download PDB/mmCIF file: 8GMI-2 -<<< Could not download PDB/mmCIF file: 8GQV-1 -<<< Could not download PDB/mmCIF file: 8GSU-1 -<<< Could not download PDB/mmCIF file: 8GVA-1 -<<< Could not download PDB/mmCIF file: 8H0N-1 -<<< Could not download PDB/mmCIF file: 8H9B-1 -<<< Could not download PDB/mmCIF file: 8HDV-1 -<<< Could not download PDB/mmCIF file: 8HIZ-1 -<<< Could not download PDB/mmCIF file: 8HN6-1 -<<< Could not download PDB/mmCIF file: 8HXS-1 -<<< Could not download PDB/mmCIF file: 8I2C-1 -<<< Could not download PDB/mmCIF file: 8I6Z-1 -<<< Could not download PDB/mmCIF file: 8IC9-1 -<<< Could not download PDB/mmCIF file: 8IIR-1 -<<< Could not download PDB/mmCIF file: 8IU9-1 -<<< Could not download PDB/mmCIF file: 8JBJ-2 -<<< Could not download PDB/mmCIF file: 8OG5-1 -<<< Could not download PDB/mmCIF file: 8OQ1-1 -<<< Could not download PDB/mmCIF file: 8OWG-3 -<<< Could not download PDB/mmCIF file: 8P9L-1 -<<< Could not download PDB/mmCIF file: 8SBW-1 -<<< Could not download PDB/mmCIF file: 8SKF-1 -<<< Could not download PDB/mmCIF file: 8T1B-1 -<<< Could not download PDB/mmCIF file: 7QCL-1 -<<< Could not download PDB/mmCIF file: 7TPU-1 -<<< Could not download PDB/mmCIF file: 7X2X-1 -<<< Could not download PDB/mmCIF file: 7XS3-2 -<<< Could not download PDB/mmCIF file: 7YCL-1 -<<< Could not download PDB/mmCIF file: 8A16-2 -<<< Could not download PDB/mmCIF file: 8CEM-1 -<<< Could not download PDB/mmCIF file: 8DL2-3 -<<< Could not download PDB/mmCIF file: 8EDI-1 -<<< Could not download PDB/mmCIF file: 8FFE-1 -<<< Could not download PDB/mmCIF file: 8G3S-1 -<<< Could not download PDB/mmCIF file: 8IDN-1 -<<< Could not download PDB/mmCIF file: 7E49-1 -<<< Could not download PDB/mmCIF file: 7FRX-1 -<<< Could not download PDB/mmCIF file: 7FSJ-3 -<<< Could not download PDB/mmCIF file: 7FSW-1 -<<< Could not download PDB/mmCIF file: 7FT8-3 -<<< Could not download PDB/mmCIF file: 7FVK-1 -<<< Could not download PDB/mmCIF file: 7FWX-1 -<<< Could not download PDB/mmCIF file: 7FY8-3 -<<< Could not download PDB/mmCIF file: 7FZC-1 -<<< Could not download PDB/mmCIF file: 7G08-1 -<<< Could not download PDB/mmCIF file: 7G1K-1 -<<< Could not download PDB/mmCIF file: 7G8V-1 -<<< Could not download PDB/mmCIF file: 7N8G-1 -<<< Could not download PDB/mmCIF file: 7PE4-1 -<<< Could not download PDB/mmCIF file: 7QUH-1 -<<< Could not download PDB/mmCIF file: 7QW4-4 -<<< Could not download PDB/mmCIF file: 7R2X-2 -<<< Could not download PDB/mmCIF file: 7RYK-1 -<<< Could not download PDB/mmCIF file: 7SCU-1 -<<< Could not download PDB/mmCIF file: 7SVH-2 -<<< Could not download PDB/mmCIF file: 7T4T-2 -<<< Could not download PDB/mmCIF file: 7T8S-2 -<<< Could not download PDB/mmCIF file: 7TQ1-2 -<<< Could not download PDB/mmCIF file: 7TSW-4 -<<< Could not download PDB/mmCIF file: 7TUN-1 -<<< Could not download PDB/mmCIF file: 7TZX-1 -<<< Could not download PDB/mmCIF file: 7U59-1 -<<< Could not download PDB/mmCIF file: 7U6H-2 -<<< Could not download PDB/mmCIF file: 7UCQ-4 -<<< Could not download PDB/mmCIF file: 7UE8-1 -<<< Could not download PDB/mmCIF file: 7ULQ-3 -<<< Could not download PDB/mmCIF file: 7UR2-5 -<<< Could not download PDB/mmCIF file: 7UVC-1 -<<< Could not download PDB/mmCIF file: 7VA1-3 -<<< Could not download PDB/mmCIF file: 7WVZ-1 -<<< Could not download PDB/mmCIF file: 7X4I-1 -<<< Could not download PDB/mmCIF file: 7X66-1 -<<< Could not download PDB/mmCIF file: 7X8B-2 -<<< Could not download PDB/mmCIF file: 7XBM-2 -<<< Could not download PDB/mmCIF file: 7XF3-1 -<<< Could not download PDB/mmCIF file: 7XHW-1 -<<< Could not download PDB/mmCIF file: 7XJB-3 -<<< Could not download PDB/mmCIF file: 7XMJ-2 -<<< Could not download PDB/mmCIF file: 7XR0-1 -<<< Could not download PDB/mmCIF file: 7XUJ-1 -<<< Could not download PDB/mmCIF file: 7XXS-1 -<<< Could not download PDB/mmCIF file: 7Y0X-1 -<<< Could not download PDB/mmCIF file: 7Y3S-1 -<<< Could not download PDB/mmCIF file: 7Y5J-1 -<<< Could not download PDB/mmCIF file: 7Y9L-2 -<<< Could not download PDB/mmCIF file: 7YC4-3 -<<< Could not download PDB/mmCIF file: 7YE4-1 -<<< Could not download PDB/mmCIF file: 7YHC-2 -<<< Could not download PDB/mmCIF file: 7YJH-2 -<<< Could not download PDB/mmCIF file: 7YME-1 -<<< Could not download PDB/mmCIF file: 7YOT-1 -<<< Could not download PDB/mmCIF file: 7YYF-1 -<<< Could not download PDB/mmCIF file: 7YZW-1 -<<< Could not download PDB/mmCIF file: 7ZAB-1 -<<< Could not download PDB/mmCIF file: 7ZDN-1 -<<< Could not download PDB/mmCIF file: 7ZGZ-1 -<<< Could not download PDB/mmCIF file: 7ZK6-1 -<<< Could not download PDB/mmCIF file: 7ZLS-4 -<<< Could not download PDB/mmCIF file: 7ZPU-1 -<<< Could not download PDB/mmCIF file: 7ZRX-1 -<<< Could not download PDB/mmCIF file: 7ZTJ-1 -<<< Could not download PDB/mmCIF file: 7ZV6-1 -<<< Could not download PDB/mmCIF file: 7ZX3-1 -<<< Could not download PDB/mmCIF file: 7ZYN-1 -<<< Could not download PDB/mmCIF file: 8A3X-1 -<<< Could not download PDB/mmCIF file: 8A6Z-3 -<<< Could not download PDB/mmCIF file: 8A8Z-1 -<<< Could not download PDB/mmCIF file: 8AAO-1 -<<< Could not download PDB/mmCIF file: 8AD4-2 -<<< Could not download PDB/mmCIF file: 8AFU-1 -<<< Could not download PDB/mmCIF file: 8AHT-3 -<<< Could not download PDB/mmCIF file: 8AQ8-2 -<<< Could not download PDB/mmCIF file: 8ASS-2 -<<< Could not download PDB/mmCIF file: 8AWX-1 -<<< Could not download PDB/mmCIF file: 8B2B-2 -<<< Could not download PDB/mmCIF file: 8B8U-1 -<<< Could not download PDB/mmCIF file: 8BAT-1 -<<< Could not download PDB/mmCIF file: 8BC8-1 -<<< Could not download PDB/mmCIF file: 8BDM-1 -<<< Could not download PDB/mmCIF file: 8BHD-3 -<<< Could not download PDB/mmCIF file: 8BJ3-1 -<<< Could not download PDB/mmCIF file: 8BNQ-2 -<<< Could not download PDB/mmCIF file: 8BQQ-1 -<<< Could not download PDB/mmCIF file: 8BYH-1 -<<< Could not download PDB/mmCIF file: 8C3C-1 -<<< Could not download PDB/mmCIF file: 8C77-1 -<<< Could not download PDB/mmCIF file: 8CBZ-1 -<<< Could not download PDB/mmCIF file: 8CET-2 -<<< Could not download PDB/mmCIF file: 8CJG-2 -<<< Could not download PDB/mmCIF file: 8CRS-1 -<<< Could not download PDB/mmCIF file: 8CTW-2 -<<< Could not download PDB/mmCIF file: 8D32-1 -<<< Could not download PDB/mmCIF file: 8DA1-1 -<<< Could not download PDB/mmCIF file: 8DBN-1 -<<< Could not download PDB/mmCIF file: 8DDL-1 -<<< Could not download PDB/mmCIF file: 8DEZ-1 -<<< Could not download PDB/mmCIF file: 8DGX-1 -<<< Could not download PDB/mmCIF file: 8DJ0-1 -<<< Could not download PDB/mmCIF file: 8DKF-2 -<<< Could not download PDB/mmCIF file: 8DSF-1 -<<< Could not download PDB/mmCIF file: 8DWK-2 -<<< Could not download PDB/mmCIF file: 8DYR-1 -<<< Could not download PDB/mmCIF file: 8E51-1 -<<< Could not download PDB/mmCIF file: 8E7X-2 -<<< Could not download PDB/mmCIF file: 8EA9-1 -<<< Could not download PDB/mmCIF file: 8ECM-8 -<<< Could not download PDB/mmCIF file: 8EIN-1 -<<< Could not download PDB/mmCIF file: 8EM1-1 -<<< Could not download PDB/mmCIF file: 8EPJ-1 -<<< Could not download PDB/mmCIF file: 8ER4-2 -<<< Could not download PDB/mmCIF file: 8EUS-2 -<<< Could not download PDB/mmCIF file: 8EXK-1 -<<< Could not download PDB/mmCIF file: 8EZW-3 -<<< Could not download PDB/mmCIF file: 8F2L-6 -<<< Could not download PDB/mmCIF file: 8F5N-1 -<<< Could not download PDB/mmCIF file: 8FBO-1 -<<< Could not download PDB/mmCIF file: 8FF6-1 -<<< Could not download PDB/mmCIF file: 8FIB-1 -<<< Could not download PDB/mmCIF file: 8FM2-3 -<<< Could not download PDB/mmCIF file: 8FO4-1 -<<< Could not download PDB/mmCIF file: 8FT8-1 -<<< Could not download PDB/mmCIF file: 8FX7-1 -<<< Could not download PDB/mmCIF file: 8G1N-1 -<<< Could not download PDB/mmCIF file: 8G62-1 -<<< Could not download PDB/mmCIF file: 8GBY-1 -<<< Could not download PDB/mmCIF file: 8GHF-1 -<<< Could not download PDB/mmCIF file: 8GMI-3 -<<< Could not download PDB/mmCIF file: 8GQV-2 -<<< Could not download PDB/mmCIF file: 8GSW-1 -<<< Could not download PDB/mmCIF file: 8H0R-1 -<<< Could not download PDB/mmCIF file: 8H9C-1 -<<< Could not download PDB/mmCIF file: 8HE0-1 -<<< Could not download PDB/mmCIF file: 8HJ0-1 -<<< Could not download PDB/mmCIF file: 8HN7-1 -<<< Could not download PDB/mmCIF file: 8HY4-1 -<<< Could not download PDB/mmCIF file: 8I2D-1 -<<< Could not download PDB/mmCIF file: 8I70-1 -<<< Could not download PDB/mmCIF file: 8IC9-2 -<<< Could not download PDB/mmCIF file: 8IIS-1 -<<< Could not download PDB/mmCIF file: 8IUK-1 -<<< Could not download PDB/mmCIF file: 8JBZ-1 -<<< Could not download PDB/mmCIF file: 8OG6-1 -<<< Could not download PDB/mmCIF file: 8OQC-1 -<<< Could not download PDB/mmCIF file: 8OWI-1 -<<< Could not download PDB/mmCIF file: 8PA6-1 -<<< Could not download PDB/mmCIF file: 8SBW-2 -<<< Could not download PDB/mmCIF file: 8SKH-1 -<<< Could not download PDB/mmCIF file: 8T1C-1 -<<< Too many missing values in total: 148l-1 -<<< Too many missing values in total: 1fvm-6 -<<< Sequence is too short: 2d1k-1 -<<< Sequence is too short: 2vdp-1 -<<< Sequence is too short: 3pma-2 -<<< Too many missing values in the middle: 3rg1-3 -<<< Too many missing values in the ends: 3wsr-2 -<<< Too many missing values in the ends: 4fqx-1 -<<< Unnatural amino acids found: 4gz8-1 -<<< Too many missing values in total: 4kbb-1 -<<< Too many missing values in the middle: 3k6s-5 -<<< Too many missing values in the ends: 4ycg-1 -<<< Too many missing values in the middle: 4zxb-1 -<<< Sequence is too short: 5djd-1 -<<< Too many missing values in the middle: 5es4-2 -<<< Sequence is too short: 5j4x-1 -<<< Unnatural amino acids found: 5jq3-1 -<<< Too many missing values in the middle: 5m3v-1 -<<< Sequence is too short: 5ujt-1 -<<< Too many missing values in total: 5w5s-1 -<<< Unnatural amino acids found: 6hs4-1 -<<< Unknown: 6m8p-4 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in the middle: 6plx-1 -<<< Some chains in the PDB do not appear in the fasta file: 6t2s-3 -<<< Some chains in the PDB do not appear in the fasta file: 6ytp-1 -<<< Some chains in the PDB do not appear in the fasta file: 7b6t-1 -<<< Too many missing values in total: 6x3x-1 -<<< Too many missing values in the middle: 7k9k-1 -<<< Unnatural amino acids found: 7l8x-1 -<<< Too many missing values in total: 7lkf-1 -<<< Too many missing values in the middle: 7mww-1 -<<< Too many missing values in total: 7or1-1 -<<< Incorrect alignment: 7puy-1 -<<< Sequence is too short: 7e9l-1 -<<< Too many missing values in the ends: 7uwm-1 -<<< Too many missing values in total: 7wfw-1 -<<< Too many missing values in the ends: 8as0-7 -<<< Too many missing values in total: 1a09-2 -<<< Too many missing values in total: 7m6e-1 -<<< Too many missing values in the middle: 1b3s-2 -<<< Too many missing values in the middle: 1b9y-1 -<<< Sequence is too short: 1b8h-1 -<<< Too many missing values in total: 1bm2-1 -<<< Sequence is too short: 1cmi-1 -<<< Sequence is too short: 1cq4-1 -<<< Sequence is too short: 1d4t-1 -<<< Sequence is too short: 1ctp-1 -<<< Sequence is too short: 1dei-3 -<<< Sequence is too short: 1d9i-1 -<<< Sequence is too short: 1dit-1 -<<< Too many missing values in the middle: 1dla-3 -<<< Too many missing values in the ends: 1f1j-5 -<<< Sequence is too short: 1ffo-1 -<<< Sequence is too short: 1fyt-1 -<<< Sequence is too short: 1g39-1 -<<< Sequence is too short: 1gwr-2 -<<< Too many missing values in total: 1h0g-1 -<<< Sequence is too short: 1hxy-1 -<<< Too many missing values in total: 1i7w-1 -<<< Too many missing values in total: 1iqk-1 -<<< Too many missing values in the middle: 1h8e-1 -<<< Sequence is too short: 1jht-1 -<<< Too many missing values in total: 1jni-1 -<<< Sequence is too short: 1k6f-3 -<<< Unnatural amino acids found: 1kga-1 -<<< Too many missing values in the ends: 1khq-1 -<<< Too many missing values in the middle: 1ky9-2 -<<< Sequence is too short: 1lvb-5 -<<< Sequence is too short: 1m7e-2 -<<< Sequence is too short: 1mk7-2 -<<< Sequence is too short: 1n5z-3 -<<< Too many missing values in total: 1n4r-5 -<<< Too many missing values in the middle: 1nju-2 -<<< Too many missing values in the ends: 1nrq-1 -<<< Too many missing values in total: 1o3p-1 -<<< Too many missing values in total: 1o5c-1 -<<< Sequence is too short: 1o6k-1 -<<< Sequence is too short: 1oqn-2 -<<< Too many missing values in the middle: 1ozt-4 -<<< Too many missing values in the middle: 1p13-1 -<<< Too many missing values in the ends: 1p4u-1 -<<< Sequence is too short: 1pfb-1 -<<< Too many missing values in total: 1q4q-1 -<<< Too many missing values in the middle: 1q7d-1 -<<< Too many missing values in the middle: 1qx7-4 -<<< Sequence is too short: 1rbe-2 -<<< Sequence is too short: 1s7q-1 -<<< Too many missing values in the middle: 1smr-9 -<<< Too many missing values in the middle: 1t2v-1 -<<< Sequence is too short: 1t5w-1 -<<< Too many missing values in the middle: 1tgg-2 -<<< Sequence is too short: 1tvb-1 -<<< Too many missing values in total: 1u2m-1 -<<< Too many missing values in the middle: 1u83-2 -<<< Too many missing values in the ends: 1ud0-3 -<<< Sequence is too short: 1uma-1 -<<< Too many missing values in the middle: 1vh1-1 -<<< Too many missing values in total: 1w7q-2 -<<< Sequence is too short: 1xda-1 -<<< Sequence is too short: 1ypj-1 -<<< Too many missing values in the middle: 1ytj-1 -<<< Too many missing values in total: 1zea-1 -<<< Sequence is too short: 1zmi-4 -<<< Sequence is too short: 1zhb-4 -<<< Too many missing values in the middle: 1zw0-13 -<<< Sequence is too short: 1zuz-1 -<<< Sequence is too short: 1zsd-1 -<<< Too many missing values in the middle: 1zyc-2 -<<< Too many missing values in the middle: 2abz-1 -<<< Sequence is too short: 2ak4-3 -<<< Too many missing values in the middle: 2at2-1 -<<< Too many missing values in the ends: 2b1a-1 -<<< Too many missing values in total: 2bd2-1 -<<< Sequence is too short: 2bst-1 -<<< Sequence is too short: 2c2l-4 -<<< Too many missing values in the middle: 2cfv-1 -<<< Too many missing values in the ends: 2d11-2 -<<< Too many missing values in the ends: 2df6-2 -<<< Too many missing values in the middle: 2dpx-2 -<<< Too many missing values in the middle: 2drt-1 -<<< Too many missing values in the middle: 2egu-2 -<<< Too many missing values in the middle: 2f0a-4 -<<< Too many missing values in the ends: 2f8e-1 -<<< Too many missing values in total: 2fiv-1 -<<< Sequence is too short: 2fmi-2 -<<< Too many missing values in total: 2fo5-3 -<<< Sequence is too short: 2fym-2 -<<< Too many missing values in the middle: 2hww-1 -<<< Too many missing values in the middle: 2i0i-1 -<<< Sequence is too short: 2hpc-2 -<<< Sequence is too short: 2ins-2 -<<< Sequence is too short: 2j8u-2 -<<< Sequence is too short: 2nw3-1 -<<< Too many missing values in the middle: 2o1w-4 -<<< Too many missing values in the middle: 2o97-1 -<<< Sequence is too short: 2omq-1 -<<< Sequence is too short: 2opz-2 -<<< Too many missing values in the middle: 2ozo-1 -<<< Too many missing values in the middle: 2nut-1 -<<< Sequence is too short: 2p15-1 -<<< Sequence is too short: 2pm5-3 -<<< Sequence is too short: 2pv9-1 -<<< Too many missing values in the middle: 2q7t-1 -<<< Too many missing values in the ends: 2qa7-1 -<<< Too many missing values in the middle: 2qf9-1 -<<< Too many missing values in the ends: 2qj9-1 -<<< Too many missing values in the middle: 2qo7-1 -<<< Too many missing values in the middle: 2qqs-1 -<<< Unnatural amino acids found: 2v5i-1 -<<< Too many missing values in the middle: 2vgc-2 -<<< Sequence is too short: 2vo6-1 -<<< Too many missing values in the ends: 2wph-1 -<<< Sequence is too short: 2ws6-3 -<<< Too many missing values in the middle: 2wuq-1 -<<< Too many missing values in the middle: 2xzd-2 -<<< Sequence is too short: 2xum-1 -<<< Too many missing values in the ends: 2yek-2 -<<< Too many missing values in the middle: 2ygv-3 -<<< Too many missing values in the middle: 2yxj-1 -<<< Too many missing values in the ends: 2z5n-2 -<<< Too many missing values in the middle: 2zkz-3 -<<< Sequence is too short: 2zmj-1 -<<< Too many missing values in the middle: 2zix-1 -<<< Too many missing values in the middle: 2zhr-2 -<<< Too many missing values in the middle: 2ztt-1 -<<< Sequence is too short: 3a1h-2 -<<< Too many missing values in total: 2zsi-1 -<<< Too many missing values in total: 3a5z-2 -<<< Too many missing values in total: 3aln-3 -<<< Too many missing values in the middle: 3bbp-6 -<<< Too many missing values in total: 3bzx-2 -<<< Too many missing values in total: 3bts-1 -<<< Too many missing values in total: 3cbp-1 -<<< Too many missing values in total: 3che-2 -<<< Too many missing values in the middle: 3cra-1 -<<< Too many missing values in total: 3cy3-1 -<<< Too many missing values in the middle: 3d8e-1 -<<< Too many missing values in the middle: 3dcx-1 -<<< Too many missing values in the middle: 3dgs-2 -<<< Sequence is too short: 3dne-1 -<<< Too many missing values in total: 3drt-1 -<<< Too many missing values in the ends: 3e1i-2 -<<< Too many missing values in the middle: 3eb0-3 -<<< Sequence is too short: 3e8c-2 -<<< Too many missing values in total: 3ehf-2 -<<< Too many missing values in total: 3egg-2 -<<< Too many missing values in total: 3ewf-5 -<<< Too many missing values in total: 3f5r-1 -<<< Too many missing values in the middle: 3f86-1 -<<< Too many missing values in the middle: 3f9x-3 -<<< Too many missing values in the middle: 3fal-3 -<<< Too many missing values in the middle: 3fif-8 -<<< Sequence is too short: 3fod-3 -<<< Too many missing values in the middle: 3fz3-1 -<<< Sequence is too short: 3g5y-1 -<<< Sequence is too short: 3ggw-1 -<<< Too many missing values in total: 3gj7-2 -<<< Too many missing values in the middle: 3h2q-1 -<<< Too many missing values in the middle: 3h7x-1 -<<< Too many missing values in the middle: 3hff-2 -<<< Sequence is too short: 3h9q-2 -<<< Too many missing values in total: 3hqm-1 -<<< Too many missing values in the middle: 3hyh-2 -<<< Too many missing values in the middle: 3hvl-3 -<<< Sequence is too short: 3i6k-1 -<<< Too many missing values in the middle: 3iih-1 -<<< Too many missing values in the middle: 3iml-2 -<<< Sequence is too short: 3iux-2 -<<< Sequence is too short: 3jq5-1 -<<< Sequence is too short: 3kf9-1 -<<< Unknown: 3knr-4 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Sequence is too short: 3i7o-1 -<<< Too many missing values in the middle: 3l13-1 -<<< Too many missing values in the middle: 3l6t-2 -<<< Unknown: 3l8r-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3l9u-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lbz-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3ld2-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in total: 3lay-1 -<<< Unknown: 3le5-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lf6-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3li6-4 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lh9-2 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lg7-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3liq-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3ljx-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3llr-4 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lkn-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in the middle: 3lpm-1 -<<< Too many missing values in the middle: 3lsy-1 -<<< Too many missing values in total: 3mbu-3 -<<< Too many missing values in total: 3met-2 -<<< Too many missing values in total: 3mh5-1 -<<< Too many missing values in total: 3m4w-1 -<<< Too many missing values in the middle: 3mmn-1 -<<< Too many missing values in the middle: 3mks-2 -<<< Sequence is too short: 3mls-2 -<<< Too many missing values in the middle: 3mwh-1 -<<< Sequence is too short: 3mro-1 -<<< Sequence is too short: 3mvj-1 -<<< Incorrect alignment: 3nbj-2 -<<< Sequence is too short: 3nfk-1 -<<< Too many missing values in total: 3nmx-2 -<<< Too many missing values in the middle: 3nsu-2 -<<< Too many missing values in total: 3o34-1 -<<< Sequence is too short: 3omk-1 -<<< Too many missing values in total: 3oq0-7 -<<< Unnatural amino acids found: 3ou0-2 -<<< Sequence is too short: 3p33-4 -<<< Too many missing values in total: 3ofi-2 -<<< Sequence is too short: 3pk1-1 -<<< Sequence is too short: 3pfv-2 -<<< Sequence is too short: 3pwj-2 -<<< Too many missing values in the middle: 3q15-2 -<<< Sequence is too short: 3q6s-1 -<<< Too many missing values in the middle: 3q9i-1 -<<< Too many missing values in the middle: 3qg2-1 -<<< Sequence is too short: 3qjn-3 -<<< Too many missing values in total: 3qxy-2 -<<< Too many missing values in the middle: 3r7r-1 -<<< Too many missing values in the ends: 3ray-1 -<<< Too many missing values in the middle: 3rbw-2 -<<< Sequence is too short: 3rew-1 -<<< Too many missing values in the middle: 3rj3-2 -<<< Too many missing values in the ends: 3r1r-3 -<<< Sequence is too short: 3rwd-1 -<<< Too many missing values in the ends: 3s90-2 -<<< Too many missing values in total: 3shv-2 -<<< Too many missing values in the middle: 3sl0-2 -<<< Too many missing values in total: 3sow-1 -<<< Sequence is too short: 3ssb-2 -<<< Too many missing values in total: 3sui-1 -<<< Too many missing values in the middle: 3swc-1 -<<< Too many missing values in the middle: 3t30-2 -<<< Too many missing values in the ends: 3t1u-1 -<<< Sequence is too short: 3tie-2 -<<< Sequence is too short: 3tcg-6 -<<< Too many missing values in the ends: 3tje-1 -<<< Too many missing values in the middle: 3tvz-1 -<<< Too many missing values in total: 3t5v-2 -<<< Too many missing values in total: 3u3d-1 -<<< Too many missing values in total: 3uf7-1 -<<< Sequence is too short: 3uvk-1 -<<< Too many missing values in the middle: 3v6m-2 -<<< Sequence is too short: 3vj6-1 -<<< Incorrect alignment: 3von-18 -<<< Too many missing values in the middle: 3vrq-2 -<<< Too many missing values in the middle: 3w20-1 -<<< Sequence is too short: 3w0j-1 -<<< Too many missing values in the middle: 3wfn-3 -<<< Too many missing values in the middle: 3zdt-1 -<<< Too many missing values in total: 3w3w-1 -<<< Too many missing values in total: 3x3f-1 -<<< Too many missing values in the middle: 3zkj-1 -<<< Too many missing values in total: 3wgu-1 -<<< Sequence is too short: 3zrk-1 -<<< Too many missing values in the ends: 4afz-2 -<<< Too many missing values in total: 4apr-1 -<<< Too many missing values in the middle: 4b95-3 -<<< Sequence is too short: 4bah-1 -<<< Too many missing values in the middle: 4bj3-1 -<<< Too many missing values in total: 4bwq-1 -<<< Too many missing values in total: 4c5h-1 -<<< Too many missing values in total: 4chg-2 -<<< Too many missing values in total: 4ccn-1 -<<< Too many missing values in the middle: 4dor-1 -<<< Sequence is too short: 4d11-1 -<<< Too many missing values in the middle: 4dyv-1 -<<< Sequence is too short: 4e17-1 -<<< Sequence is too short: 4ekk-2 -<<< Sequence is too short: 4ep3-1 -<<< Too many missing values in the middle: 4etu-1 -<<< Sequence is too short: 4esg-2 -<<< Too many missing values in the middle: 4ezq-2 -<<< Sequence is too short: 4fgt-1 -<<< Sequence is too short: 4fm6-1 -<<< Too many missing values in the middle: 4fo0-1 -<<< Too many missing values in the middle: 4fvt-1 -<<< Sequence is too short: 4g0d-3 -<<< Too many missing values in the middle: 4go6-1 -<<< Too many missing values in total: 4gow-1 -<<< Too many missing values in total: 4gye-1 -<<< Too many missing values in total: 4h3k-2 -<<< Sequence is too short: 4i5b-2 -<<< Too many missing values in the middle: 4iao-1 -<<< Sequence is too short: 4ins-4 -<<< Sequence is too short: 4iv4-1 -<<< Sequence is too short: 4j9f-3 -<<< Sequence is too short: 4j78-1 -<<< Sequence is too short: 4j82-2 -<<< Too many missing values in the middle: 4jcq-3 -<<< Too many missing values in total: 4jj8-1 -<<< Too many missing values in the ends: 4jok-2 -<<< Too many missing values in total: 4jqi-3 -<<< Too many missing values in total: 4k45-1 -<<< Sequence is too short: 4jzw-1 -<<< Too many missing values in total: 4kml-1 -<<< Too many missing values in total: 4l58-1 -<<< Sequence is too short: 4laj-1 -<<< Too many missing values in the ends: 4lk9-1 -<<< Too many missing values in total: 4m6b-2 -<<< Sequence is too short: 4mj5-1 -<<< Sequence is too short: 4mnw-1 -<<< Sequence is too short: 4mzl-2 -<<< Too many missing values in the middle: 4m8n-2 -<<< Too many missing values in the middle: 4nj7-16 -<<< Unnatural amino acids found: 4nkq-1 -<<< Too many missing values in total: 4nms-1 -<<< Sequence is too short: 4ny3-2 -<<< Too many missing values in total: 4oed-1 -<<< Sequence is too short: 4ok1-1 -<<< Too many missing values in the middle: 4oz7-2 -<<< Too many missing values in the ends: 4p30-1 -<<< Too many missing values in total: 4p0a-1 -<<< Too many missing values in the middle: 4on9-3 -<<< Too many missing values in the ends: 4pa6-1 -<<< Too many missing values in the middle: 4pdn-1 -<<< Too many missing values in the middle: 4phx-1 -<<< Too many missing values in the middle: 4pw8-1 -<<< Sequence is too short: 4qbq-1 -<<< Too many missing values in the middle: 4qrh-2 -<<< Sequence is too short: 4qx8-1 -<<< Sequence is too short: 4r8m-2 -<<< Sequence is too short: 4rme-1 -<<< Sequence is too short: 4rof-2 -<<< Sequence is too short: 4rt4-1 -<<< Too many missing values in total: 4rr2-1 -<<< Too many missing values in total: 4rwd-1 -<<< Sequence is too short: 4tky-3 -<<< Too many missing values in total: 4tot-3 -<<< Too many missing values in the middle: 4tn7-2 -<<< Too many missing values in the middle: 4tyj-1 -<<< Too many missing values in the middle: 4u9e-1 -<<< Too many missing values in the middle: 4up2-4 -<<< Sequence is too short: 4uu7-1 -<<< Too many missing values in total: 4uw2-3 -<<< Sequence is too short: 4w50-1 -<<< Unknown: 4v7n-13 -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert - for (chain,) in pdb_entry.get_chains(): -ValueError: too many values to unpack (expected 1) - -<<< Unknown: 4v45-3 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Sequence is too short: 4wjq-1 -<<< Too many missing values in the middle: 4wov-3 -<<< Too many missing values in total: 4wx8-1 -<<< Too many missing values in the middle: 4x0s-1 -<<< Too many missing values in total: 4v1v-1 -<<< Too many missing values in total: 4xi7-1 -<<< Too many missing values in total: 4xyi-1 -<<< Too many missing values in the ends: 4y66-1 -<<< Sequence is too short: 4wz9-1 -<<< Too many missing values in total: 4z29-2 -<<< Too many missing values in total: 4z8m-1 -<<< Too many missing values in the ends: 4zp3-6 -<<< Too many missing values in the middle: 4zqk-1 -<<< Sequence is too short: 5a53-1 -<<< Sequence is too short: 5ajk-3 -<<< Too many missing values in the middle: 5b7b-1 -<<< Unnatural amino acids found: 5bu8-1 -<<< Too many missing values in the middle: 5c01-1 -<<< Too many missing values in total: 5c13-1 -<<< Too many missing values in the middle: 5c59-6 -<<< Too many missing values in the middle: 5cwv-2 -<<< Too many missing values in total: 5cxt-6 -<<< Too many missing values in the ends: 5d56-1 -<<< Too many missing values in total: 5dhm-2 -<<< Sequence is too short: 5dmf-1 -<<< Sequence is too short: 5dow-3 -<<< Too many missing values in the middle: 5dsc-2 -<<< Too many missing values in the middle: 5dxb-1 -<<< Too many missing values in the middle: 5e4l-2 -<<< Too many missing values in total: 5e8d-1 -<<< Too many missing values in the middle: 5e0w-1 -<<< Too many missing values in the middle: 5ej0-1 -<<< Some chains in the PDB do not appear in the fasta file: 5exc-2 -<<< Too many missing values in the middle: 5f7c-1 -<<< Sequence is too short: 5f88-2 -<<< Too many missing values in the middle: 5go3-1 -<<< Sequence is too short: 5gp7-1 -<<< Too many missing values in the middle: 5gvi-1 -<<< Too many missing values in the ends: 5gu4-2 -<<< Too many missing values in the middle: 5h5a-3 -<<< Sequence is too short: 5hed-1 -<<< Sequence is too short: 5h94-2 -<<< Too many missing values in the middle: 5hfj-3 -<<< Sequence is too short: 5fq6-1 -<<< Sequence is too short: 5hhn-1 -<<< Sequence is too short: 5hox-2 -<<< Sequence is too short: 5icz-1 -<<< Sequence is too short: 5iqn-2 -<<< Sequence is too short: 5iop-1 -<<< Too many missing values in total: 5izt-2 -<<< Sequence is too short: 5isz-1 -<<< Too many missing values in total: 5jer-3 -<<< Too many missing values in the middle: 5jhb-1 -<<< Too many missing values in total: 5ix2-1 -<<< Too many missing values in total: 5jja-1 -<<< Sequence is too short: 5jwd-1 -<<< Sequence is too short: 5jzy-1 -<<< Too many missing values in the middle: 5k19-1 -<<< Unnatural amino acids found: 5k4l-2 -<<< Sequence is too short: 5ksv-1 -<<< Too many missing values in the middle: 5kxj-2 -<<< Too many missing values in the middle: 5ls6-3 -<<< Too many missing values in total: 5lut-1 -<<< Too many missing values in the middle: 5lye-1 -<<< Unnatural amino acids found: 5me3-1 -<<< Sequence is too short: 5mlw-2 -<<< Too many missing values in the ends: 5mk1-3 -<<< Too many missing values in total: 5mst-1 -<<< Too many missing values in the middle: 5mvg-1 -<<< Too many missing values in total: 5n10-1 -<<< Too many missing values in total: 5mub-5 -<<< Too many missing values in total: 5mu0-3 -<<< Too many missing values in total: 5n74-1 -<<< Too many missing values in total: 5n9p-1 -<<< Sequence is too short: 5nc7-3 -<<< Too many missing values in the middle: 5nne-1 -<<< Too many missing values in the middle: 5npv-2 -<<< Sequence is too short: 5n4d-2 -<<< Sequence is too short: 5o9t-2 -<<< Too many missing values in the middle: 5oup-1 -<<< Too many missing values in the middle: 5o7a-1 -<<< Too many missing values in total: 5oo6-4 -<<< Sequence is too short: 5q0k-1 -<<< Sequence is too short: 5q1e-1 -<<< Too many missing values in the middle: 5r48-1 -<<< Too many missing values in the middle: 5s5w-1 -<<< Too many missing values in the middle: 5sb9-1 -<<< Sequence is too short: 5t1k-2 -<<< Sequence is too short: 5t8r-6 -<<< Sequence is too short: 5t7g-1 -<<< Too many missing values in total: 5twg-1 -<<< Sequence is too short: 5u62-1 -<<< Sequence is too short: 5urt-1 -<<< Sequence is too short: 5uwm-1 -<<< Sequence is too short: 5va6-2 -<<< Too many missing values in the middle: 5vlq-1 -<<< Too many missing values in the middle: 5vvo-1 -<<< Sequence is too short: 5vx3-2 -<<< Sequence is too short: 5vyo-4 -<<< Too many missing values in the middle: 5w5o-6 -<<< Too many missing values in the ends: 5w4e-1 -<<< Too many missing values in the middle: 5wer-1 -<<< Sequence is too short: 5wg1-1 -<<< Sequence is too short: 5wli-2 -<<< Sequence is too short: 5wy2-2 -<<< Sequence is too short: 5x54-1 -<<< Too many missing values in total: 5ve8-1 -<<< Too many missing values in total: 5x6c-1 -<<< Too many missing values in the middle: 5yc2-2 -<<< Sequence is too short: 5yd4-3 -<<< Too many missing values in the middle: 5yj1-12 -<<< Too many missing values in the middle: 5yva-1 -<<< Too many missing values in total: 5xoj-1 -<<< Too many missing values in the ends: 5z72-3 -<<< Too many missing values in total: 5z8n-2 -<<< Too many missing values in the middle: 5zia-2 -<<< Too many missing values in the ends: 5zv3-1 -<<< Too many missing values in the ends: 5zwx-2 -<<< Sequence is too short: 6av8-1 -<<< Too many missing values in the middle: 6b4c-10 -<<< Too many missing values in total: 6b67-1 -<<< Too many missing values in the ends: 6bg1-1 -<<< Too many missing values in total: 6bpe-3 -<<< Sequence is too short: 6bwz-1 -<<< Too many missing values in total: 6c4u-1 -<<< Sequence is too short: 6cnu-2 -<<< Too many missing values in the middle: 6cqo-3 -<<< Too many missing values in the middle: 6czn-1 -<<< Too many missing values in the middle: 6cw3-1 -<<< Too many missing values in total: 6dca-2 -<<< Unnatural amino acids found: 6bcx-1 -<<< Sequence is too short: 6dn8-3 -<<< Sequence is too short: 6dtg-1 -<<< Too many missing values in total: 6ecf-3 -<<< Too many missing values in the middle: 6et3-1 -<<< Too many missing values in the middle: 6eyn-3 -<<< Sequence is too short: 6ewo-2 -<<< Too many missing values in the middle: 6ffj-3 -<<< Too many missing values in the middle: 6fjy-2 -<<< Too many missing values in the middle: 6fel-1 -<<< Too many missing values in the middle: 6fyz-1 -<<< Too many missing values in the middle: 6g2z-1 -<<< Too many missing values in total: 6g07-1 -<<< Sequence is too short: 6g6c-4 -<<< Too many missing values in the middle: 6g8l-1 -<<< Too many missing values in the middle: 6gmn-3 -<<< Too many missing values in total: 6grg-1 -<<< Too many missing values in total: 6h06-1 -<<< Sequence is too short: 6hos-2 -<<< Too many missing values in the ends: 6hm5-1 -<<< Incorrect alignment: 6ikm-8 -<<< Too many missing values in total: 6isb-1 -<<< Unknown: 6igc-6 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in total: 6j19-1 -<<< Too many missing values in the ends: 6j7b-1 -<<< Sequence is too short: 6j2d-1 -<<< Too many missing values in the middle: 6jck-1 -<<< Too many missing values in the middle: 6jqv-1 -<<< Too many missing values in the middle: 6kgv-1 -<<< Too many missing values in the ends: 6kdr-1 -<<< Too many missing values in the middle: 6kwb-3 -<<< Too many missing values in the middle: 6kzg-1 -<<< Too many missing values in total: 6kr4-3 -<<< Too many missing values in total: 6lhu-1 -<<< Too many missing values in the middle: 6lzk-2 -<<< Too many missing values in the middle: 6m7f-2 -<<< Sequence is too short: 6m4z-1 -<<< Sequence is too short: 6mbj-2 -<<< Too many missing values in the middle: 6mkh-1 -<<< Sequence is too short: 6me1-2 -<<< Sequence is too short: 6mpm-1 -<<< Too many missing values in the middle: 6mta-3 -<<< Too many missing values in the ends: 6mwh-1 -<<< Sequence is too short: 6nca-11 -<<< Too many missing values in total: 6nzz-1 -<<< Sequence is too short: 6o3w-2 -<<< Too many missing values in total: 6nuu-1 -<<< Sequence is too short: 6o9b-1 -<<< Too many missing values in total: 6oi3-1 -<<< Too many missing values in total: 6osj-1 -<<< Too many missing values in the ends: 6of7-1 -<<< Too many missing values in the ends: 6p2p-1 -<<< Too many missing values in the middle: 6o7d-1 -<<< Sequence is too short: 6phl-1 -<<< Too many missing values in total: 6pit-1 -<<< Too many missing values in total: 6psd-3 -<<< Too many missing values in the middle: 6pw5-1 -<<< Sequence is too short: 6q0m-2 -<<< Sequence is too short: 6q5n-1 -<<< Sequence is too short: 6qc0-1 -<<< Too many missing values in the middle: 6qpc-1 -<<< Sequence is too short: 6qqg-1 -<<< Too many missing values in total: 6qsz-2 -<<< Sequence is too short: 6r50-1 -<<< Too many missing values in total: 6qio-1 -<<< Too many missing values in the ends: 6rgn-1 -<<< Too many missing values in the ends: 6rrk-2 -<<< Too many missing values in total: 6rxm-3 -<<< Unnatural amino acids found: 6sdr-1 -<<< Too many missing values in the middle: 6squ-1 -<<< Sequence is too short: 6ssq-1 -<<< Some chains in the PDB do not appear in the fasta file: 6sx4-2 -<<< Some chains in the PDB do not appear in the fasta file: 6t9m-1 -<<< Some chains in the PDB do not appear in the fasta file: 6t5o-2 -<<< Some chains in the PDB do not appear in the fasta file: 6tkp-2 -<<< Sequence is too short: 6tq0-4 -<<< Some chains in the PDB do not appear in the fasta file: 6tnl-2 -<<< Too many missing values in total: 6txb-2 -<<< Too many missing values in total: 6u39-10 -<<< Too many missing values in the middle: 6u8g-1 -<<< Too many missing values in the middle: 6ug3-1 -<<< Too many missing values in the middle: 6uie-2 -<<< Too many missing values in total: 6uyz-2 -<<< Sequence is too short: 6v3n-2 -<<< Too many missing values in the middle: 6vrg-2 -<<< Too many missing values in the ends: 6vxn-1 -<<< Sequence is too short: 6wa0-3 -<<< Unknown: 6wat-3 -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert - for (chain,) in pdb_entry.get_chains(): -ValueError: too many values to unpack (expected 1) - -<<< Too many missing values in the ends: 6wfx-1 -<<< Too many missing values in total: 6wi3-2 -<<< Incorrect alignment: 6x0a-18 -<<< Too many missing values in total: 6y0d-1 -<<< Some chains in the PDB do not appear in the fasta file: 6xwk-1 -<<< Too many missing values in total: 6ybu-2 -<<< Too many missing values in the ends: 6yie-2 -<<< Sequence is too short: 6yo8-1 -<<< Sequence is too short: 6yx0-2 -<<< Some chains in the PDB do not appear in the fasta file: 6z3n-1 -<<< Some chains in the PDB do not appear in the fasta file: 6z66-1 -<<< Sequence is too short: 6z7w-4 -<<< Some chains in the PDB do not appear in the fasta file: 6ziv-3 -<<< Too many missing values in the ends: 6yn0-1 -<<< Some chains in the PDB do not appear in the fasta file: 6zrx-4 -<<< Sequence is too short: 6zuw-1 -<<< Too many missing values in total: 6zwk-6 -<<< Too many missing values in total: 7ahc-1 -<<< Too many missing values in total: 7age-2 -<<< Too many missing values in total: 7azd-2 -<<< Too many missing values in the ends: 7b5g-3 -<<< Unexpected atoms (D): 7bbi-1 -<<< Too many missing values in the middle: 7bh9-1 -<<< Too many missing values in the ends: 7bos-1 -<<< Too many missing values in total: 7bqy-1 -<<< Too many missing values in total: 7bsd-2 -<<< Too many missing values in total: 7c8e-1 -<<< Too many missing values in total: 7cfd-1 -<<< Too many missing values in total: 7ciz-2 -<<< Too many missing values in total: 7ci2-2 -<<< Too many missing values in the middle: 7cva-1 -<<< Too many missing values in total: 7d0r-1 -<<< Too many missing values in total: 7d2p-1 -<<< Too many missing values in the middle: 7dfb-1 -<<< Too many missing values in the ends: 7dmw-2 -<<< Too many missing values in the middle: 7dq6-1 -<<< Too many missing values in total: 7drp-1 -<<< Too many missing values in total: 7dvp-1 -<<< Too many missing values in the middle: 7dad-1 -<<< Too many missing values in the middle: 7efy-1 -<<< Sequence is too short: 7egu-1 -<<< Sequence is too short: 7etu-1 -<<< Too many missing values in the ends: 7f2m-2 -<<< Sequence is too short: 7fb5-1 -<<< Unexpected atoms (D1): 7fg8-1 -<<< Too many missing values in the ends: 7fho-1 -<<< Too many missing values in the middle: 7jsd-4 -<<< Too many missing values in total: 7jn8-1 -<<< Sequence is too short: 7jwi-1 -<<< Too many missing values in the middle: 7k90-1 -<<< Too many missing values in the middle: 7kji-1 -<<< Too many missing values in total: 7kue-1 -<<< Too many missing values in total: 7kdt-1 -<<< Too many missing values in total: 7l7g-1 -<<< Too many missing values in the ends: 7law-1 -<<< Unnatural amino acids found: 7ln3-1 -<<< Too many missing values in the middle: 7lwl-1 -<<< Too many missing values in the ends: 7m53-1 -<<< Too many missing values in total: 7m71-1 -<<< Too many missing values in the middle: 7mvv-1 -<<< Too many missing values in the middle: 7n56-4 -<<< Too many missing values in total: 7n8i-1 -<<< Sequence is too short: 7nab-2 -<<< Some chains in the PDB do not appear in the fasta file: 7ne9-1 -<<< Too many missing values in total: 7ni4-1 -<<< Some chains in the PDB do not appear in the fasta file: 7nqg-1 -<<< Too many missing values in total: 7nrv-2 -<<< Sequence is too short: 7ntk-3 -<<< Some chains in the PDB do not appear in the fasta file: 7nm8-1 -<<< Too many missing values in the ends: 7nvi-1 -<<< Some chains in the PDB do not appear in the fasta file: 7od0-3 -<<< Some chains in the PDB do not appear in the fasta file: 7oet-1 -<<< Too many missing values in total: 7obl-1 -<<< Some chains in the PDB do not appear in the fasta file: 7olu-1 -<<< Some chains in the PDB do not appear in the fasta file: 7orp-1 -<<< Unnatural amino acids found: 7oxj-1 -<<< Some chains in the PDB do not appear in the fasta file: 7oz9-2 -<<< Some chains in the PDB do not appear in the fasta file: 7pgz-1 -<<< Unknown: 7pe5-1 -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert - for (chain,) in pdb_entry.get_chains(): -ValueError: too many values to unpack (expected 1) - -<<< Some chains in the PDB do not appear in the fasta file: 7p7n-1 -<<< Too many missing values in the middle: 7pqu-1 -<<< Sequence is too short: 7q1s-4 -<<< Unknown: 7q8i-2 -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert - for (chain,) in pdb_entry.get_chains(): -ValueError: too many values to unpack (expected 1) - -<<< Too many missing values in the middle: 7qie-1 -<<< Sequence is too short: 7qpj-1 -<<< Too many missing values in total: 7qqn-1 -<<< Too many missing values in the middle: 7rg7-1 -<<< Too many missing values in total: 7nkh-1 -<<< Sequence is too short: 7rly-3 -<<< Too many missing values in the middle: 7rn8-1 -<<< Sequence is too short: 7r1r-8 -<<< Too many missing values in total: 7rhk-1 -<<< Too many missing values in the middle: 7rxb-1 -<<< Too many missing values in the middle: 7s1t-3 -<<< Sequence is too short: 7s4g-1 -<<< Sequence is too short: 7s8q-1 -<<< Too many missing values in the middle: 7s7d-1 -<<< Too many missing values in the middle: 7st3-4 -<<< Too many missing values in the middle: 7t7t-2 -<<< Too many missing values in the middle: 7srr-1 -<<< Unknown: 7t66-2 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in the middle: 7tw9-1 -<<< Too many missing values in total: 7ue9-1 -<<< Sequence is too short: 7uyk-1 -<<< Too many missing values in total: 7v0m-1 -<<< Too many missing values in the middle: 7v7x-1 -<<< Too many missing values in the ends: 7vf2-1 -<<< Too many missing values in total: 7vph-1 -<<< Too many missing values in the middle: 7vvj-1 -<<< Too many missing values in the middle: 7wf7-1 -<<< Too many missing values in total: 7wy0-1 -<<< Too many missing values in the middle: 7x9s-1 -<<< Too many missing values in the middle: 7xdt-1 -<<< Too many missing values in the middle: 7xox-1 -<<< Too many missing values in the middle: 7xwi-1 -<<< Sequence is too short: 7yxd-4 -<<< Too many missing values in total: 7xsj-1 -<<< Too many missing values in total: 7z8m-1 -<<< Too many missing values in total: 8a5a-1 -<<< Too many missing values in the middle: 8bfe-4 -<<< Too many missing values in the middle: 8da2-1 -<<< Too many missing values in total: 8do8-1 -<<< Too many missing values in total: 8efu-1 -<<< Too many missing values in total: 8d7z-1 -<<< Too many missing values in the middle: 1pyy-1 -<<< Sequence is too short: 2g5b-1 -<<< Too many missing values in total: 2vdq-1 -<<< Too many missing values in the middle: 8f5o-1 -<<< Sequence is too short: 3hus-1 -<<< Sequence is too short: 3pma-3 -<<< Too many missing values in the middle: 3s88-1 -<<< Sequence is too short: 4bao-1 -<<< Too many missing values in total: 4kbb-2 -<<< Too many missing values in the middle: 4ui2-1 -<<< Too many missing values in the ends: 4yci-1 -<<< Sequence is too short: 5djx-1 -<<< Too many missing values in the middle: 5es4-3 -<<< Sequence is too short: 5j4x-2 -<<< Unnatural amino acids found: 5jq7-1 -<<< Sequence is too short: 5ujt-2 -<<< Too many missing values in total: 5w5u-1 -<<< Too many missing values in the middle: 6ht9-1 -<<< Too many missing values in total: 5hcc-1 -<<< Too many missing values in the middle: 6oej-1 -<<< Too many missing values in the middle: 6idf-1 -<<< Too many missing values in the middle: 6ply-1 -<<< Unknown: 6m8p-5 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in total: 6wdq-1 -<<< Too many missing values in total: 6xp6-1 -<<< Some chains in the PDB do not appear in the fasta file: 6ytp-2 -<<< Some chains in the PDB do not appear in the fasta file: 7b6t-2 -<<< Too many missing values in total: 6x3z-1 -<<< Too many missing values in total: 7la4-1 -<<< Too many missing values in total: 7lkh-1 -<<< Too many missing values in the middle: 7mwx-1 -<<< Too many missing values in the middle: 7m6m-1 -<<< Sequence is too short: 7o50-1 -<<< Too many missing values in the middle: 7rhr-1 -<<< Too many missing values in the middle: 7scj-1 -<<< Too many missing values in total: 7kmb-1 -<<< Too many missing values in the middle: 7uwn-1 -<<< Too many missing values in the ends: 8as0-8 -<<< Too many missing values in the middle: 16vp-1 -<<< Too many missing values in total: 1a09-3 -<<< Unknown: 8dli-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in the middle: 1aya-1 -<<< Sequence is too short: 1awq-1 -<<< Sequence is too short: 1bbr-1 -<<< Too many missing values in total: 1bm2-2 -<<< Sequence is too short: 1c9i-1 -<<< Sequence is too short: 1cmi-2 -<<< Too many missing values in the middle: 1dla-4 -<<< Too many missing values in the middle: 1dvk-1 -<<< Too many missing values in the middle: 1etk-1 -<<< Too many missing values in the middle: 1f32-1 -<<< Sequence is too short: 1ffo-2 -<<< Too many missing values in total: 1gi7-1 -<<< Unnatural amino acids found: 1h0h-1 -<<< Sequence is too short: 1hbt-1 -<<< Sequence is too short: 1him-1 -<<< Sequence is too short: 1hxz-1 -<<< Too many missing values in total: 1i7x-1 -<<< Too many missing values in total: 1iql-1 -<<< Sequence is too short: 1jbu-1 -<<< Too many missing values in the middle: 1jq6-1 -<<< Too many missing values in the ends: 1jp5-1 -<<< Sequence is too short: 1k8d-1 -<<< Unnatural amino acids found: 1kp0-1 -<<< Sequence is too short: 1m7e-3 -<<< Too many missing values in the middle: 1ml9-1 -<<< Sequence is too short: 1n5z-4 -<<< Too many missing values in total: 1n4r-6 -<<< Sequence is too short: 1nrr-1 -<<< Too many missing values in the middle: 1nju-3 -<<< Sequence is too short: 1nvq-1 -<<< Too many missing values in the ends: 1o5d-1 -<<< Sequence is too short: 1o6l-1 -<<< Sequence is too short: 1oqn-3 -<<< Too many missing values in the middle: 1ozu-1 -<<< Too many missing values in the middle: 1p13-2 -<<< Too many missing values in the ends: 1p4u-2 -<<< Too many missing values in the middle: 1pdg-1 -<<< Sequence is too short: 1pfb-2 -<<< Sequence is too short: 1p9u-1 -<<< Too many missing values in total: 1q4q-10 -<<< Too many missing values in the middle: 1q67-1 -<<< Sequence is too short: 1qd6-1 -<<< Too many missing values in the middle: 1qqg-1 -<<< Sequence is too short: 1r5v-1 -<<< Sequence is too short: 1rbf-1 -<<< Sequence is too short: 1s2k-1 -<<< Too many missing values in the ends: 1s94-1 -<<< Sequence is too short: 1sb1-1 -<<< Sequence is too short: 1s7r-1 -<<< Too many missing values in the middle: 1t2v-2 -<<< Sequence is too short: 1t5w-2 -<<< Sequence is too short: 1ta2-1 -<<< Sequence is too short: 1t08-1 -<<< Too many missing values in total: 1tu3-1 -<<< Sequence is too short: 1tvb-2 -<<< Too many missing values in total: 1tno-1 -<<< Sequence is too short: 1u9f-2 -<<< Too many missing values in the ends: 1ud0-4 -<<< Sequence is too short: 1unv-1 -<<< Too many missing values in the ends: 1vzq-1 -<<< Too many missing values in total: 1w7q-3 -<<< Too many missing values in the middle: 1xc4-1 -<<< Sequence is too short: 1xda-10 -<<< Too many missing values in the ends: 1x78-1 -<<< Too many missing values in total: 1xhm-1 -<<< Sequence is too short: 1ypk-1 -<<< Sequence is too short: 1zmi-5 -<<< Too many missing values in the middle: 1zw0-14 -<<< Too many missing values in the middle: 1zyd-1 -<<< Sequence is too short: 1zuz-2 -<<< Sequence is too short: 2ak4-4 -<<< Too many missing values in the ends: 2avu-1 -<<< Too many missing values in the middle: 2anc-1 -<<< Too many missing values in total: 2bd3-1 -<<< Unknown: 2c2m-1 -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1334, in get_coordinates_array - chain_crd[informative_mask]["unique_residue_number"].astype(int), - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/generic.py", line 6324, in astype - new_data = self._mgr.astype(dtype=dtype, copy=copy, errors=errors) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/internals/managers.py", line 451, in astype - return self.apply( - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/internals/managers.py", line 352, in apply - applied = getattr(b, f)(**kwargs) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/internals/blocks.py", line 511, in astype - new_values = astype_array_safe(values, dtype, copy=copy, errors=errors) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/dtypes/astype.py", line 242, in astype_array_safe - new_values = astype_array(values, dtype, copy=copy) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/dtypes/astype.py", line 187, in astype_array - values = _astype_nansafe(values, dtype, copy=copy) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/dtypes/astype.py", line 138, in _astype_nansafe - return arr.astype(dtype, copy=True) -ValueError: invalid literal for int() with base 10: '277_' - -<<< Sequence is too short: 2br8-1 -<<< Too many missing values in the middle: 2c8t-2 -<<< Too many missing values in the ends: 2d11-3 -<<< Too many missing values in total: 2dm9-1 -<<< Too many missing values in the middle: 2egu-3 -<<< Too many missing values in the middle: 2f0a-5 -<<< Too many missing values in the middle: 2fd4-1 -<<< Too many missing values in total: 2fo5-4 -<<< Sequence is too short: 2fx7-1 -<<< Too many missing values in total: 2g66-1 -<<< Sequence is too short: 2fym-3 -<<< Too many missing values in the middle: 2h2d-1 -<<< Too many missing values in the middle: 2hlr-1 -<<< Sequence is too short: 2hnt-1 -<<< Too many missing values in the middle: 2hww-2 -<<< Too many missing values in the middle: 2i0i-2 -<<< Sequence is too short: 2hpc-3 -<<< Sequence is too short: 2ins-3 -<<< Sequence is too short: 2iwb-1 -<<< Too many missing values in the middle: 2j1l-1 -<<< Too many missing values in the middle: 2o1w-5 -<<< Sequence is too short: 2o4j-1 -<<< Too many missing values in the middle: 2o97-2 -<<< Sequence is too short: 2pcu-1 -<<< Too many missing values in total: 2pbk-1 -<<< Sequence is too short: 2pm5-4 -<<< Sequence is too short: 2pv9-2 -<<< Too many missing values in the middle: 2q3v-1 -<<< Too many missing values in the middle: 2q7t-2 -<<< Too many missing values in the ends: 2qa7-2 -<<< Sequence is too short: 2qbw-1 -<<< Too many missing values in the ends: 2qja-1 -<<< Too many missing values in total: 2qqs-2 -<<< Too many missing values in the middle: 2r5f-1 -<<< Sequence is too short: 2qxm-1 -<<< Too many missing values in the middle: 2rfl-6 -<<< Too many missing values in the middle: 2rgo-3 -<<< Too many missing values in the middle: 2vgc-3 -<<< Sequence is too short: 2vo7-1 -<<< Too many missing values in the middle: 2vvg-1 -<<< Too many missing values in total: 2w2w-12 -<<< Too many missing values in the ends: 2wax-1 -<<< Too many missing values in the middle: 2woj-1 -<<< Too many missing values in the ends: 2wpi-1 -<<< Too many missing values in the middle: 2wqo-1 -<<< Sequence is too short: 2ws6-4 -<<< Too many missing values in the middle: 2xbx-1 -<<< Sequence is too short: 2xni-1 -<<< Too many missing values in total: 2xze-1 -<<< Sequence is too short: 2xum-2 -<<< Too many missing values in total: 2y5t-1 -<<< Too many missing values in total: 2ygv-4 -<<< Too many missing values in total: 2yvc-1 -<<< Too many missing values in total: 2z3c-1 -<<< Sequence is too short: 2zdv-1 -<<< Too many missing values in the middle: 2ztt-2 -<<< Too many missing values in the middle: 3a60-1 -<<< Too many missing values in total: 3ai6-1 -<<< Too many missing values in the middle: 3alo-1 -<<< Too many missing values in total: 3bbp-7 -<<< Too many missing values in total: 3bzx-3 -<<< Sequence is too short: 3c3q-1 -<<< Too many missing values in total: 3chf-1 -<<< Too many missing values in the middle: 3crc-1 -<<< Too many missing values in the middle: 3cwv-2 -<<< Sequence is too short: 3cvl-1 -<<< Too many missing values in the middle: 3d4b-1 -<<< Too many missing values in the middle: 3d8e-2 -<<< Too many missing values in the ends: 3d1e-1 -<<< Too many missing values in the middle: 3dcy-1 -<<< Sequence is too short: 3dux-1 -<<< Too many missing values in the middle: 3e1k-1 -<<< Unnatural amino acids found: 3e2o-1 -<<< Sequence is too short: 3e8c-3 -<<< Too many missing values in the middle: 3edm-1 -<<< Too many missing values in total: 3egh-1 -<<< Too many missing values in total: 3eul-4 -<<< Too many missing values in the middle: 3f86-2 -<<< Too many missing values in the middle: 3f9x-4 -<<< Too many missing values in the middle: 3eoe-1 -<<< Sequence is too short: 3fif-9 -<<< Sequence is too short: 3fpo-1 -<<< Sequence is too short: 3fod-4 -<<< Sequence is too short: 3fqr-1 -<<< Sequence is too short: 3fy2-1 -<<< Sequence is too short: 3ggw-2 -<<< Too many missing values in total: 3gj8-1 -<<< Unnatural amino acids found: 3gnn-1 -<<< Too many missing values in the middle: 3h2q-2 -<<< Too many missing values in the ends: 3h1p-1 -<<< Too many missing values in total: 3hqm-2 -<<< Too many missing values in the middle: 3hyh-3 -<<< Sequence is too short: 3i6k-2 -<<< Too many missing values in the middle: 3iep-1 -<<< Too many missing values in the middle: 3ihp-1 -<<< Too many missing values in the middle: 3ka0-1 -<<< Sequence is too short: 3i7p-1 -<<< Sequence is too short: 3kf9-2 -<<< Unknown: 3kp3-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Sequence is too short: 3l3d-1 -<<< Too many missing values in the middle: 3khd-1 -<<< Unknown: 3l9v-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3l8r-2 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3laz-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3ld2-2 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3le5-2 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lc0-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lha-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lf7-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3li8-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lir-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3ljy-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3llr-5 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lga-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lko-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in the ends: 3luo-1 -<<< Too many missing values in total: 3mbu-4 -<<< Sequence is too short: 3m1f-1 -<<< Too many missing values in total: 3mh5-2 -<<< Too many missing values in total: 3m4w-2 -<<< Too many missing values in total: 3meu-1 -<<< Too many missing values in the middle: 3mks-3 -<<< Sequence is too short: 3mls-3 -<<< Sequence is too short: 3mrp-1 -<<< Sequence is too short: 3mvj-2 -<<< Incorrect alignment: 3nbj-3 -<<< Too many missing values in the middle: 3ngq-1 -<<< Too many missing values in total: 3nfk-2 -<<< Too many missing values in total: 3nmx-3 -<<< Too many missing values in the middle: 3nru-6 -<<< Too many missing values in total: 3o35-1 -<<< Too many missing values in the ends: 3o45-1 -<<< Too many missing values in the middle: 3odn-1 -<<< Too many missing values in the ends: 3oj3-1 -<<< Too many missing values in the ends: 3oq0-8 -<<< Sequence is too short: 3omk-2 -<<< Unnatural amino acids found: 3ou0-3 -<<< Too many missing values in the middle: 3p27-1 -<<< Too many missing values in the middle: 3p34-1 -<<< Sequence is too short: 3ogl-5 -<<< Too many missing values in the ends: 3pcx-1 -<<< Sequence is too short: 3pk1-2 -<<< Too many missing values in the middle: 3pqj-1 -<<< Sequence is too short: 3q6s-2 -<<< Too many missing values in the middle: 3q9i-2 -<<< Sequence is too short: 3qjn-4 -<<< Too many missing values in the middle: 3qku-2 -<<< Too many missing values in the middle: 3rbw-3 -<<< Sequence is too short: 3rew-2 -<<< Sequence is too short: 3rwd-2 -<<< Too many missing values in the middle: 3shw-1 -<<< Too many missing values in the middle: 3sl1-1 -<<< Too many missing values in total: 3sow-2 -<<< Sequence is too short: 3so6-1 -<<< Too many missing values in the middle: 3sti-1 -<<< Too many missing values in total: 3r1r-7 -<<< Too many missing values in total: 3swc-2 -<<< Sequence is too short: 3tcg-7 -<<< Too many missing values in the middle: 3tsw-1 -<<< Too many missing values in the middle: 3tvz-2 -<<< Unnatural amino acids found: 3tuv-1 -<<< Sequence is too short: 3uq3-1 -<<< Too many missing values in the ends: 3uua-1 -<<< Sequence is too short: 3uvl-1 -<<< Too many missing values in the middle: 3v6m-3 -<<< Too many missing values in the ends: 3vb4-1 -<<< Too many missing values in the middle: 3vrq-3 -<<< Sequence is too short: 3vt7-1 -<<< Too many missing values in the middle: 3w21-1 -<<< Too many missing values in the middle: 3wv5-2 -<<< Too many missing values in total: 3w3x-1 -<<< Too many missing values in the middle: 3zfm-1 -<<< Too many missing values in the middle: 3zkj-2 -<<< Sequence is too short: 3zin-1 -<<< Too many missing values in the ends: 3zrk-2 -<<< Too many missing values in total: 3wgu-2 -<<< Too many missing values in the ends: 4a9i-2 -<<< Sequence is too short: 4aif-1 -<<< Too many missing values in the middle: 4an4-2 -<<< Too many missing values in the middle: 4b95-4 -<<< Too many missing values in the ends: 4b3b-1 -<<< Too many missing values in the middle: 4bpu-3 -<<< Too many missing values in the middle: 4by2-1 -<<< Too many missing values in the ends: 4bwq-2 -<<< Too many missing values in total: 4c5i-1 -<<< Too many missing values in the middle: 4ckw-1 -<<< Too many missing values in total: 4chg-3 -<<< Too many missing values in the ends: 4cco-1 -<<< Too many missing values in the middle: 4dor-2 -<<< Sequence is too short: 4d11-2 -<<< Sequence is too short: 4ds1-1 -<<< Too many missing values in the middle: 4dyv-2 -<<< Too many missing values in the middle: 4e18-1 -<<< Too many missing values in the ends: 4ec6-1 -<<< Too many missing values in total: 4edn-1 -<<< Too many missing values in the middle: 4etv-1 -<<< Too many missing values in the middle: 4ezq-3 -<<< Too many missing values in total: 4fbw-1 -<<< Too many missing values in the middle: 4fo0-2 -<<< Too many missing values in the middle: 4fr3-1 -<<< Sequence is too short: 4g0d-4 -<<< Too many missing values in total: 4g69-1 -<<< Too many missing values in the ends: 4gi3-1 -<<< Too many missing values in the middle: 4go6-2 -<<< Too many missing values in the ends: 4gw8-1 -<<< Sequence is too short: 4ht6-1 -<<< Too many missing values in the middle: 4hxz-2 -<<< Sequence is too short: 4i31-1 -<<< Sequence is too short: 4ie9-1 -<<< Too many missing values in the middle: 4iao-2 -<<< Sequence is too short: 4ins-5 -<<< Too many missing values in the middle: 4iu9-2 -<<< Sequence is too short: 4iyf-1 -<<< Too many missing values in the middle: 4iv5-1 -<<< Sequence is too short: 4j2l-1 -<<< Sequence is too short: 4j9g-1 -<<< Too many missing values in total: 4j83-1 -<<< Sequence is too short: 4j79-1 -<<< Too many missing values in the middle: 4jcq-4 -<<< Too many missing values in total: 4jj8-2 -<<< Too many missing values in total: 4jol-1 -<<< Sequence is too short: 4jrx-1 -<<< Sequence is too short: 4k6y-1 -<<< Sequence is too short: 4jzw-2 -<<< Too many missing values in the middle: 4kv1-1 -<<< Sequence is too short: 4kts-1 -<<< Sequence is too short: 4laj-2 -<<< Too many missing values in the middle: 4lei-1 -<<< Too many missing values in the middle: 4lj2-1 -<<< Too many missing values in total: 4lka-1 -<<< Sequence is too short: 4ln2-1 -<<< Too many missing values in the middle: 4m6e-1 -<<< Sequence is too short: 4mj6-1 -<<< Too many missing values in the ends: 4mpz-1 -<<< Sequence is too short: 4mnx-1 -<<< Too many missing values in the middle: 4mzm-1 -<<< Unexpected atoms (D): 4n9s-1 -<<< Too many missing values in the middle: 4nim-1 -<<< Sequence is too short: 4nms-2 -<<< Too many missing values in the middle: 4nnx-1 -<<< Too many missing values in the middle: 4ob9-1 -<<< Too many missing values in total: 4oiu-1 -<<< Unnatural amino acids found: 4our-1 -<<< Too many missing values in total: 4p0a-2 -<<< Too many missing values in the ends: 4p30-2 -<<< Too many missing values in the middle: 4p3v-1 -<<< Too many missing values in the ends: 4pa6-2 -<<< Too many missing values in the middle: 4pk1-1 -<<< Sequence is too short: 4pp5-1 -<<< Too many missing values in the middle: 4pw8-2 -<<< Too many missing values in total: 4q13-1 -<<< Sequence is too short: 4qbr-1 -<<< Too many missing values in the middle: 4qts-1 -<<< Too many missing values in the ends: 4qx8-2 -<<< Too many missing values in the middle: 4r3p-1 -<<< Too many missing values in total: 4rcp-1 -<<< Too many missing values in total: 4roj-1 -<<< Too many missing values in total: 4rwd-2 -<<< Sequence is too short: 4tky-4 -<<< Too many missing values in total: 4tot-4 -<<< Too many missing values in the middle: 4uro-3 -<<< Too many missing values in total: 4uw2-4 -<<< Sequence is too short: 4ux6-1 -<<< Too many missing values in the middle: 4v0m-1 -<<< Unknown: 4v7n-14 -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert - for (chain,) in pdb_entry.get_chains(): -ValueError: too many values to unpack (expected 1) - -<<< Too many missing values in the ends: 4w2o-1 -<<< Sequence is too short: 4w50-2 -<<< Too many missing values in the middle: 4w9l-1 -<<< Too many missing values in total: 4uv8-1 -<<< Sequence is too short: 4wb5-1 -<<< Sequence is too short: 4wjq-2 -<<< Unknown: 4v45-4 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in total: 4wx8-2 -<<< Too many missing values in total: 4xup-3 -<<< Too many missing values in total: 4z8m-2 -<<< Too many missing values in the ends: 4zhw-1 -<<< Too many missing values in the middle: 4zp4-1 -<<< Too many missing values in total: 4zrt-1 -<<< Sequence is too short: 5a0x-1 -<<< Unexpected atoms (DA): 5a93-1 -<<< Sequence is too short: 5ax3-1 -<<< Sequence is too short: 5bxu-1 -<<< Too many missing values in the middle: 5c01-2 -<<< Too many missing values in total: 5c13-2 -<<< Too many missing values in the middle: 5c59-7 -<<< Too many missing values in the ends: 5cos-1 -<<< Too many missing values in total: 5csi-1 -<<< Too many missing values in total: 5cxt-7 -<<< Too many missing values in the middle: 5d3w-2 -<<< Too many missing values in the ends: 5d56-2 -<<< Too many missing values in the middle: 5d6h-1 -<<< Too many missing values in the middle: 5dcf-1 -<<< Sequence is too short: 5ddh-1 -<<< Sequence is too short: 5dmg-1 -<<< Sequence is too short: 5dow-4 -<<< Too many missing values in the middle: 5dsc-3 -<<< Sequence is too short: 5e8f-1 -<<< Too many missing values in the ends: 5e0x-1 -<<< Too many missing values in the middle: 5f51-1 -<<< Too many missing values in the middle: 5f7c-2 -<<< Too many missing values in total: 5fc8-1 -<<< Too many missing values in the middle: 5feh-1 -<<< Too many missing values in the middle: 5frt-4 -<<< Too many missing values in total: 5ft1-1 -<<< Too many missing values in the middle: 5go3-2 -<<< Too many missing values in the middle: 5h5a-4 -<<< Too many missing values in the middle: 5hfj-4 -<<< Sequence is too short: 5hox-3 -<<< Sequence is too short: 5hho-1 -<<< Too many missing values in total: 5hyp-1 -<<< Too many missing values in the middle: 5hq8-1 -<<< Sequence is too short: 5icz-2 -<<< Sequence is too short: 5iqo-1 -<<< Sequence is too short: 5iop-2 -<<< Sequence is too short: 5ivn-1 -<<< Too many missing values in total: 5iue-1 -<<< Sequence is too short: 5izu-1 -<<< Too many missing values in the middle: 5jaa-1 -<<< Sequence is too short: 5fq6-2 -<<< Too many missing values in total: 5jer-4 -<<< Sequence is too short: 5jhc-1 -<<< Too many missing values in total: 5jja-2 -<<< Sequence is too short: 5jwe-1 -<<< Too many missing values in the middle: 5k19-2 -<<< Too many missing values in total: 5kc1-1 -<<< Sequence is too short: 5kr9-1 -<<< Too many missing values in the middle: 5kxj-3 -<<< Sequence is too short: 5l83-1 -<<< Incorrect alignment: 5l9w-2 -<<< Sequence is too short: 5leo-1 -<<< Too many missing values in the middle: 5ltv-7 -<<< Too many missing values in the middle: 5ls6-4 -<<< Sequence is too short: 5m5r-1 -<<< Unnatural amino acids found: 5me3-2 -<<< Sequence is too short: 5m71-1 -<<< Sequence is too short: 5mlw-3 -<<< Too many missing values in the ends: 5mk1-4 -<<< Too many missing values in total: 5mst-2 -<<< Too many missing values in total: 5mu0-4 -<<< Too many missing values in total: 5mub-6 -<<< Too many missing values in total: 5n74-2 -<<< Sequence is too short: 5n85-1 -<<< Sequence is too short: 5n1y-1 -<<< Sequence is too short: 5nc7-4 -<<< Too many missing values in the ends: 5ndt-1 -<<< Sequence is too short: 5n32-1 -<<< Too many missing values in the middle: 5nnf-1 -<<< Too many missing values in the middle: 5o3p-1 -<<< Too many missing values in total: 5npw-1 -<<< Too many missing values in the middle: 5o7b-1 -<<< Too many missing values in the middle: 5n4e-1 -<<< Too many missing values in the middle: 5oi2-1 -<<< Sequence is too short: 5o9u-1 -<<< Sequence is too short: 5ous-1 -<<< Too many missing values in the middle: 5ow9-1 -<<< Too many missing values in total: 5oo6-5 -<<< Sequence is too short: 5q0l-1 -<<< Sequence is too short: 5q1f-1 -<<< Too many missing values in the ends: 5qu1-1 -<<< Too many missing values in total: 5oqq-1 -<<< Too many missing values in the middle: 5r49-1 -<<< Unexpected atoms (D1): 5rsa-1 -<<< Too many missing values in the middle: 5s5x-1 -<<< Too many missing values in the middle: 5sba-1 -<<< Sequence is too short: 5t1l-1 -<<< Sequence is too short: 5t7g-2 -<<< Too many missing values in total: 5twh-1 -<<< Sequence is too short: 5u62-2 -<<< Too many missing values in the middle: 5un5-1 -<<< Sequence is too short: 5urt-2 -<<< Sequence is too short: 5uwm-2 -<<< Too many missing values in the middle: 5vlq-2 -<<< Sequence is too short: 5vud-1 -<<< Sequence is too short: 5vvp-1 -<<< Too many missing values in the middle: 5w5o-7 -<<< Too many missing values in the middle: 5wax-2 -<<< Too many missing values in total: 5w4f-1 -<<< Too many missing values in the middle: 5wer-2 -<<< Sequence is too short: 5wli-3 -<<< Sequence is too short: 5x54-2 -<<< Too many missing values in total: 5ve8-2 -<<< Too many missing values in the middle: 5xjl-1 -<<< Too many missing values in total: 5xxk-1 -<<< Too many missing values in total: 5xw8-1 -<<< Too many missing values in total: 5y26-1 -<<< Too many missing values in the middle: 5yc3-1 -<<< Sequence is too short: 5yd4-4 -<<< Too many missing values in the middle: 5yj1-13 -<<< Too many missing values in the middle: 5yvb-1 -<<< Too many missing values in total: 5z8n-3 -<<< Sequence is too short: 5zgc-1 -<<< Too many missing values in the middle: 5zia-3 -<<< Too many missing values in the middle: 5xlt-1 -<<< Too many missing values in the middle: 6awf-2 -<<< Too many missing values in the middle: 6b4c-11 -<<< Too many missing values in total: 6b67-2 -<<< Sequence is too short: 6bcy-1 -<<< Too many missing values in the middle: 6bqr-1 -<<< Too many missing values in the middle: 6c1o-2 -<<< Too many missing values in the middle: 6c4u-2 -<<< Too many missing values in the middle: 6bro-1 -<<< Too many missing values in the middle: 6cqo-4 -<<< Too many missing values in total: 6czo-1 -<<< Too many missing values in total: 6dca-3 -<<< Sequence is too short: 6dth-1 -<<< Too many missing values in total: 6ecf-4 -<<< Too many missing values in the middle: 6ffj-4 -<<< Too many missing values in the middle: 6fel-2 -<<< Too many missing values in total: 6ft5-1 -<<< Too many missing values in the middle: 6fy1-2 -<<< Too many missing values in total: 6g07-2 -<<< Too many missing values in the middle: 6g30-1 -<<< Too many missing values in total: 6g8p-1 -<<< Too many missing values in the middle: 6gmn-4 -<<< Too many missing values in total: 6grh-1 -<<< Too many missing values in total: 6h06-2 -<<< Sequence is too short: 6i2g-1 -<<< Incorrect alignment: 6ikm-9 -<<< Too many missing values in the middle: 6iqn-1 -<<< Unknown: 6igc-7 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in total: 6j91-1 -<<< Sequence is too short: 6j2e-1 -<<< Too many missing values in the middle: 6jm4-1 -<<< Sequence is too short: 6jp3-1 -<<< Too many missing values in the ends: 6k3a-1 -<<< Too many missing values in the middle: 6kgw-1 -<<< Sequence is too short: 6kds-1 -<<< Too many missing values in the middle: 6kmt-1 -<<< Sequence is too short: 6knu-1 -<<< Too many missing values in total: 6kzh-1 -<<< Too many missing values in the middle: 6kr4-4 -<<< Too many missing values in the middle: 6lol-1 -<<< Too many missing values in total: 6lrq-1 -<<< Too many missing values in total: 6lmw-1 -<<< Too many missing values in the middle: 6lzk-3 -<<< Too many missing values in the middle: 6lhx-1 -<<< Sequence is too short: 6mbk-1 -<<< Too many missing values in total: 6m8w-1 -<<< Too many missing values in the middle: 6mki-1 -<<< Too many missing values in total: 6mj8-1 -<<< Sequence is too short: 6mpn-1 -<<< Too many missing values in the middle: 6mxg-1 -<<< Too many missing values in the middle: 6mzw-2 -<<< Sequence is too short: 6n5w-1 -<<< Sequence is too short: 6nca-12 -<<< Too many missing values in total: 6o3x-1 -<<< Sequence is too short: 6o9c-1 -<<< Sequence is too short: 6oi4-1 -<<< Too many missing values in the ends: 6op8-1 -<<< Too many missing values in total: 6osl-1 -<<< Too many missing values in the ends: 6p8h-1 -<<< Sequence is too short: 6pdi-1 -<<< Too many missing values in total: 6phm-1 -<<< Too many missing values in total: 6pln-1 -<<< Too many missing values in total: 6psd-4 -<<< Sequence is too short: 6q0n-1 -<<< Sequence is too short: 6pyv-1 -<<< Sequence is too short: 6q5n-2 -<<< Sequence is too short: 6on2-1 -<<< Too many missing values in total: 6qsz-3 -<<< Sequence is too short: 6r50-2 -<<< Sequence is too short: 6r7j-1 -<<< Too many missing values in the middle: 6rxm-4 -<<< Sequence is too short: 6s7g-1 -<<< Too many missing values in the ends: 6sb1-1 -<<< Too many missing values in the middle: 6s6a-1 -<<< Too many missing values in the middle: 6suo-1 -<<< Too many missing values in the middle: 6t2m-1 -<<< Some chains in the PDB do not appear in the fasta file: 6sx4-3 -<<< Some chains in the PDB do not appear in the fasta file: 6sl9-1 -<<< Sequence is too short: 6t4a-1 -<<< Some chains in the PDB do not appear in the fasta file: 6t9m-2 -<<< Some chains in the PDB do not appear in the fasta file: 6tkq-1 -<<< Sequence is too short: 6tq0-5 -<<< Some chains in the PDB do not appear in the fasta file: 6tlu-1 -<<< Some chains in the PDB do not appear in the fasta file: 6tnl-3 -<<< Too many missing values in the middle: 6tz7-1 -<<< Sequence is too short: 6u39-2 -<<< Too many missing values in the middle: 6u8g-2 -<<< Sequence is too short: 6uai-1 -<<< Too many missing values in the middle: 6ubw-1 -<<< Too many missing values in the middle: 6ug3-2 -<<< Too many missing values in the middle: 6uek-2 -<<< Too many missing values in the middle: 6v6q-1 -<<< Sequence is too short: 6uz1-1 -<<< Too many missing values in the middle: 6vbu-1 -<<< Too many missing values in total: 6vil-5 -<<< Too many missing values in the middle: 6vxo-1 -<<< Too many missing values in total: 6vrh-1 -<<< Unknown: 6wat-4 -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert - for (chain,) in pdb_entry.get_chains(): -ValueError: too many values to unpack (expected 1) - -<<< Too many missing values in the middle: 6wc9-1 -<<< Too many missing values in the middle: 6wkj-1 -<<< Too many missing values in the ends: 6wfy-1 -<<< Too many missing values in total: 6wqk-1 -<<< Too many missing values in total: 6wi3-3 -<<< Too many missing values in the middle: 6wnx-1 -<<< Incorrect alignment: 6x0a-2 -<<< Too many missing values in total: 6y73-1 -<<< Some chains in the PDB do not appear in the fasta file: 6yab-1 -<<< Too many missing values in total: 6yif-1 -<<< Some chains in the PDB do not appear in the fasta file: 6ylz-1 -<<< Incorrect alignment: 6yn1-1 -<<< Some chains in the PDB do not appear in the fasta file: 6yqr-1 -<<< Sequence is too short: 6yo8-2 -<<< Too many missing values in the middle: 6yvt-5 -<<< Some chains in the PDB do not appear in the fasta file: 6z3n-2 -<<< Sequence is too short: 6z7w-5 -<<< Some chains in the PDB do not appear in the fasta file: 6ziv-4 -<<< Some chains in the PDB do not appear in the fasta file: 6zry-1 -<<< Sequence is too short: 6zux-1 -<<< Too many missing values in the middle: 6zwm-1 -<<< Unknown: 7a8y-1 -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert - for (chain,) in pdb_entry.get_chains(): -ValueError: too many values to unpack (expected 1) - -<<< Some chains in the PDB do not appear in the fasta file: 7ael-1 -<<< Too many missing values in the middle: 7ahd-1 -<<< Too many missing values in the middle: 7alv-1 -<<< Too many missing values in total: 7age-3 -<<< Too many missing values in total: 7asu-1 -<<< Too many missing values in the ends: 7b5g-4 -<<< Some chains in the PDB do not appear in the fasta file: 7b6w-1 -<<< Too many missing values in total: 7aze-1 -<<< Too many missing values in the ends: 7bji-1 -<<< Too many missing values in the middle: 7bqz-1 -<<< Too many missing values in total: 7bot-1 -<<< Too many missing values in total: 7cfd-2 -<<< Too many missing values in total: 7ciz-3 -<<< Too many missing values in total: 7cla-1 -<<< Too many missing values in total: 7cmr-1 -<<< Too many missing values in total: 7crh-1 -<<< Too many missing values in total: 7d2q-1 -<<< Too many missing values in total: 7d0s-1 -<<< Too many missing values in total: 7dfc-1 -<<< Too many missing values in the ends: 7dmw-3 -<<< Too many missing values in the middle: 7dys-1 -<<< Too many missing values in the middle: 7drp-2 -<<< Too many missing values in total: 7cyl-1 -<<< Too many missing values in the middle: 7dae-1 -<<< Sequence is too short: 7etv-1 -<<< Too many missing values in the ends: 7f2n-1 -<<< Too many missing values in total: 7f5x-1 -<<< Sequence is too short: 7jl7-1 -<<< Too many missing values in total: 7jn9-1 -<<< Too many missing values in the middle: 7jsj-1 -<<< Sequence is too short: 7jwj-1 -<<< Too many missing values in the middle: 7k7q-1 -<<< Sequence is too short: 7k2s-2 -<<< Too many missing values in the middle: 7kfl-2 -<<< Unknown: 7kp5-1 -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert - for (chain,) in pdb_entry.get_chains(): -ValueError: too many values to unpack (expected 1) - -<<< Too many missing values in the ends: 7law-2 -<<< Too many missing values in the middle: 7jfr-1 -<<< Unnatural amino acids found: 7ln4-1 -<<< Too many missing values in the middle: 7lwp-1 -<<< Sequence is too short: 7m55-1 -<<< Too many missing values in the middle: 7l7i-1 -<<< Some chains in the PDB do not appear in the fasta file: 7mqt-1 -<<< Too many missing values in total: 7n27-1 -<<< Too many missing values in total: 7nm9-1 -<<< Sequence is too short: 7n8j-1 -<<< Sequence is too short: 7ntk-4 -<<< Some chains in the PDB do not appear in the fasta file: 7nvj-1 -<<< Too many missing values in the middle: 7o2e-1 -<<< Too many missing values in the middle: 7o49-2 -<<< Some chains in the PDB do not appear in the fasta file: 7o76-1 -<<< Some chains in the PDB do not appear in the fasta file: 7od0-4 -<<< Too many missing values in total: 7oeu-1 -<<< Too many missing values in total: 7ot9-1 -<<< Some chains in the PDB do not appear in the fasta file: 7orq-1 -<<< Sequence is too short: 7oxk-1 -<<< Some chains in the PDB do not appear in the fasta file: 7oza-1 -<<< Some chains in the PDB do not appear in the fasta file: 7p7o-1 -<<< Some chains in the PDB do not appear in the fasta file: 7ph0-1 -<<< Unknown: 7pe6-1 -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert - for (chain,) in pdb_entry.get_chains(): -ValueError: too many values to unpack (expected 1) - -<<< Too many missing values in total: 7nkj-1 -<<< Unknown: 7q8j-1 -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert - for (chain,) in pdb_entry.get_chains(): -ValueError: too many values to unpack (expected 1) - -<<< Too many missing values in the middle: 7qie-2 -<<< Too many missing values in the ends: 7qqn-2 -<<< Too many missing values in total: 7rlz-1 -<<< Sequence is too short: 7rn9-1 -<<< Too many missing values in total: 7rhl-1 -<<< Too many missing values in the middle: 7s1t-4 -<<< Sequence is too short: 7s4g-2 -<<< Sequence is too short: 7s8q-2 -<<< Too many missing values in total: 7srs-1 -<<< Too many missing values in total: 7sxy-1 -<<< Too many missing values in the middle: 7st3-5 -<<< Too many missing values in the middle: 7t1g-1 -<<< Unknown: 7t68-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in total: 7tyf-1 -<<< Too many missing values in the middle: 7ukv-1 -<<< Too many missing values in total: 7uve-1 -<<< Sequence is too short: 7uyk-2 -<<< Too many missing values in the ends: 7vec-1 -<<< Too many missing values in total: 7uea-1 -<<< Too many missing values in total: 7vf3-1 -<<< Too many missing values in the middle: 7vph-2 -<<< Too many missing values in the middle: 7vvk-1 -<<< Sequence is too short: 7vlz-1 -<<< Too many missing values in the middle: 7w1r-1 -<<< Too many missing values in total: 7wcu-1 -<<< Sequence is too short: 7wlx-1 -<<< Too many missing values in total: 7wri-1 -<<< Too many missing values in the middle: 7x9s-2 -<<< Too many missing values in the middle: 7xwi-2 -<<< Too many missing values in the middle: 7ye7-1 -<<< Some chains in the PDB do not appear in the fasta file: 7zad-1 -<<< Too many missing values in the middle: 7zfg-1 -<<< Too many missing values in total: 7zh3-1 -<<< Too many missing values in the middle: 8bfe-5 -<<< Too many missing values in total: 8do8-2 -<<< Unnatural amino acids found: 8eio-1 -<<< Too many missing values in total: 8f5p-1 -<<< Too many missing values in total: 7zbn-1 -<<< Too many missing values in total: 1hh3-1 -<<< Too many missing values in total: 1lgc-1 -<<< Sequence is too short: 1lwu-1 -<<< Unnatural amino acids found: 2h26-1 -<<< Sequence is too short: 2g5b-2 -<<< Sequence is too short: 2vdr-1 -<<< Unknown: 3d7w-1 -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1334, in get_coordinates_array - chain_crd[informative_mask]["unique_residue_number"].astype(int), - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/generic.py", line 6324, in astype - new_data = self._mgr.astype(dtype=dtype, copy=copy, errors=errors) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/internals/managers.py", line 451, in astype - return self.apply( - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/internals/managers.py", line 352, in apply - applied = getattr(b, f)(**kwargs) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/internals/blocks.py", line 511, in astype - new_values = astype_array_safe(values, dtype, copy=copy, errors=errors) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/dtypes/astype.py", line 242, in astype_array_safe - new_values = astype_array(values, dtype, copy=copy) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/dtypes/astype.py", line 187, in astype_array - values = _astype_nansafe(values, dtype, copy=copy) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/dtypes/astype.py", line 138, in _astype_nansafe - return arr.astype(dtype, copy=True) -ValueError: invalid literal for int() with base 10: '510_' - -<<< Sequence is too short: 3hus-2 -<<< Sequence is too short: 3pma-4 -<<< Too many missing values in the ends: 4aa1-1 -<<< Too many missing values in the ends: 4fqx-3 -<<< Sequence is too short: 5djx-2 -<<< Too many missing values in the middle: 5es4-4 -<<< Sequence is too short: 5j50-1 -<<< Unnatural amino acids found: 5jqb-1 -<<< Sequence is too short: 5ujt-3 -<<< Too many missing values in the middle: 5vgj-1 -<<< Too many missing values in the ends: 5w6i-1 -<<< Too many missing values in the ends: 5hcd-1 -<<< Too many missing values in total: 6fyw-1 -<<< Too many missing values in the middle: 6ht9-2 -<<< Too many missing values in the middle: 6np0-1 -<<< Unknown: 6m8p-6 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in the middle: 6oej-2 -<<< Too many missing values in the middle: 6plz-1 -<<< Too many missing values in the middle: 6uyg-1 -<<< Too many missing values in the middle: 6vkf-2 -<<< Too many missing values in total: 6xp6-2 -<<< Some chains in the PDB do not appear in the fasta file: 6ytr-1 -<<< Too many missing values in the middle: 7ad1-1 -<<< Too many missing values in the ends: 7cq5-1 -<<< Some chains in the PDB do not appear in the fasta file: 7b6u-1 -<<< Unknown: 7drb-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in total: 6x40-1 -<<< Too many missing values in the middle: 7lkp-1 -<<< Too many missing values in the middle: 7mwx-2 -<<< Unnatural amino acids found: 7ne0-1 -<<< Sequence is too short: 7o50-2 -<<< Too many missing values in total: 7tti-1 -<<< Too many missing values in the ends: 7qzr-1 -<<< Too many missing values in the middle: 7sxx-1 -<<< Too many missing values in total: 7x8w-1 -<<< Too many missing values in the middle: 8dlj-1 -<<< Sequence is too short: 1a6a-1 -<<< Sequence is too short: 1awr-1 -<<< Too many missing values in the middle: 1aya-2 -<<< Sequence is too short: 1b17-1 -<<< Too many missing values in the middle: 1b8k-1 -<<< Sequence is too short: 1b05-1 -<<< Too many missing values in total: 1bdw-1 -<<< Sequence is too short: 1bbr-2 -<<< Too many missing values in the middle: 1bpe-1 -<<< Sequence is too short: 1d4w-1 -<<< Sequence is too short: 1dph-1 -<<< Too many missing values in the middle: 1du3-1 -<<< Too many missing values in total: 1efm-1 -<<< Too many missing values in the middle: 1ejf-1 -<<< Sequence is too short: 1etl-1 -<<< Sequence is too short: 1ffp-1 -<<< Too many missing values in total: 1fm9-1 -<<< Sequence is too short: 1g39-3 -<<< Too many missing values in total: 1gi8-1 -<<< Unnatural amino acids found: 1h0h-2 -<<< Too many missing values in the middle: 1grl-2 -<<< Sequence is too short: 1hlt-1 -<<< Too many missing values in the middle: 1hnk-1 -<<< Sequence is too short: 1him-2 -<<< Too many missing values in the middle: 1huu-1 -<<< Sequence is too short: 1i1f-1 -<<< Too many missing values in total: 1iqm-1 -<<< Too many missing values in the middle: 1jkf-1 -<<< Too many missing values in the middle: 1jq7-1 -<<< Too many missing values in the ends: 1jp5-2 -<<< Too many missing values in the middle: 1kn9-4 -<<< Too many missing values in the middle: 1l8w-2 -<<< Sequence is too short: 1mk9-1 -<<< Too many missing values in total: 1muj-1 -<<< Sequence is too short: 1nrs-1 -<<< Sequence is too short: 1nx0-1 -<<< Sequence is too short: 1nvr-1 -<<< Too many missing values in total: 1o6o-1 -<<< Sequence is too short: 1ou8-1 -<<< Too many missing values in the middle: 1pdg-2 -<<< Too many missing values in the middle: 1pm3-1 -<<< Sequence is too short: 1ppe-1 -<<< Too many missing values in total: 1q4q-2 -<<< Sequence is too short: 1qd6-2 -<<< Sequence is too short: 1qls-1 -<<< Sequence is too short: 1qxa-1 -<<< Sequence is too short: 1rbg-1 -<<< Sequence is too short: 1r5v-2 -<<< Too many missing values in the ends: 1rh5-1 -<<< Too many missing values in total: 1rrv-1 -<<< Too many missing values in the ends: 1s94-2 -<<< Sequence is too short: 1s7r-2 -<<< Too many missing values in the middle: 1t2v-3 -<<< Sequence is too short: 1t5x-1 -<<< Sequence is too short: 1tjg-1 -<<< Too many missing values in total: 1tu3-2 -<<< Too many missing values in total: 1tno-2 -<<< Too many missing values in the ends: 1tzy-1 -<<< Too many missing values in the middle: 1ud1-1 -<<< Too many missing values in total: 1tyq-1 -<<< Sequence is too short: 1uhb-1 -<<< Unnatural amino acids found: 1w5c-1 -<<< Too many missing values in total: 1w7r-1 -<<< Too many missing values in the middle: 1wr6-1 -<<< Sequence is too short: 1xda-11 -<<< Too many missing values in the middle: 1xqb-1 -<<< Sequence is too short: 1y2a-1 -<<< Sequence is too short: 1ypl-1 -<<< Sequence is too short: 1yn6-1 -<<< Sequence is too short: 1zmi-6 -<<< Sequence is too short: 1zni-1 -<<< Too many missing values in the middle: 1ztm-1 -<<< Too many missing values in the middle: 1zw0-15 -<<< Too many missing values in the middle: 1zxe-1 -<<< Too many missing values in the middle: 2a33-1 -<<< Sequence is too short: 2ak5-1 -<<< Sequence is too short: 2aq9-1 -<<< Sequence is too short: 2b1f-1 -<<< Too many missing values in the middle: 2bbh-1 -<<< Too many missing values in total: 2bd4-1 -<<< Too many missing values in total: 2bdx-1 -<<< Too many missing values in the middle: 2br9-1 -<<< Sequence is too short: 2bvx-1 -<<< Too many missing values in the middle: 2c1n-1 -<<< Too many missing values in the middle: 2c8t-3 -<<< Too many missing values in the middle: 2d5h-1 -<<< Too many missing values in the middle: 2d2r-1 -<<< Too many missing values in the ends: 2d11-4 -<<< Too many missing values in the middle: 2di4-1 -<<< Too many missing values in total: 2dma-1 -<<< Sequence is too short: 2fmk-1 -<<< Too many missing values in the middle: 2fvu-1 -<<< Sequence is too short: 2fx8-1 -<<< Sequence is too short: 2gph-1 -<<< Too many missing values in total: 2gl7-1 -<<< Sequence is too short: 2h1c-1 -<<< Too many missing values in the ends: 2h65-1 -<<< Too many missing values in the middle: 2hww-3 -<<< Too many missing values in the middle: 2hy1-1 -<<< Too many missing values in the middle: 2i0i-3 -<<< Sequence is too short: 2hpc-4 -<<< Too many missing values in the middle: 2ihe-1 -<<< Sequence is too short: 2ins-4 -<<< Sequence is too short: 2jdr-1 -<<< Too many missing values in the middle: 2nyd-1 -<<< Sequence is too short: 2o4j-2 -<<< Sequence is too short: 2os2-1 -<<< Too many missing values in the middle: 2p22-1 -<<< Too many missing values in the middle: 2p9b-1 -<<< Sequence is too short: 2pm5-5 -<<< Sequence is too short: 2p6a-1 -<<< Too many missing values in the middle: 2pf4-2 -<<< Too many missing values in the middle: 2q3v-2 -<<< Too many missing values in the middle: 2q6r-1 -<<< Too many missing values in the middle: 2q7u-1 -<<< Sequence is too short: 2qbx-1 -<<< Sequence is too short: 2qa8-1 -<<< Too many missing values in the ends: 2qjb-1 -<<< Unexpected atoms (D1): 2r24-1 -<<< Too many missing values in total: 2uwl-1 -<<< Too many missing values in the middle: 2v92-1 -<<< Too many missing values in the middle: 2vvg-2 -<<< Too many missing values in the middle: 2vso-1 -<<< Incorrect alignment: 2w8s-1 -<<< Too many missing values in the ends: 2wax-2 -<<< Too many missing values in the middle: 2woj-2 -<<< Too many missing values in the ends: 2wpj-1 -<<< Sequence is too short: 2ws6-5 -<<< Too many missing values in the middle: 2xby-1 -<<< Too many missing values in the middle: 2xk3-1 -<<< Too many missing values in total: 2xze-2 -<<< Too many missing values in the middle: 2ybx-1 -<<< Too many missing values in the middle: 2yqy-1 -<<< Too many missing values in total: 2yvc-2 -<<< Unnatural amino acids found: 2z5o-2 -<<< Too many missing values in the ends: 2z3d-1 -<<< Too many missing values in the middle: 2ztu-1 -<<< Too many missing values in total: 3a2h-1 -<<< Too many missing values in the middle: 3a61-1 -<<< Too many missing values in total: 3ai6-2 -<<< Too many missing values in the middle: 3alo-2 -<<< Too many missing values in total: 3atw-1 -<<< Too many missing values in total: 3bzx-4 -<<< Too many missing values in the middle: 3bow-1 -<<< Sequence is too short: 3c3r-1 -<<< Too many missing values in the middle: 3cbr-1 -<<< Too many missing values in total: 3chf-2 -<<< Too many missing values in the middle: 3cjq-1 -<<< Sequence is too short: 3d1f-1 -<<< Too many missing values in the middle: 3d8e-3 -<<< Too many missing values in the middle: 3dcz-1 -<<< Too many missing values in the middle: 3ddq-1 -<<< Too many missing values in the middle: 3e1k-2 -<<< Sequence is too short: 3e8c-4 -<<< Sequence is too short: 3e0m-1 -<<< Too many missing values in total: 3egh-2 -<<< Too many missing values in the middle: 3eul-5 -<<< Sequence is too short: 3cww-1 -<<< Too many missing values in the middle: 3f87-1 -<<< Too many missing values in the middle: 3f9y-1 -<<< Too many missing values in the middle: 3fog-1 -<<< Sequence is too short: 3ftr-1 -<<< Sequence is too short: 3fwv-1 -<<< Too many missing values in the middle: 3gbx-1 -<<< Too many missing values in total: 3gj8-2 -<<< Sequence is too short: 3h9s-1 -<<< Too many missing values in the middle: 3i5p-1 -<<< Sequence is too short: 3i6l-1 -<<< Too many missing values in the middle: 3ihp-2 -<<< Too many missing values in the middle: 3jq7-1 -<<< Too many missing values in the middle: 3kbe-1 -<<< Too many missing values in total: 3kqi-1 -<<< Unknown: 3kp4-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Sequence is too short: 3kkv-1 -<<< Too many missing values in the middle: 3khd-2 -<<< Too many missing values in the middle: 3l6v-1 -<<< Unknown: 3l9v-2 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3l8r-3 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3ld2-3 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3laz-2 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3le6-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lha-2 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lgb-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lis-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lc1-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3li8-2 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3ljy-2 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lf7-2 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lkp-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lls-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in the middle: 3lt0-1 -<<< Too many missing values in the ends: 3luo-2 -<<< Too many missing values in the middle: 3m1g-1 -<<< Too many missing values in total: 3mev-1 -<<< Sequence is too short: 3mls-4 -<<< Sequence is too short: 3mrq-1 -<<< Sequence is too short: 3mvj-3 -<<< Sequence is too short: 3nco-3 -<<< Sequence is too short: 3nfk-3 -<<< Incorrect alignment: 3nbj-4 -<<< Too many missing values in the middle: 3ngr-1 -<<< Sequence is too short: 3o17-1 -<<< Too many missing values in total: 3o45-2 -<<< Too many missing values in the ends: 3oj3-2 -<<< Too many missing values in the ends: 3oq0-9 -<<< Sequence is too short: 3ou1-1 -<<< Too many missing values in total: 3p0g-1 -<<< Sequence is too short: 3ogl-6 -<<< Too many missing values in the middle: 3p35-1 -<<< Too many missing values in the ends: 3pcx-2 -<<< Too many missing values in the middle: 3pfy-1 -<<< Sequence is too short: 3ppd-1 -<<< Sequence is too short: 3pwl-1 -<<< Too many missing values in the middle: 3q9i-3 -<<< Too many missing values in the middle: 3qbn-1 -<<< Sequence is too short: 3qjn-5 -<<< Sequence is too short: 3qg6-1 -<<< Sequence is too short: 3qn7-1 -<<< Too many missing values in total: 3qzv-1 -<<< Too many missing values in the middle: 3rbw-4 -<<< Too many missing values in the middle: 3rpg-1 -<<< Sequence is too short: 3rwe-1 -<<< Too many missing values in the middle: 3rz3-3 -<<< Too many missing values in the middle: 3sl1-2 -<<< Too many missing values in total: 3sow-3 -<<< Unnatural amino acids found: 3stj-1 -<<< Too many missing values in the middle: 3swc-3 -<<< Too many missing values in the middle: 3tau-1 -<<< Sequence is too short: 3tbs-1 -<<< Too many missing values in the ends: 3tjg-1 -<<< Sequence is too short: 3tcg-8 -<<< Too many missing values in total: 3tsw-2 -<<< Too many missing values in the middle: 3tvz-3 -<<< Too many missing values in total: 3u1i-1 -<<< Sequence is too short: 3u3f-1 -<<< Too many missing values in total: 3ul5-1 -<<< Too many missing values in the ends: 3uua-2 -<<< Sequence is too short: 3uvm-1 -<<< Sequence is too short: 3v2x-1 -<<< Too many missing values in the middle: 3v6m-4 -<<< Sequence is too short: 3v3v-1 -<<< Sequence is too short: 3vfm-1 -<<< Too many missing values in the ends: 3vb5-1 -<<< Too many missing values in total: 3vrr-1 -<<< Too many missing values in total: 3wht-1 -<<< Too many missing values in the ends: 3wtf-1 -<<< Too many missing values in total: 3w3y-1 -<<< Too many missing values in total: 3wgv-1 -<<< Too many missing values in the middle: 3zqj-6 -<<< Sequence is too short: 3zio-1 -<<< Too many missing values in the middle: 4a2p-1 -<<< Too many missing values in the ends: 4a9j-1 -<<< Sequence is too short: 3zrl-1 -<<< Sequence is too short: 4aif-2 -<<< Too many missing values in the middle: 4bj5-1 -<<< Too many missing values in the ends: 4brr-1 -<<< Too many missing values in the ends: 4bwq-3 -<<< Too many missing values in the middle: 4by2-2 -<<< Too many missing values in the middle: 4cbt-1 -<<< Too many missing values in the middle: 4cfe-1 -<<< Too many missing values in the middle: 4ckw-2 -<<< Sequence is too short: 4cxn-1 -<<< Too many missing values in the middle: 4d11-3 -<<< Too many missing values in the middle: 4da9-1 -<<< Sequence is too short: 4dor-3 -<<< Sequence is too short: 4dqm-1 -<<< Too many missing values in the middle: 4dyv-3 -<<< Too many missing values in the ends: 4e19-1 -<<< Too many missing values in the middle: 4e2h-1 -<<< Too many missing values in the ends: 4ec6-2 -<<< Too many missing values in the middle: 4etv-2 -<<< Too many missing values in the middle: 4eyt-2 -<<< Too many missing values in the middle: 4ezq-4 -<<< Too many missing values in the middle: 4fa0-1 -<<< Too many missing values in total: 4fbw-2 -<<< Sequence is too short: 4fi9-1 -<<< Too many missing values in total: 4fj3-1 -<<< Sequence is too short: 4g6a-1 -<<< Too many missing values in the middle: 4go6-3 -<<< Too many missing values in total: 4gxb-1 -<<< Too many missing values in the middle: 4hou-2 -<<< Sequence is too short: 4ht6-2 -<<< Sequence is too short: 4hw4-1 -<<< Sequence is too short: 4i31-2 -<<< Too many missing values in the middle: 4iea-1 -<<< Too many missing values in the middle: 4igk-1 -<<< Sequence is too short: 4ins-6 -<<< Too many missing values in the middle: 4iw4-1 -<<< Sequence is too short: 4j2l-2 -<<< Sequence is too short: 4j9g-2 -<<< Too many missing values in total: 4j83-2 -<<< Too many missing values in total: 4jol-2 -<<< Sequence is too short: 4jry-1 -<<< Sequence is too short: 4k6y-2 -<<< Too many missing values in total: 4k38-1 -<<< Too many missing values in the middle: 4kv1-2 -<<< Sequence is too short: 4laj-3 -<<< Too many missing values in the middle: 4lle-2 -<<< Too many missing values in the middle: 4loo-1 -<<< Too many missing values in the middle: 4mcn-1 -<<< Sequence is too short: 4mny-1 -<<< Too many missing values in the middle: 4mzm-2 -<<< Too many missing values in total: 4n3g-1 -<<< Too many missing values in total: 4nft-3 -<<< Too many missing values in the middle: 4nim-2 -<<< Too many missing values in the middle: 4nmt-1 -<<< Sequence is too short: 4nny-1 -<<< Too many missing values in total: 4p0b-1 -<<< Too many missing values in the ends: 4p3w-1 -<<< Too many missing values in the ends: 4pa7-1 -<<< Too many missing values in the middle: 4pdp-1 -<<< Too many missing values in the middle: 4pl7-1 -<<< Too many missing values in total: 4pk2-1 -<<< Sequence is too short: 4pra-1 -<<< Sequence is too short: 4pp6-1 -<<< Sequence is too short: 4qbr-2 -<<< Too many missing values in total: 4qmf-1 -<<< Sequence is too short: 4pes-1 -<<< Too many missing values in the middle: 4qts-2 -<<< Too many missing values in the middle: 4qxa-1 -<<< Sequence is too short: 4r0i-1 -<<< Too many missing values in total: 4roj-2 -<<< Too many missing values in the middle: 4rt7-1 -<<< Too many missing values in total: 4ryd-1 -<<< Too many missing values in the middle: 4tzj-1 -<<< Too many missing values in total: 4twi-1 -<<< Too many missing values in the middle: 4up5-1 -<<< Too many missing values in the middle: 4uro-4 -<<< Sequence is too short: 4uu8-1 -<<< Too many missing values in the middle: 4uya-1 -<<< Too many missing values in the middle: 4v0m-2 -<<< Too many missing values in the middle: 4tv8-1 -<<< Too many missing values in the ends: 4w2o-2 -<<< Sequence is too short: 4w50-3 -<<< Unknown: 4v7n-15 -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert - for (chain,) in pdb_entry.get_chains(): -ValueError: too many values to unpack (expected 1) - -<<< Unknown: 4v4c-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Sequence is too short: 4wb6-1 -<<< Too many missing values in total: 4uv9-1 -<<< Too many missing values in total: 4wx8-3 -<<< Too many missing values in total: 4wyb-1 -<<< Too many missing values in the middle: 4x7h-1 -<<< Too many missing values in total: 4x9r-1 -<<< Too many missing values in the middle: 4xi8-2 -<<< Too many missing values in the middle: 4y66-3 -<<< Too many missing values in the middle: 4y3b-1 -<<< Sequence is too short: 4yo0-1 -<<< Too many missing values in the middle: 4z9m-7 -<<< Too many missing values in the middle: 4zhx-1 -<<< Too many missing values in the middle: 4zp4-2 -<<< Sequence is too short: 5a0x-2 -<<< Too many missing values in total: 5ah2-1 -<<< Sequence is too short: 5ajn-1 -<<< Unnatural amino acids found: 5azz-1 -<<< Too many missing values in the middle: 5bop-1 -<<< Sequence is too short: 5b4w-1 -<<< Sequence is too short: 5c02-1 -<<< Sequence is too short: 5c7e-1 -<<< Too many missing values in the ends: 5cos-2 -<<< Too many missing values in total: 5csj-1 -<<< Too many missing values in total: 5cxt-8 -<<< Too many missing values in total: 5da7-1 -<<< Too many missing values in the ends: 5dpw-1 -<<< Too many missing values in total: 5dmg-2 -<<< Too many missing values in the middle: 5dsc-4 -<<< Sequence is too short: 5e8f-2 -<<< Too many missing values in the middle: 5f51-2 -<<< Sequence is too short: 5f67-1 -<<< Too many missing values in the middle: 5feh-2 -<<< Too many missing values in total: 5ft1-2 -<<< Too many missing values in the middle: 5fuc-2 -<<< Sequence is too short: 5grg-1 -<<< Sequence is too short: 5gsv-1 -<<< Too many missing values in the middle: 5h98-2 -<<< Sequence is too short: 5hhp-1 -<<< Sequence is too short: 5hox-4 -<<< Sequence is too short: 5hvz-1 -<<< Too many missing values in total: 5hq8-2 -<<< Sequence is too short: 5hyq-1 -<<< Too many missing values in total: 5i70-1 -<<< Sequence is too short: 5id0-1 -<<< Sequence is too short: 5iqo-2 -<<< Too many missing values in total: 5iue-2 -<<< Too many missing values in total: 5fq7-1 -<<< Too many missing values in the middle: 5j71-1 -<<< Too many missing values in total: 5jer-5 -<<< Sequence is too short: 5jhc-10 -<<< Sequence is too short: 5jwe-2 -<<< Too many missing values in the middle: 5k19-3 -<<< Too many missing values in the middle: 5k86-1 -<<< Too many missing values in total: 5kc1-2 -<<< Too many missing values in the middle: 5keu-1 -<<< Sequence is too short: 5kra-1 -<<< Sequence is too short: 5l83-2 -<<< Sequence is too short: 5leo-2 -<<< Too many missing values in total: 5lm1-1 -<<< Too many missing values in total: 5m72-1 -<<< Sequence is too short: 5m5s-1 -<<< Sequence is too short: 5mlw-4 -<<< Too many missing values in the middle: 5mph-1 -<<< Too many missing values in total: 5msu-1 -<<< Too many missing values in the middle: 5mvi-1 -<<< Too many missing values in total: 5mu0-5 -<<< Too many missing values in total: 5mub-7 -<<< Too many missing values in the ends: 5n74-3 -<<< Too many missing values in the ends: 5nc8-1 -<<< Too many missing values in the middle: 5nla-1 -<<< Too many missing values in the middle: 5nng-1 -<<< Too many missing values in the middle: 5nr7-1 -<<< Too many missing values in the middle: 5nud-1 -<<< Too many missing values in the ends: 5n33-1 -<<< Too many missing values in the middle: 5o3q-1 -<<< Too many missing values in total: 5npw-2 -<<< Sequence is too short: 5nw8-1 -<<< Too many missing values in the middle: 5oi3-1 -<<< Sequence is too short: 5o9u-2 -<<< Too many missing values in total: 5oo6-6 -<<< Sequence is too short: 5q0l-2 -<<< Sequence is too short: 5q1f-2 -<<< Too many missing values in the middle: 5oqq-2 -<<< Too many missing values in the ends: 5qu1-2 -<<< Too many missing values in the middle: 5r4a-1 -<<< Sequence is too short: 5r1r-1 -<<< Too many missing values in the middle: 5s5y-1 -<<< Too many missing values in the middle: 5sbb-1 -<<< Too many missing values in the middle: 5t27-1 -<<< Sequence is too short: 5t1l-2 -<<< Too many missing values in the middle: 5tf2-1 -<<< Too many missing values in the middle: 5uly-2 -<<< Too many missing values in the middle: 5un6-1 -<<< Too many missing values in the middle: 5uq0-1 -<<< Too many missing values in the middle: 5ur1-2 -<<< Sequence is too short: 5va9-1 -<<< Too many missing values in the middle: 5vmt-2 -<<< Too many missing values in the middle: 5vvt-1 -<<< Sequence is too short: 5vue-1 -<<< Too many missing values in the middle: 5w5o-8 -<<< Too many missing values in the middle: 5w8f-1 -<<< Too many missing values in total: 5w4g-1 -<<< Sequence is too short: 5wa1-1 -<<< Sequence is too short: 5wha-2 -<<< Too many missing values in the middle: 5wer-3 -<<< Sequence is too short: 5wli-4 -<<< Sequence is too short: 5wzx-1 -<<< Too many missing values in the middle: 5x83-1 -<<< Sequence is too short: 5xjm-1 -<<< Too many missing values in the middle: 5xxk-2 -<<< Too many missing values in total: 5xw9-1 -<<< Too many missing values in total: 5y27-1 -<<< Sequence is too short: 5xzf-1 -<<< Too many missing values in the middle: 5yc4-1 -<<< Too many missing values in the middle: 5yek-1 -<<< Too many missing values in the ends: 5yb0-6 -<<< Too many missing values in the middle: 5yhi-1 -<<< Sequence is too short: 5yd5-1 -<<< Too many missing values in the middle: 5yj1-14 -<<< Sequence is too short: 5yip-1 -<<< Too many missing values in the middle: 5yvc-1 -<<< Too many missing values in the middle: 5zgc-2 -<<< Too many missing values in the middle: 5zod-1 -<<< Too many missing values in the middle: 5zia-4 -<<< Too many missing values in the middle: 6a2k-1 -<<< Sequence is too short: 6a9c-1 -<<< Sequence is too short: 6au5-1 -<<< Too many missing values in the middle: 6b1l-2 -<<< Too many missing values in the middle: 6b4c-12 -<<< Too many missing values in total: 6b67-3 -<<< Sequence is too short: 6bcy-2 -<<< Too many missing values in total: 6bqt-1 -<<< Too many missing values in the middle: 6c4u-3 -<<< Too many missing values in the middle: 6c08-1 -<<< Too many missing values in the middle: 6bro-2 -<<< Sequence is too short: 6cbi-1 -<<< Too many missing values in the middle: 6cpg-1 -<<< Too many missing values in the middle: 6cxo-2 -<<< Too many missing values in total: 6czo-2 -<<< Too many missing values in total: 6dca-4 -<<< Too many missing values in the middle: 6dfs-1 -<<< Too many missing values in the middle: 6dr4-1 -<<< Sequence is too short: 6e3g-1 -<<< Too many missing values in total: 6ecf-5 -<<< Too many missing values in total: 6ehp-1 -<<< Sequence is too short: 6eqa-1 -<<< Unnatural amino acids found: 6f6s-1 -<<< Too many missing values in the middle: 6fit-1 -<<< Too many missing values in the middle: 6fyz-3 -<<< Too many missing values in total: 6g07-3 -<<< Unknown: 6g5k-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in the middle: 6g6e-1 -<<< Too many missing values in total: 6fy2-1 -<<< Too many missing values in the middle: 6g31-1 -<<< Too many missing values in the middle: 6gek-1 -<<< Too many missing values in total: 6g8q-1 -<<< Sequence is too short: 6gh1-1 -<<< Too many missing values in total: 6gum-1 -<<< Too many missing values in total: 6h06-3 -<<< Sequence is too short: 6hby-1 -<<< Too many missing values in the middle: 6gxc-1 -<<< Too many missing values in the middle: 6hr5-1 -<<< Some chains in the PDB do not appear in the fasta file: 6i46-1 -<<< Sequence is too short: 6i2h-1 -<<< Too many missing values in the middle: 6ija-3 -<<< Too many missing values in the middle: 6im9-1 -<<< Unknown: 6igc-8 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Sequence is too short: 6j2e-2 -<<< Too many missing values in the middle: 6jm4-2 -<<< Too many missing values in the ends: 6jzb-1 -<<< Too many missing values in the middle: 6ki9-3 -<<< Too many missing values in the middle: 6kmt-2 -<<< Sequence is too short: 6knv-1 -<<< Too many missing values in the middle: 6l30-1 -<<< Too many missing values in total: 6ldv-1 -<<< Too many missing values in the middle: 6lol-2 -<<< Too many missing values in the middle: 6m1u-1 -<<< Sequence is too short: 6mbk-2 -<<< Too many missing values in total: 6maj-1 -<<< Too many missing values in total: 6m8y-1 -<<< Too many missing values in the ends: 6m32-1 -<<< Too many missing values in the middle: 6mha-1 -<<< Sequence is too short: 6mpn-2 -<<< Sequence is too short: 6nca-13 -<<< Sequence is too short: 6nv1-1 -<<< Too many missing values in total: 6o3x-2 -<<< Too many missing values in total: 6nt9-1 -<<< Too many missing values in the ends: 6oau-1 -<<< Sequence is too short: 6oi4-2 -<<< Too many missing values in total: 6osm-1 -<<< Sequence is too short: 6oqx-1 -<<< Sequence is too short: 6oyy-1 -<<< Sequence is too short: 6p2s-1 -<<< Too many missing values in total: 6phn-1 -<<< Too many missing values in total: 6pln-2 -<<< Too many missing values in the ends: 6psd-5 -<<< Too many missing values in the middle: 6ptl-1 -<<< Sequence is too short: 6q0n-2 -<<< Sequence is too short: 6pyw-1 -<<< Sequence is too short: 6qiu-1 -<<< Too many missing values in the ends: 6qsz-4 -<<< Too many missing values in total: 6q9i-1 -<<< Sequence is too short: 6r51-1 -<<< Sequence is too short: 6r7k-1 -<<< Too many missing values in the middle: 6rix-1 -<<< Too many missing values in the middle: 6rxm-5 -<<< Sequence is too short: 6ruj-1 -<<< Too many missing values in the middle: 6s6a-2 -<<< Too many missing values in the ends: 6sb1-2 -<<< Some chains in the PDB do not appear in the fasta file: 6sqv-1 -<<< Some chains in the PDB do not appear in the fasta file: 6sla-1 -<<< Too many missing values in the middle: 6szw-1 -<<< Some chains in the PDB do not appear in the fasta file: 6sx4-4 -<<< Some chains in the PDB do not appear in the fasta file: 6t2n-1 -<<< Some chains in the PDB do not appear in the fasta file: 6tkq-2 -<<< Sequence is too short: 6tq0-6 -<<< Some chains in the PDB do not appear in the fasta file: 6tnl-4 -<<< Too many missing values in the ends: 6u39-3 -<<< Sequence is too short: 6u8h-1 -<<< Sequence is too short: 6uk4-1 -<<< Sequence is too short: 6uln-1 -<<< Sequence is too short: 6uz1-2 -<<< Too many missing values in the middle: 6v6q-2 -<<< Too many missing values in the middle: 6vbv-1 -<<< Sequence is too short: 6vjn-1 -<<< Too many missing values in the ends: 6vxp-1 -<<< Sequence is too short: 6w05-1 -<<< Unknown: 6wat-5 -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert - for (chain,) in pdb_entry.get_chains(): -ValueError: too many values to unpack (expected 1) - -<<< Too many missing values in the middle: 6wca-1 -<<< Sequence is too short: 6wfz-1 -<<< Sequence is too short: 6wi4-1 -<<< Too many missing values in total: 6wmd-1 -<<< Too many missing values in the middle: 6wnx-2 -<<< Too many missing values in total: 6wsj-1 -<<< Too many missing values in the middle: 6wvv-2 -<<< Incorrect alignment: 6x0a-3 -<<< Too many missing values in total: 6x1s-1 -<<< Too many missing values in total: 6xxr-1 -<<< Too many missing values in total: 6y73-2 -<<< Some chains in the PDB do not appear in the fasta file: 6yab-2 -<<< Incorrect alignment: 6yn1-2 -<<< Too many missing values in the ends: 6ypl-1 -<<< Some chains in the PDB do not appear in the fasta file: 6yqs-1 -<<< Some chains in the PDB do not appear in the fasta file: 6z3o-1 -<<< Sequence is too short: 6z7w-6 -<<< Some chains in the PDB do not appear in the fasta file: 6zi0-1 -<<< Some chains in the PDB do not appear in the fasta file: 6ziv-5 -<<< Sequence is too short: 6zv7-1 -<<< Some chains in the PDB do not appear in the fasta file: 6zry-2 -<<< Too many missing values in the ends: 6zwo-1 -<<< Sequence is too short: 7a2w-1 -<<< Too many missing values in the middle: 7a8z-1 -<<< Too many missing values in total: 7age-4 -<<< Some chains in the PDB do not appear in the fasta file: 7alx-1 -<<< Too many missing values in total: 7asv-1 -<<< Sequence is too short: 7b13-1 -<<< Too many missing values in total: 7azf-1 -<<< Too many missing values in the ends: 7bji-2 -<<< Too many missing values in total: 7bcy-1 -<<< Too many missing values in total: 7bqz-2 -<<< Too many missing values in total: 7cfd-3 -<<< Sequence is too short: 7co1-1 -<<< Too many missing values in the middle: 7dmx-1 -<<< Too many missing values in the middle: 7cbz-1 -<<< Sequence is too short: 7duu-1 -<<< Too many missing values in the middle: 7daf-1 -<<< Too many missing values in the middle: 7cld-1 -<<< Sequence is too short: 7edo-1 -<<< Too many missing values in the middle: 7ezh-1 -<<< Too many missing values in the middle: 7f2o-1 -<<< Too many missing values in total: 7f4a-1 -<<< Too many missing values in the middle: 7jsk-1 -<<< Sequence is too short: 7k7r-1 -<<< Too many missing values in the middle: 7kzc-2 -<<< Too many missing values in the middle: 7l7j-1 -<<< Too many missing values in the ends: 7lfb-1 -<<< Unnatural amino acids found: 7ln5-1 -<<< Too many missing values in total: 7n27-2 -<<< Too many missing values in the middle: 7mvy-1 -<<< Sequence is too short: 7n5c-1 -<<< Too many missing values in total: 7ni6-1 -<<< Too many missing values in total: 7nkq-1 -<<< Some chains in the PDB do not appear in the fasta file: 7nfv-1 -<<< Some chains in the PDB do not appear in the fasta file: 7nvk-1 -<<< Too many missing values in total: 7nma-1 -<<< Some chains in the PDB do not appear in the fasta file: 7nzb-1 -<<< Too many missing values in the middle: 7o2f-1 -<<< Some chains in the PDB do not appear in the fasta file: 7od0-5 -<<< Some chains in the PDB do not appear in the fasta file: 7obo-1 -<<< Some chains in the PDB do not appear in the fasta file: 7olw-1 -<<< Some chains in the PDB do not appear in the fasta file: 7oza-2 -<<< Some chains in the PDB do not appear in the fasta file: 7p7w-1 -<<< Too many missing values in the middle: 7pe7-1 -<<< Sequence is too short: 7q1s-6 -<<< Some chains in the PDB do not appear in the fasta file: 7pwx-1 -<<< Unknown: 7q8j-2 -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert - for (chain,) in pdb_entry.get_chains(): -ValueError: too many values to unpack (expected 1) - -<<< Unknown: 7q9h-1 -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert - for (chain,) in pdb_entry.get_chains(): -ValueError: too many values to unpack (expected 1) - -<<< Sequence is too short: 7qqy-1 -<<< Some chains in the PDB do not appear in the fasta file: 7quk-1 -<<< Some chains in the PDB do not appear in the fasta file: 7qyx-1 -<<< Too many missing values in total: 7rg9-1 -<<< Too many missing values in the middle: 7rkm-1 -<<< Too many missing values in the middle: 7rna-1 -<<< Too many missing values in total: 7rlz-2 -<<< Too many missing values in the middle: 7rym-1 -<<< Sequence is too short: 7s4g-3 -<<< Sequence is too short: 7s8r-1 -<<< Sequence is too short: 7snx-1 -<<< Too many missing values in total: 7sy0-1 -<<< Too many missing values in the middle: 7st3-6 -<<< Unknown: 7t68-2 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 7t8v-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Incorrect alignment: 7tl7-1 -<<< Too many missing values in total: 7tuq-1 -<<< Too many missing values in the middle: 7u5b-1 -<<< Too many missing values in the ends: 7uxe-1 -<<< Unnatural amino acids found: 7uyl-1 -<<< Too many missing values in the middle: 7v2a-1 -<<< Too many missing values in the ends: 7vec-10 -<<< Too many missing values in total: 7vf3-2 -<<< Too many missing values in total: 7v0s-1 -<<< Too many missing values in the middle: 7vvl-1 -<<< Too many missing values in total: 7vph-3 -<<< Sequence is too short: 7w6i-1 -<<< Too many missing values in total: 7wu3-1 -<<< Too many missing values in the middle: 7x9s-3 -<<< Too many missing values in the middle: 7xwj-1 -<<< Too many missing values in the middle: 7y9n-1 -<<< Too many missing values in the middle: 7ye7-2 -<<< Some chains in the PDB do not appear in the fasta file: 7zae-1 -<<< Too many missing values in total: 7zh4-1 -<<< Too many missing values in total: 7zv7-1 -<<< Too many missing values in the middle: 8aqa-1 -<<< Too many missing values in total: 8bfe-6 -<<< Too many missing values in total: 8b8w-1 -<<< Sequence is too short: 8d36-1 -<<< Unnatural amino acids found: 8ddq-1 -<<< Too many missing values in total: 8dki-1 -<<< Unnatural amino acids found: 8em8-1 -<<< Too many missing values in the middle: 7wlz-1 -<<< Too many missing values in total: 1hh3-2 -<<< Sequence is too short: 1h15-1 -<<< Sequence is too short: 1lgc-2 -<<< Sequence is too short: 1lwu-2 -<<< Sequence is too short: 2g5b-3 -<<< Sequence is too short: 2h43-1 -<<< Sequence is too short: 2zck-1 -<<< Sequence is too short: 3hdb-1 -<<< Sequence is too short: 3n95-8 -<<< Sequence is too short: 3v5a-1 -<<< Too many missing values in total: 4aa2-1 -<<< Too many missing values in the middle: 4gg8-1 -<<< Too many missing values in the middle: 4mwf-1 -<<< Sequence is too short: 4oga-1 -<<< Too many missing values in total: 4um8-1 -<<< Sequence is too short: 5djy-1 -<<< Too many missing values in the middle: 4z5w-1 -<<< Sequence is too short: 5j50-2 -<<< Too many missing values in the middle: 5esv-1 -<<< Too many missing values in the ends: 5w6r-1 -<<< Too many missing values in the middle: 6agf-1 -<<< Too many missing values in total: 5hce-1 -<<< Too many missing values in the ends: 6e7k-1 -<<< Too many missing values in the middle: 6hug-1 -<<< Too many missing values in the middle: 6j15-2 -<<< Too many missing values in the middle: 6l63-1 -<<< Too many missing values in the middle: 6mkz-1 -<<< Too many missing values in the middle: 6oel-1 -<<< Unknown: 6m8p-7 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in the middle: 6pm0-1 -<<< Too many missing values in the middle: 6rvd-1 -<<< Too many missing values in the middle: 6uym-1 -<<< Too many missing values in the middle: 6vkm-1 -<<< Too many missing values in the middle: 6y1z-1 -<<< Some chains in the PDB do not appear in the fasta file: 6zfa-1 -<<< Too many missing values in total: 7ad6-1 -<<< Some chains in the PDB do not appear in the fasta file: 6ytr-2 -<<< Too many missing values in the ends: 7cq6-1 -<<< Some chains in the PDB do not appear in the fasta file: 7b6u-2 -<<< Unknown: 7drb-2 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in the middle: 7kbu-1 -<<< Too many missing values in the middle: 7lkz-1 -<<< Too many missing values in the middle: 7mdu-1 -<<< Too many missing values in the ends: 7qzr-2 -<<< Too many missing values in the middle: 7sxz-1 -<<< Too many missing values in the middle: 7yhk-1 -<<< Sequence is too short: 1a6a-2 -<<< Too many missing values in total: 1ayb-1 -<<< Sequence is too short: 1awr-2 -<<< Sequence is too short: 1b17-2 -<<< Sequence is too short: 1bbr-3 -<<< Sequence is too short: 1bph-1 -<<< Too many missing values in the middle: 1com-1 -<<< Too many missing values in the ends: 7v7z-1 -<<< Sequence is too short: 1d4w-2 -<<< Sequence is too short: 1dph-2 -<<< Too many missing values in the middle: 1du3-2 -<<< Too many missing values in the middle: 1efn-1 -<<< Sequence is too short: 1ee4-1 -<<< Sequence is too short: 1etm-1 -<<< Too many missing values in the middle: 1f1o-1 -<<< Too many missing values in the middle: 1fl1-1 -<<< Sequence is too short: 1fpc-1 -<<< Sequence is too short: 1ffp-2 -<<< Sequence is too short: 1g39-4 -<<< Too many missing values in total: 1gi9-1 -<<< Sequence is too short: 1h24-1 -<<< Sequence is too short: 1hin-1 -<<< Too many missing values in the middle: 1huu-2 -<<< Sequence is too short: 1i1f-2 -<<< Too many missing values in total: 1iqn-1 -<<< Too many missing values in total: 1h8h-1 -<<< Too many missing values in the middle: 1jen-1 -<<< Too many missing values in the middle: 1jg3-1 -<<< Sequence is too short: 1jq8-1 -<<< Too many missing values in the middle: 1jr1-1 -<<< Too many missing values in total: 1kna-1 -<<< Too many missing values in the middle: 1lm8-1 -<<< Sequence is too short: 1mk9-2 -<<< Too many missing values in the middle: 1n0w-1 -<<< Too many missing values in the middle: 1ne2-1 -<<< Sequence is too short: 1nvs-1 -<<< Sequence is too short: 1nx1-1 -<<< Too many missing values in total: 1o6o-2 -<<< Sequence is too short: 1ogt-1 -<<< Sequence is too short: 1ou8-2 -<<< Sequence is too short: 1ox1-1 -<<< Sequence is too short: 1p9u-3 -<<< Too many missing values in the ends: 1q4q-3 -<<< Sequence is too short: 1qd6-3 -<<< Too many missing values in the middle: 1qow-1 -<<< Sequence is too short: 1r5v-3 -<<< Too many missing values in the ends: 1r17-1 -<<< Sequence is too short: 1rbg-2 -<<< Too many missing values in total: 1rrv-2 -<<< Sequence is too short: 1s7s-1 -<<< Too many missing values in the ends: 1sm3-1 -<<< Too many missing values in total: 1sza-2 -<<< Too many missing values in the ends: 1t2v-4 -<<< Unexpected atoms (DD21): 1tes-1 -<<< Too many missing values in the middle: 1tgl-1 -<<< Sequence is too short: 1tjh-1 -<<< Too many missing values in the middle: 1tu3-3 -<<< Too many missing values in total: 1tno-3 -<<< Too many missing values in the ends: 1u9g-1 -<<< Too many missing values in total: 1s3s-1 -<<< Sequence is too short: 1uhd-1 -<<< Sequence is too short: 1uj0-1 -<<< Too many missing values in the middle: 1uys-1 -<<< Sequence is too short: 1v1t-1 -<<< Sequence is too short: 1vc3-1 -<<< Too many missing values in total: 1w7r-2 -<<< Unnatural amino acids found: 1w5c-2 -<<< Too many missing values in the ends: 1wck-1 -<<< Too many missing values in the middle: 1x9r-1 -<<< Too many missing values in the middle: 1xas-1 -<<< Too many missing values in the ends: 1x7a-1 -<<< Sequence is too short: 1xda-12 -<<< Sequence is too short: 1yod-1 -<<< Sequence is too short: 1ypm-1 -<<< Sequence is too short: 1yn7-1 -<<< Too many missing values in the middle: 1zbd-1 -<<< Sequence is too short: 1zni-2 -<<< Too many missing values in the middle: 1zw0-2 -<<< Too many missing values in the middle: 1zxe-2 -<<< Sequence is too short: 2a4q-1 -<<< Sequence is too short: 2adv-1 -<<< Too many missing values in the middle: 1zq1-1 -<<< Too many missing values in the middle: 2b48-1 -<<< Too many missing values in the middle: 2bbh-2 -<<< Too many missing values in total: 2bd5-1 -<<< Sequence is too short: 2bdy-1 -<<< Too many missing values in the middle: 2c1n-2 -<<< Too many missing values in the middle: 2c9w-1 -<<< Too many missing values in the middle: 2d5h-2 -<<< Sequence is too short: 2cvy-1 -<<< Too many missing values in the middle: 2dza-1 -<<< Too many missing values in the middle: 2f0a-7 -<<< Too many missing values in the ends: 2fvv-1 -<<< Sequence is too short: 2fx8-2 -<<< Sequence is too short: 2gch-1 -<<< Unnatural amino acids found: 2gnx-1 -<<< Too many missing values in total: 2gl7-2 -<<< Sequence is too short: 2h1c-2 -<<< Too many missing values in the ends: 2h4w-1 -<<< Sequence is too short: 2h96-1 -<<< Too many missing values in the middle: 2hjg-1 -<<< Too many missing values in the middle: 2hql-2 -<<< Too many missing values in the middle: 2ihf-1 -<<< Sequence is too short: 2ins-5 -<<< Sequence is too short: 2j7i-1 -<<< Too many missing values in the middle: 2jb8-1 -<<< Sequence is too short: 2jds-1 -<<< Too many missing values in the middle: 2nye-1 -<<< Too many missing values in the middle: 2o1x-2 -<<< Too many missing values in the middle: 2ocy-1 -<<< Too many missing values in total: 2npp-1 -<<< Sequence is too short: 2os2-2 -<<< Sequence is too short: 2p6b-1 -<<< Sequence is too short: 2pm5-6 -<<< Too many missing values in the middle: 2pf4-3 -<<< Too many missing values in the middle: 2q7u-2 -<<< Sequence is too short: 2qa9-1 -<<< Sequence is too short: 2qbx-2 -<<< Too many missing values in total: 2uwo-1 -<<< Too many missing values in the middle: 2uy1-1 -<<< Too many missing values in the middle: 2vhf-2 -<<< Too many missing values in the middle: 2vo9-1 -<<< Too many missing values in the middle: 2vpe-1 -<<< Too many missing values in the middle: 2vso-2 -<<< Too many missing values in the middle: 2w6p-2 -<<< Too many missing values in total: 2way-1 -<<< Too many missing values in the ends: 2wpk-1 -<<< Sequence is too short: 2ws6-6 -<<< Too many missing values in the middle: 2wok-1 -<<< Too many missing values in total: 2x4n-1 -<<< Sequence is too short: 2y4v-1 -<<< Too many missing values in the middle: 2yqy-2 -<<< Sequence is too short: 2yvc-3 -<<< Too many missing values in the ends: 2z5s-1 -<<< Too many missing values in total: 2z3e-1 -<<< Too many missing values in the middle: 2zv2-1 -<<< Too many missing values in the middle: 3afq-1 -<<< Too many missing values in total: 3b71-1 -<<< Too many missing values in the middle: 3bku-1 -<<< Too many missing values in total: 3bzy-1 -<<< Sequence is too short: 3c9j-1 -<<< Too many missing values in the middle: 3cjq-2 -<<< Too many missing values in the middle: 3d8e-4 -<<< Sequence is too short: 3dt0-1 -<<< Too many missing values in the middle: 3dpo-1 -<<< Too many missing values in the middle: 3e1k-3 -<<< Sequence is too short: 3e8c-5 -<<< Too many missing values in total: 3egh-3 -<<< Too many missing values in the middle: 3eul-6 -<<< Too many missing values in the middle: 3f4z-1 -<<< Too many missing values in the middle: 3f87-2 -<<< Too many missing values in the middle: 3f9y-2 -<<< Too many missing values in the middle: 3fdx-1 -<<< Too many missing values in the middle: 3fna-1 -<<< Sequence is too short: 3fii-1 -<<< Sequence is too short: 3fqt-1 -<<< Sequence is too short: 3fwv-2 -<<< Too many missing values in total: 3g3b-4 -<<< Too many missing values in the ends: 3gj9-1 -<<< Too many missing values in the middle: 3h8v-1 -<<< Too many missing values in the middle: 3hfh-1 -<<< Too many missing values in the middle: 3hsm-1 -<<< Too many missing values in the middle: 3ier-1 -<<< Too many missing values in the middle: 3ilm-1 -<<< Too many missing values in the middle: 3kdf-1 -<<< Too many missing values in total: 3kqi-2 -<<< Unknown: 3kp5-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in the middle: 3khd-3 -<<< Too many missing values in the middle: 3l15-1 -<<< Sequence is too short: 3l3g-1 -<<< Too many missing values in the middle: 3l6v-2 -<<< Unknown: 3l8r-4 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3l9v-3 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3ld2-4 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lb0-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3le7-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lf9-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lhb-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lgb-2 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lc2-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3li9-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lit-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3ljy-3 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3llt-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lkq-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in the ends: 3lpr-1 -<<< Too many missing values in the middle: 3lt1-1 -<<< Too many missing values in the middle: 3m1g-2 -<<< Too many missing values in the middle: 3mcu-1 -<<< Too many missing values in the ends: 3mlt-1 -<<< Too many missing values in the ends: 3lww-2 -<<< Sequence is too short: 3mrr-1 -<<< Too many missing values in the middle: 3n2e-3 -<<< Sequence is too short: 3nco-4 -<<< Too many missing values in total: 3nfl-1 -<<< Sequence is too short: 3nji-1 -<<< Too many missing values in the middle: 3nkf-1 -<<< Too many missing values in the middle: 3nru-8 -<<< Too many missing values in total: 3o36-1 -<<< Sequence is too short: 3o17-2 -<<< Sequence is too short: 3obq-1 -<<< Too many missing values in the middle: 3oen-1 -<<< Too many missing values in the ends: 3oj3-3 -<<< Sequence is too short: 3omm-1 -<<< Too many missing values in the middle: 3os5-1 -<<< Too many missing values in total: 3ov1-1 -<<< Sequence is too short: 3ozj-1 -<<< Sequence is too short: 3ogl-7 -<<< Too many missing values in the middle: 3p35-2 -<<< Too many missing values in the ends: 3pcx-3 -<<< Sequence is too short: 3plz-1 -<<< Sequence is too short: 3pwl-2 -<<< Too many missing values in the middle: 3q9j-1 -<<< Sequence is too short: 3qjn-6 -<<< Sequence is too short: 3qg6-2 -<<< Sequence is too short: 3qxa-1 -<<< Sequence is too short: 3qzw-1 -<<< Too many missing values in the middle: 3r6o-1 -<<< Too many missing values in the middle: 3re0-2 -<<< Sequence is too short: 3r9i-1 -<<< Too many missing values in the middle: 3rz3-4 -<<< Too many missing values in the ends: 3r1r-9 -<<< Sequence is too short: 3rwf-1 -<<< Unnatural amino acids found: 3stj-2 -<<< Too many missing values in the middle: 3tdh-1 -<<< Sequence is too short: 3tbs-2 -<<< Too many missing values in the middle: 3t8a-1 -<<< Too many missing values in the middle: 3tig-1 -<<< Sequence is too short: 3tei-1 -<<< Sequence is too short: 3tjh-1 -<<< Too many missing values in the middle: 3tsw-3 -<<< Too many missing values in total: 3tpm-1 -<<< Too many missing values in the middle: 3tzn-1 -<<< Sequence is too short: 3u3f-2 -<<< Too many missing values in total: 3u1i-2 -<<< Too many missing values in the middle: 3ub2-1 -<<< Too many missing values in the ends: 3u97-1 -<<< Too many missing values in total: 3ul5-2 -<<< Too many missing values in the ends: 3uua-3 -<<< Sequence is too short: 3uvn-1 -<<< Sequence is too short: 3v3v-2 -<<< Too many missing values in the middle: 3v5n-1 -<<< Too many missing values in total: 3vb6-1 -<<< Sequence is too short: 3vfn-1 -<<< Too many missing values in the middle: 3vnn-1 -<<< Incorrect alignment: 3von-4 -<<< Sequence is too short: 3vrt-1 -<<< Too many missing values in the middle: 3vu4-2 -<<< Sequence is too short: 3vt8-1 -<<< Too many missing values in total: 3vx8-1 -<<< Too many missing values in total: 3wdc-1 -<<< Too many missing values in the middle: 3wso-1 -<<< Too many missing values in total: 3wgv-2 -<<< Sequence is too short: 3zip-1 -<<< Too many missing values in the middle: 4a2q-1 -<<< Sequence is too short: 3zrm-1 -<<< Too many missing values in the ends: 4ag2-1 -<<< Too many missing values in the middle: 4an7-1 -<<< Too many missing values in the middle: 4au7-1 -<<< Too many missing values in the middle: 4ay9-1 -<<< Sequence is too short: 4ax9-1 -<<< Too many missing values in the ends: 4b0e-3 -<<< Sequence is too short: 4bak-1 -<<< Too many missing values in the middle: 4bj5-2 -<<< Too many missing values in total: 4boh-1 -<<< Too many missing values in the ends: 4brr-2 -<<< Too many missing values in total: 4btt-1 -<<< Too many missing values in total: 4bwq-4 -<<< Too many missing values in the middle: 4by2-3 -<<< Unnatural amino acids found: 4cat-1 -<<< Too many missing values in the middle: 4cdz-1 -<<< Too many missing values in the middle: 4cfe-2 -<<< Sequence is too short: 4cim-1 -<<< Too many missing values in the middle: 4ckw-3 -<<< Sequence is too short: 4cxn-2 -<<< Too many missing values in total: 4d11-4 -<<< Too many missing values in the middle: 4da9-2 -<<< Unknown: 4dcb-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in the middle: 4dgs-1 -<<< Sequence is too short: 4dos-1 -<<< Sequence is too short: 4dqm-2 -<<< Sequence is too short: 4e05-1 -<<< Too many missing values in total: 4dx8-1 -<<< Too many missing values in the ends: 4e19-2 -<<< Sequence is too short: 4e2j-1 -<<< Too many missing values in the ends: 4ec6-3 -<<< Sequence is too short: 4edn-2 -<<< Too many missing values in the middle: 4etv-3 -<<< Sequence is too short: 4ezr-1 -<<< Too many missing values in total: 4fbw-3 -<<< Too many missing values in total: 4fgx-1 -<<< Sequence is too short: 4ftg-1 -<<< Too many missing values in total: 4fz3-1 -<<< Sequence is too short: 4g6a-2 -<<< Too many missing values in the middle: 4gfl-1 -<<< Too many missing values in the middle: 4go6-4 -<<< Too many missing values in the middle: 4gq1-1 -<<< Too many missing values in total: 4hs2-1 -<<< Sequence is too short: 4ht6-3 -<<< Sequence is too short: 4hw4-2 -<<< Sequence is too short: 4hwz-1 -<<< Sequence is too short: 4i32-1 -<<< Too many missing values in the middle: 4igk-2 -<<< Sequence is too short: 4ins-7 -<<< Too many missing values in the middle: 4iw4-2 -<<< Too many missing values in total: 4j1v-1 -<<< Sequence is too short: 4j9g-3 -<<< Sequence is too short: 4j84-1 -<<< Too many missing values in the ends: 4k38-2 -<<< Too many missing values in the middle: 4iij-1 -<<< Too many missing values in the middle: 4kb3-1 -<<< Too many missing values in the middle: 4kmo-1 -<<< Sequence is too short: 4ktu-1 -<<< Too many missing values in the middle: 4kzc-1 -<<< Sequence is too short: 4laj-4 -<<< Sequence is too short: 4lrs-2 -<<< Too many missing values in the middle: 4lop-1 -<<< Too many missing values in the middle: 4lzk-1 -<<< Too many missing values in the middle: 4m6h-1 -<<< Too many missing values in total: 4mbe-1 -<<< Sequence is too short: 4mny-2 -<<< Sequence is too short: 4n0c-1 -<<< Unexpected atoms (D): 4n3m-1 -<<< Too many missing values in the middle: 4n84-1 -<<< Too many missing values in total: 4n1a-1 -<<< Too many missing values in total: 4nft-4 -<<< Too many missing values in the middle: 4nim-3 -<<< Too many missing values in the middle: 4nj7-4 -<<< Sequence is too short: 4nmt-2 -<<< Sequence is too short: 4nsk-1 -<<< Too many missing values in total: 4p0b-2 -<<< Sequence is too short: 4p6j-1 -<<< Too many missing values in the ends: 4p3w-2 -<<< Too many missing values in the ends: 4pa7-2 -<<< Too many missing values in the middle: 4pdp-2 -<<< Too many missing values in the middle: 4pl7-2 -<<< Too many missing values in total: 4pk3-1 -<<< Too many missing values in the middle: 4po6-1 -<<< Sequence is too short: 4prb-1 -<<< Too many missing values in the middle: 4qbs-1 -<<< Too many missing values in the middle: 4qky-1 -<<< Too many missing values in total: 4qmf-2 -<<< Sequence is too short: 4pes-2 -<<< Too many missing values in the middle: 4r0j-1 -<<< Sequence is too short: 4qxb-1 -<<< Too many missing values in the middle: 4r3r-1 -<<< Too many missing values in total: 4roj-3 -<<< Too many missing values in total: 4rta-1 -<<< Too many missing values in total: 4ryd-2 -<<< Sequence is too short: 4twj-1 -<<< Too many missing values in the middle: 4u5a-3 -<<< Too many missing values in total: 4u7y-1 -<<< Too many missing values in the middle: 4up7-1 -<<< Too many missing values in the middle: 4v0m-3 -<<< Too many missing values in the middle: 4tv9-1 -<<< Sequence is too short: 4ux9-1 -<<< Too many missing values in the ends: 4w2o-3 -<<< Sequence is too short: 4w71-1 -<<< Unknown: 4v7n-16 -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert - for (chain,) in pdb_entry.get_chains(): -ValueError: too many values to unpack (expected 1) - -<<< Sequence is too short: 4w50-4 -<<< Unknown: 4v4c-10 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in the ends: 4wci-1 -<<< Too many missing values in total: 4uva-1 -<<< Sequence is too short: 4wb6-2 -<<< Too many missing values in the middle: 4x34-1 -<<< Too many missing values in total: 4wyb-10 -<<< Sequence is too short: 4wuu-1 -<<< Too many missing values in total: 4xup-5 -<<< Sequence is too short: 4xi9-1 -<<< Too many missing values in the middle: 4xpd-1 -<<< Sequence is too short: 4yo0-2 -<<< Too many missing values in the middle: 4zb7-1 -<<< Too many missing values in the middle: 4zhx-2 -<<< Too many missing values in the ends: 5aeo-1 -<<< Sequence is too short: 5ajo-1 -<<< Too many missing values in total: 5ah2-2 -<<< Too many missing values in the middle: 5bop-2 -<<< Sequence is too short: 5b4w-2 -<<< Too many missing values in the middle: 5c03-1 -<<< Too many missing values in the middle: 5c7e-2 -<<< Too many missing values in total: 5cxt-9 -<<< Too many missing values in the middle: 5d3x-2 -<<< Too many missing values in the ends: 5d57-2 -<<< Too many missing values in total: 5da7-2 -<<< Too many missing values in total: 5dmg-3 -<<< Too many missing values in the ends: 5dpw-2 -<<< Too many missing values in the middle: 5dxe-1 -<<< Too many missing values in total: 5et0-1 -<<< Sequence is too short: 5f2y-1 -<<< Sequence is too short: 5f67-2 -<<< Too many missing values in the middle: 5f7c-4 -<<< Too many missing values in total: 5ft1-3 -<<< Too many missing values in total: 5fvd-1 -<<< Too many missing values in the middle: 5g53-2 -<<< Too many missing values in the middle: 5gyd-1 -<<< Too many missing values in the middle: 5h5c-1 -<<< Sequence is too short: 5hhq-1 -<<< Sequence is too short: 5hoy-2 -<<< Sequence is too short: 5hyq-2 -<<< Too many missing values in total: 5h2v-1 -<<< Too many missing values in the ends: 5ic3-1 -<<< Too many missing values in total: 5i70-2 -<<< Sequence is too short: 5id0-2 -<<< Too many missing values in total: 5iq9-1 -<<< Sequence is too short: 5fq8-1 -<<< Too many missing values in total: 5iue-3 -<<< Too many missing values in total: 5jbm-1 -<<< Sequence is too short: 5jhc-11 -<<< Sequence is too short: 5jwe-3 -<<< Too many missing values in the middle: 5k1a-1 -<<< Too many missing values in the ends: 5jxh-1 -<<< Too many missing values in total: 5kc1-3 -<<< Too many missing values in the middle: 5keu-2 -<<< Sequence is too short: 5kra-2 -<<< Too many missing values in total: 5l6s-4 -<<< Too many missing values in total: 5lb7-1 -<<< Too many missing values in the middle: 5lsb-1 -<<< Sequence is too short: 5lw1-1 -<<< Sequence is too short: 5m5s-2 -<<< Too many missing values in the ends: 5me5-1 -<<< Sequence is too short: 5m75-1 -<<< Too many missing values in total: 5mk2-2 -<<< Too many missing values in the middle: 5mpi-1 -<<< Too many missing values in total: 5msu-2 -<<< Too many missing values in the middle: 5lov-1 -<<< Too many missing values in the middle: 5mvi-2 -<<< Too many missing values in the ends: 5mwy-2 -<<< Too many missing values in total: 5mu0-6 -<<< Too many missing values in total: 5mub-8 -<<< Too many missing values in total: 5n74-4 -<<< Too many missing values in the middle: 5n5r-1 -<<< Too many missing values in the middle: 5nud-2 -<<< Too many missing values in total: 5npw-3 -<<< Too many missing values in the middle: 5o3r-1 -<<< Sequence is too short: 5o9v-1 -<<< Too many missing values in the middle: 5oi5-1 -<<< Too many missing values in the middle: 5ojo-1 -<<< Too many missing values in total: 5oo6-7 -<<< Sequence is too short: 5q0m-1 -<<< Too many missing values in the ends: 5q1g-1 -<<< Too many missing values in total: 5oqr-1 -<<< Sequence is too short: 5qu2-1 -<<< Too many missing values in the middle: 5r4b-1 -<<< Sequence is too short: 5r1r-10 -<<< Too many missing values in the middle: 5s5z-1 -<<< Too many missing values in the middle: 5s4l-1 -<<< Too many missing values in the middle: 5sbc-1 -<<< Too many missing values in the middle: 5sus-1 -<<< Too many missing values in the middle: 5t28-1 -<<< Sequence is too short: 5t1m-1 -<<< Too many missing values in the middle: 5tgc-1 -<<< Sequence is too short: 5u98-1 -<<< Too many missing values in the middle: 5un6-2 -<<< Too many missing values in the middle: 5uq0-2 -<<< Too many missing values in the middle: 5uui-1 -<<< Sequence is too short: 5v5l-1 -<<< Sequence is too short: 5va9-2 -<<< Sequence is too short: 5vkl-1 -<<< Too many missing values in the middle: 5vvu-1 -<<< Too many missing values in the middle: 5vph-1 -<<< Sequence is too short: 5vuf-1 -<<< Too many missing values in the middle: 5w4h-1 -<<< Too many missing values in the middle: 5wer-4 -<<< Sequence is too short: 5wlj-1 -<<< Sequence is too short: 5wqd-1 -<<< Too many missing values in the middle: 5wuy-1 -<<< Too many missing values in the middle: 5wy5-1 -<<< Sequence is too short: 5wzx-2 -<<< Too many missing values in the middle: 5xeu-1 -<<< Sequence is too short: 5xoq-1 -<<< Too many missing values in the middle: 5xu6-2 -<<< Too many missing values in total: 5xwa-1 -<<< Too many missing values in the middle: 5y28-1 -<<< Sequence is too short: 5xzh-1 -<<< Sequence is too short: 5yd5-2 -<<< Too many missing values in the ends: 5yiq-1 -<<< Too many missing values in the middle: 5yj1-15 -<<< Too many missing values in the middle: 5z08-1 -<<< Too many missing values in total: 5zgc-3 -<<< Too many missing values in the middle: 5zia-5 -<<< Sequence is too short: 5zmz-1 -<<< Too many missing values in the middle: 6a2l-1 -<<< Too many missing values in the middle: 6ae1-1 -<<< Sequence is too short: 6au5-2 -<<< Sequence is too short: 6azk-1 -<<< Too many missing values in the middle: 6b4c-2 -<<< Too many missing values in total: 6bqt-2 -<<< Too many missing values in the middle: 6c08-2 -<<< Too many missing values in the middle: 6brp-1 -<<< Too many missing values in the middle: 6c4u-4 -<<< Too many missing values in total: 6c1q-1 -<<< Sequence is too short: 6cbi-2 -<<< Sequence is too short: 6cqq-1 -<<< Too many missing values in the middle: 6cxo-3 -<<< Too many missing values in the middle: 6d4g-2 -<<< Too many missing values in the middle: 6dft-1 -<<< Too many missing values in the middle: 6dr6-1 -<<< Sequence is too short: 6e3g-2 -<<< Too many missing values in total: 6ecf-6 -<<< Too many missing values in the middle: 6d88-1 -<<< Too many missing values in the middle: 6ejl-1 -<<< Sequence is too short: 6e4d-1 -<<< Sequence is too short: 6eqb-1 -<<< Too many missing values in the middle: 6ffk-2 -<<< Too many missing values in total: 6g07-4 -<<< Too many missing values in total: 6fy2-2 -<<< Sequence is too short: 6g6f-1 -<<< Unknown: 6g5k-2 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in the middle: 6g8r-1 -<<< Too many missing values in the middle: 6gek-2 -<<< Sequence is too short: 6gh1-2 -<<< Too many missing values in total: 6h06-4 -<<< Sequence is too short: 6hby-2 -<<< Too many missing values in the middle: 6hm8-1 -<<< Some chains in the PDB do not appear in the fasta file: 6i47-1 -<<< Too many missing values in the middle: 6hzk-1 -<<< Too many missing values in the middle: 6i8b-1 -<<< Sequence is too short: 6iwg-1 -<<< Too many missing values in the middle: 6j7f-1 -<<< Sequence is too short: 6j2f-1 -<<< Too many missing values in total: 6jzc-1 -<<< Too many missing values in the middle: 6k6w-1 -<<< Too many missing values in the middle: 6k9g-1 -<<< Too many missing values in the middle: 6kmt-3 -<<< Sequence is too short: 6knw-1 -<<< Too many missing values in the middle: 6l7v-1 -<<< Too many missing values in total: 6ldw-1 -<<< Too many missing values in total: 6ltn-1 -<<< Too many missing values in the middle: 6m1v-1 -<<< Too many missing values in the middle: 6m33-1 -<<< Sequence is too short: 6mbl-1 -<<< Too many missing values in total: 6mak-1 -<<< Too many missing values in the ends: 6mjb-1 -<<< Too many missing values in the middle: 6mnm-1 -<<< Sequence is too short: 6mpn-3 -<<< Too many missing values in the ends: 6n2b-1 -<<< Sequence is too short: 6nca-14 -<<< Sequence is too short: 6nv1-2 -<<< Unnatural amino acids found: 6o2p-1 -<<< Too many missing values in total: 6o3x-3 -<<< Too many missing values in the ends: 6oau-2 -<<< Sequence is too short: 6oqy-1 -<<< Sequence is too short: 6oyy-2 -<<< Sequence is too short: 6pho-1 -<<< Too many missing values in the ends: 6psd-6 -<<< Too many missing values in the middle: 6pw8-1 -<<< Too many missing values in total: 6qsz-5 -<<< Too many missing values in total: 6r3v-1 -<<< Sequence is too short: 6r51-2 -<<< Too many missing values in the middle: 6rix-2 -<<< Too many missing values in the middle: 6rn5-1 -<<< Sequence is too short: 6rot-1 -<<< Too many missing values in the middle: 6qpg-1 -<<< Too many missing values in total: 6rtb-1 -<<< Sequence is too short: 6rxm-6 -<<< Too many missing values in the ends: 6sb4-1 -<<< Unnatural amino acids found: 6sdv-1 -<<< Some chains in the PDB do not appear in the fasta file: 6sqv-2 -<<< Too many missing values in total: 6sst-1 -<<< Some chains in the PDB do not appear in the fasta file: 6sla-2 -<<< Some chains in the PDB do not appear in the fasta file: 6t2n-2 -<<< Some chains in the PDB do not appear in the fasta file: 6t9r-1 -<<< Some chains in the PDB do not appear in the fasta file: 6tkr-1 -<<< Sequence is too short: 6tq0-7 -<<< Too many missing values in the middle: 6u04-1 -<<< Too many missing values in the ends: 6u39-4 -<<< Sequence is too short: 6u8i-1 -<<< Too many missing values in the middle: 6v98-1 -<<< Sequence is too short: 6vbx-1 -<<< Too many missing values in the middle: 6vjo-1 -<<< Too many missing values in total: 6vil-7 -<<< Incorrect alignment: 6vmk-1 -<<< Unknown: 6wat-6 -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert - for (chain,) in pdb_entry.get_chains(): -ValueError: too many values to unpack (expected 1) - -<<< Too many missing values in the middle: 6wcb-1 -<<< Sequence is too short: 6wfz-2 -<<< Sequence is too short: 6wi4-2 -<<< Too many missing values in total: 6wme-1 -<<< Too many missing values in the middle: 6wsk-1 -<<< Too many missing values in the middle: 6wnx-3 -<<< Incorrect alignment: 6x0a-4 -<<< Too many missing values in total: 6x1s-2 -<<< Too many missing values in the middle: 6x90-1 -<<< Too many missing values in the middle: 6xog-1 -<<< Too many missing values in total: 6xxr-2 -<<< Too many missing values in total: 6wxh-1 -<<< Too many missing values in total: 6y73-3 -<<< Some chains in the PDB do not appear in the fasta file: 6yab-3 -<<< Some chains in the PDB do not appear in the fasta file: 6y4a-1 -<<< Too many missing values in total: 6yih-1 -<<< Too many missing values in total: 6yn1-3 -<<< Sequence is too short: 6yx2-1 -<<< Some chains in the PDB do not appear in the fasta file: 6z3o-2 -<<< Sequence is too short: 6zfm-1 -<<< Some chains in the PDB do not appear in the fasta file: 6zi1-1 -<<< Too many missing values in the middle: 6zmm-1 -<<< Some chains in the PDB do not appear in the fasta file: 6ziv-6 -<<< Sequence is too short: 6zv8-1 -<<< Some chains in the PDB do not appear in the fasta file: 6zrz-1 -<<< Sequence is too short: 7a2x-1 -<<< Too many missing values in total: 7acv-1 -<<< Some chains in the PDB do not appear in the fasta file: 7aly-1 -<<< Too many missing values in total: 7ahh-1 -<<< Too many missing values in the middle: 7aue-1 -<<< Too many missing values in total: 7b5o-1 -<<< Too many missing values in the middle: 7b15-1 -<<< Some chains in the PDB do not appear in the fasta file: 7b74-1 -<<< Too many missing values in total: 7azf-2 -<<< Some chains in the PDB do not appear in the fasta file: 7beb-1 -<<< Too many missing values in the middle: 7bii-1 -<<< Too many missing values in total: 7bcy-2 -<<< Too many missing values in total: 7bqz-3 -<<< Too many missing values in the middle: 7cmu-1 -<<< Sequence is too short: 7co2-1 -<<< Too many missing values in total: 7b2m-1 -<<< Too many missing values in the middle: 7d4y-1 -<<< Too many missing values in total: 7d6r-1 -<<< Too many missing values in the middle: 7dmx-2 -<<< Too many missing values in the ends: 7duv-1 -<<< Too many missing values in the middle: 7dvs-2 -<<< Too many missing values in total: 7e0f-1 -<<< Too many missing values in the middle: 7ce6-1 -<<< Too many missing values in the middle: 7eg0-1 -<<< Too many missing values in the middle: 7el4-1 -<<< Sequence is too short: 7edo-2 -<<< Too many missing values in total: 7e6j-1 -<<< Too many missing values in total: 7f1o-1 -<<< Sequence is too short: 7esi-1 -<<< Sequence is too short: 7f7g-1 -<<< Too many missing values in the ends: 7fcp-1 -<<< Unknown: 7f8i-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in the ends: 7k7r-2 -<<< Too many missing values in the middle: 7kgv-1 -<<< Too many missing values in the middle: 7l7k-1 -<<< Sequence is too short: 7lfc-1 -<<< Too many missing values in the middle: 7mbx-1 -<<< Too many missing values in the middle: 7mvz-1 -<<< Too many missing values in total: 7n27-3 -<<< Too many missing values in total: 7n5d-1 -<<< Some chains in the PDB do not appear in the fasta file: 7n3m-1 -<<< Too many missing values in total: 7nfw-1 -<<< Too many missing values in the middle: 7ni7-1 -<<< Some chains in the PDB do not appear in the fasta file: 7nmc-1 -<<< Some chains in the PDB do not appear in the fasta file: 7nkt-1 -<<< Some chains in the PDB do not appear in the fasta file: 7nvp-1 -<<< Some chains in the PDB do not appear in the fasta file: 7nzb-2 -<<< Too many missing values in the middle: 7o0l-1 -<<< Some chains in the PDB do not appear in the fasta file: 7od0-6 -<<< Too many missing values in total: 7opw-1 -<<< Too many missing values in total: 7ors-1 -<<< Some chains in the PDB do not appear in the fasta file: 7ozb-1 -<<< Some chains in the PDB do not appear in the fasta file: 7p1y-1 -<<< Sequence is too short: 7oxn-1 -<<< Some chains in the PDB do not appear in the fasta file: 7pj3-1 -<<< Some chains in the PDB do not appear in the fasta file: 7plr-1 -<<< Too many missing values in the middle: 7pe8-1 -<<< Sequence is too short: 7pns-1 -<<< Some chains in the PDB do not appear in the fasta file: 7pwx-2 -<<< Sequence is too short: 7q1s-7 -<<< Sequence is too short: 7q50-1 -<<< Unknown: 7q8k-1 -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert - for (chain,) in pdb_entry.get_chains(): -ValueError: too many values to unpack (expected 1) - -<<< Too many missing values in the ends: 7qb9-1 -<<< Unknown: 7q9h-2 -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert - for (chain,) in pdb_entry.get_chains(): -ValueError: too many values to unpack (expected 1) - -<<< Some chains in the PDB do not appear in the fasta file: 7qel-1 -<<< Too many missing values in the middle: 7rga-1 -<<< Sequence is too short: 7r1v-1 -<<< Sequence is too short: 7rnb-1 -<<< Too many missing values in total: 7rm0-1 -<<< Sequence is too short: 7s4g-4 -<<< Too many missing values in the middle: 7ryn-1 -<<< Sequence is too short: 7s8r-2 -<<< Too many missing values in total: 7sy2-1 -<<< Too many missing values in the middle: 7st3-7 -<<< Too many missing values in the middle: 7t1i-1 -<<< Unknown: 7t8v-2 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Incorrect alignment: 7tl7-2 -<<< Sequence is too short: 7tt8-1 -<<< Too many missing values in the middle: 7u5b-2 -<<< Too many missing values in total: 7t30-1 -<<< Unnatural amino acids found: 7uym-1 -<<< Too many missing values in total: 7v0t-1 -<<< Too many missing values in the middle: 7vvm-1 -<<< Too many missing values in the middle: 7vph-4 -<<< Too many missing values in the ends: 7w08-1 -<<< Sequence is too short: 7w6j-1 -<<< Too many missing values in total: 7wm0-1 -<<< Too many missing values in total: 7wu4-1 -<<< Too many missing values in the middle: 7xmr-1 -<<< Too many missing values in total: 7xp4-1 -<<< Too many missing values in the middle: 7xwj-2 -<<< Too many missing values in the middle: 7ye8-1 -<<< Too many missing values in the middle: 8a2d-1 -<<< Sequence is too short: 7zpy-1 -<<< Too many missing values in the ends: 7zv8-1 -<<< Too many missing values in total: 8aex-1 -<<< Too many missing values in the middle: 8aqb-1 -<<< Too many missing values in the middle: 8bfe-7 -<<< Too many missing values in total: 8b8w-2 -<<< Unnatural amino acids found: 8ddr-1 -<<< Too many missing values in total: 8dpf-1 -<<< Sequence is too short: 8gch-1 -<<< Sequence is too short: 8gvg-1 -<<< Too many missing values in the middle: 1gmn-1 -<<< Too many missing values in total: 1hha-1 -<<< Sequence is too short: 1h15-2 -<<< Too many missing values in the ends: 1iau-1 -<<< Too many missing values in the middle: 1k9i-1 -<<< Too many missing values in total: 1r9n-1 -<<< Too many missing values in total: 2b5i-1 -<<< Sequence is too short: 2g5b-4 -<<< Sequence is too short: 2h43-2 -<<< Too many missing values in the middle: 3cu7-2 -<<< Sequence is too short: 3n95-9 -<<< Unknown: 3l4u-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in the middle: 4bqc-2 -<<< Too many missing values in the middle: 4gg8-2 -<<< Too many missing values in the middle: 4mwf-2 -<<< Too many missing values in the middle: 4pir-1 -<<< Too many missing values in the middle: 4v3d-1 -<<< Too many missing values in total: 4um8-2 -<<< Too many missing values in the middle: 4z5w-2 -<<< Too many missing values in total: 5djz-1 -<<< Sequence is too short: 5ab0-1 -<<< Sequence is too short: 5j51-1 -<<< Too many missing values in the middle: 5l1x-1 -<<< Too many missing values in the middle: 5hyx-1 -<<< Too many missing values in the middle: 5uph-1 -<<< Too many missing values in the middle: 5xea-1 -<<< Too many missing values in the ends: 5w6r-2 -<<< Too many missing values in total: 6cxg-1 -<<< Too many missing values in the ends: 6e7k-2 -<<< Too many missing values in the middle: 6huj-1 -<<< Too many missing values in the middle: 6j34-1 -<<< Too many missing values in the middle: 6l63-2 -<<< Too many missing values in the middle: 6oeu-1 -<<< Too many missing values in the middle: 6pm1-1 -<<< Unknown: 6m8p-8 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in the middle: 6uym-2 -<<< Some chains in the PDB do not appear in the fasta file: 6yut-1 -<<< Some chains in the PDB do not appear in the fasta file: 6zfn-1 -<<< Too many missing values in total: 7ad7-1 -<<< Some chains in the PDB do not appear in the fasta file: 7b6v-1 -<<< Too many missing values in the middle: 7kc4-1 -<<< Too many missing values in the middle: 7laa-1 -<<< Too many missing values in the middle: 7my2-1 -<<< Too many missing values in the middle: 7r14-1 -<<< Too many missing values in the middle: 7sy1-1 -<<< Too many missing values in the middle: 8dlm-1 -<<< Sequence is too short: 1a3r-1 -<<< Sequence is too short: 1avf-1 -<<< Sequence is too short: 1awr-3 -<<< Too many missing values in total: 1ayc-1 -<<< Sequence is too short: 1b17-3 -<<< Sequence is too short: 1bbr-4 -<<< Incorrect alignment: 1bj4-1 -<<< Sequence is too short: 1bph-2 -<<< Sequence is too short: 1bw8-1 -<<< Too many missing values in the middle: 1bzh-1 -<<< Sequence is too short: 1c9l-1 -<<< Too many missing values in the middle: 1com-2 -<<< Too many missing values in total: 1czi-1 -<<< Unnatural amino acids found: 1deq-1 -<<< Sequence is too short: 1dph-3 -<<< Too many missing values in the ends: 7v81-1 -<<< Sequence is too short: 1ejh-1 -<<< Sequence is too short: 1ee4-2 -<<< Sequence is too short: 1etn-1 -<<< Too many missing values in the middle: 1ex4-1 -<<< Too many missing values in total: 1ffs-1 -<<< Too many missing values in the middle: 1fl1-2 -<<< Sequence is too short: 1h8i-1 -<<< Too many missing values in the middle: 1hio-1 -<<< Sequence is too short: 1hh6-1 -<<< Too many missing values in the middle: 1huu-3 -<<< Sequence is too short: 1hy2-1 -<<< Too many missing values in the ends: 1isq-1 -<<< Too many missing values in the middle: 1jen-2 -<<< Too many missing values in the middle: 1jg3-2 -<<< Too many missing values in the middle: 1jr1-2 -<<< Sequence is too short: 1mk9-3 -<<< Too many missing values in the middle: 1mul-1 -<<< Sequence is too short: 1n0x-1 -<<< Too many missing values in the middle: 1ofp-1 -<<< Sequence is too short: 1o5g-1 -<<< Sequence is too short: 1oj5-1 -<<< Too many missing values in total: 1o6o-3 -<<< Too many missing values in the ends: 1p8d-1 -<<< Sequence is too short: 1pfg-1 -<<< Sequence is too short: 1pzl-1 -<<< Too many missing values in total: 1q4q-4 -<<< Sequence is too short: 1q94-1 -<<< Too many missing values in the ends: 1r17-2 -<<< Sequence is too short: 1rbh-1 -<<< Sequence is too short: 1r5w-1 -<<< Sequence is too short: 1rxm-1 -<<< Too many missing values in total: 1s4v-1 -<<< Sequence is too short: 1s7t-1 -<<< Too many missing values in total: 1sps-1 -<<< Sequence is too short: 1t2v-5 -<<< Sequence is too short: 1t5z-1 -<<< Sequence is too short: 1ta6-1 -<<< Sequence is too short: 1tet-1 -<<< Too many missing values in the middle: 1tol-1 -<<< Sequence is too short: 1tji-1 -<<< Too many missing values in total: 1tno-4 -<<< Too many missing values in the ends: 1u9g-2 -<<< Sequence is too short: 1uhe-1 -<<< Sequence is too short: 1uef-1 -<<< Sequence is too short: 1uny-1 -<<< Too many missing values in the middle: 1uys-2 -<<< Sequence is too short: 1vc3-2 -<<< Too many missing values in total: 1vr9-1 -<<< Too many missing values in total: 1w7r-3 -<<< Too many missing values in total: 1w6i-1 -<<< Too many missing values in the ends: 1x7a-2 -<<< Sequence is too short: 1xda-2 -<<< Too many missing values in the middle: 1xp4-2 -<<< Too many missing values in the middle: 1y14-1 -<<< Too many missing values in the middle: 1zbd-2 -<<< Sequence is too short: 1zmk-1 -<<< Sequence is too short: 1zni-5 -<<< Too many missing values in the middle: 1zw0-3 -<<< Too many missing values in the middle: 1zxe-3 -<<< Sequence is too short: 2a4r-1 -<<< Sequence is too short: 2ag3-1 -<<< Too many missing values in total: 2ahk-1 -<<< Too many missing values in total: 2bd7-1 -<<< Unknown: 2c2o-1 -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1334, in get_coordinates_array - chain_crd[informative_mask]["unique_residue_number"].astype(int), - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/generic.py", line 6324, in astype - new_data = self._mgr.astype(dtype=dtype, copy=copy, errors=errors) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/internals/managers.py", line 451, in astype - return self.apply( - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/internals/managers.py", line 352, in apply - applied = getattr(b, f)(**kwargs) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/internals/blocks.py", line 511, in astype - new_values = astype_array_safe(values, dtype, copy=copy, errors=errors) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/dtypes/astype.py", line 242, in astype_array_safe - new_values = astype_array(values, dtype, copy=copy) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/dtypes/astype.py", line 187, in astype_array - values = _astype_nansafe(values, dtype, copy=copy) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/dtypes/astype.py", line 138, in _astype_nansafe - return arr.astype(dtype, copy=True) -ValueError: invalid literal for int() with base 10: '277_' - -<<< Sequence is too short: 2clv-1 -<<< Sequence is too short: 2fx8-3 -<<< Sequence is too short: 2gch-2 -<<< Too many missing values in the middle: 2gl8-1 -<<< Too many missing values in the middle: 2h3r-1 -<<< Sequence is too short: 2gt9-1 -<<< Too many missing values in the middle: 2hak-8 -<<< Sequence is too short: 2h96-2 -<<< Too many missing values in the middle: 2hwy-1 -<<< Too many missing values in the middle: 2i46-1 -<<< Too many missing values in the middle: 2ieq-1 -<<< Too many missing values in total: 2j5l-1 -<<< Sequence is too short: 2j7i-2 -<<< Too many missing values in total: 2jf1-1 -<<< Sequence is too short: 2jdt-1 -<<< Too many missing values in the middle: 2nye-3 -<<< Too many missing values in the middle: 2ocy-2 -<<< Too many missing values in total: 2npp-2 -<<< Too many missing values in the middle: 2op0-1 -<<< Too many missing values in the ends: 2p32-1 -<<< Too many missing values in the middle: 2p22-4 -<<< Too many missing values in the middle: 2pf4-4 -<<< Too many missing values in total: 2pxj-1 -<<< Sequence is too short: 2qa9-2 -<<< Sequence is too short: 2qbx-3 -<<< Too many missing values in the middle: 2qob-1 -<<< Sequence is too short: 2qpy-1 -<<< Too many missing values in total: 2uwp-1 -<<< Sequence is too short: 2vay-1 -<<< Too many missing values in the middle: 2vfj-2 -<<< Too many missing values in the middle: 2vo9-2 -<<< Sequence is too short: 2vpe-2 -<<< Too many missing values in the ends: 2way-2 -<<< Too many missing values in the ends: 2wpl-1 -<<< Too many missing values in the ends: 2x6m-1 -<<< Too many missing values in total: 2x4n-2 -<<< Too many missing values in the middle: 2xc0-1 -<<< Too many missing values in total: 2xi1-1 -<<< Too many missing values in the middle: 2yqy-3 -<<< Too many missing values in the ends: 2z5s-2 -<<< Sequence is too short: 2z4j-1 -<<< Too many missing values in total: 2z3e-2 -<<< Sequence is too short: 2zg0-1 -<<< Sequence is too short: 2zl9-1 -<<< Too many missing values in the middle: 2zxf-1 -<<< Too many missing values in total: 3a2h-3 -<<< Sequence is too short: 3afr-1 -<<< Too many missing values in total: 3b71-2 -<<< Too many missing values in the middle: 3bd1-1 -<<< Too many missing values in the middle: 3bku-2 -<<< Too many missing values in the middle: 3bqu-1 -<<< Too many missing values in total: 3bzy-2 -<<< Sequence is too short: 3cay-1 -<<< Too many missing values in the middle: 3cjq-3 -<<< Sequence is too short: 3cvn-1 -<<< Too many missing values in the middle: 3d8f-1 -<<< Too many missing values in the middle: 3db3-1 -<<< Too many missing values in the middle: 3dpo-2 -<<< Too many missing values in the middle: 3ddr-1 -<<< Too many missing values in the middle: 3dy7-1 -<<< Too many missing values in the middle: 3e1k-4 -<<< Sequence is too short: 3e8c-6 -<<< Too many missing values in the middle: 3f50-1 -<<< Sequence is too short: 3f9z-1 -<<< Too many missing values in the middle: 3fdx-2 -<<< Too many missing values in the middle: 3fqu-1 -<<< Unnatural amino acids found: 3gd3-5 -<<< Sequence is too short: 3g9e-1 -<<< Sequence is too short: 3gic-1 -<<< Too many missing values in the ends: 3gj9-2 -<<< Too many missing values in total: 3h3p-1 -<<< Too many missing values in the middle: 3h6x-1 -<<< Too many missing values in the middle: 3hfh-2 -<<< Too many missing values in the middle: 3hsm-2 -<<< Too many missing values in the middle: 3ihr-1 -<<< Too many missing values in the middle: 3ilm-2 -<<< Too many missing values in the middle: 3ioy-1 -<<< Too many missing values in the middle: 3iam-1 -<<< Too many missing values in the middle: 3kdf-2 -<<< Unexpected atoms (D1): 3kcj-1 -<<< Too many missing values in total: 3kee-1 -<<< Unknown: 3kog-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3kp6-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in the middle: 3l15-2 -<<< Too many missing values in the middle: 3k9b-1 -<<< Unknown: 3l27-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in total: 3kv4-1 -<<< Too many missing values in the middle: 3kyc-1 -<<< Sequence is too short: 3l3h-1 -<<< Unknown: 3l9v-4 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3l8s-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lb1-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lc3-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3le7-2 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lgc-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lfa-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lhb-2 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3liu-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Sequence is too short: 3l6x-1 -<<< Unknown: 3li9-2 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3ljz-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3ld3-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 3lkr-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Sequence is too short: 3lox-1 -<<< Too many missing values in the middle: 3lt2-1 -<<< Unknown: 3llu-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in total: 3mat-1 -<<< Unnatural amino acids found: 3mn9-1 -<<< Too many missing values in the ends: 3mlt-2 -<<< Too many missing values in the middle: 3n6y-1 -<<< Too many missing values in total: 3nfl-2 -<<< Too many missing values in the middle: 3ml1-1 -<<< Sequence is too short: 3njj-2 -<<< Too many missing values in the middle: 3nkf-2 -<<< Sequence is too short: 3o2h-1 -<<< Sequence is too short: 3o17-3 -<<< Too many missing values in total: 3o71-1 -<<< Too many missing values in the middle: 3oeo-1 -<<< Too many missing values in the ends: 3oj3-4 -<<< Sequence is too short: 3okh-1 -<<< Sequence is too short: 3omm-2 -<<< Sequence is too short: 3ou3-1 -<<< Too many missing values in total: 3ov1-2 -<<< Too many missing values in the middle: 3p0h-2 -<<< Sequence is too short: 3ogl-8 -<<< Sequence is too short: 3p8n-1 -<<< Too many missing values in the middle: 3p9g-1 -<<< Too many missing values in total: 3pgz-1 -<<< Sequence is too short: 3plz-2 -<<< Too many missing values in the middle: 3q9j-2 -<<< Sequence is too short: 3qjn-7 -<<< Too many missing values in total: 3qhe-1 -<<< Sequence is too short: 3qtv-1 -<<< Sequence is too short: 3qxa-2 -<<< Sequence is too short: 3qzw-2 -<<< Too many missing values in the middle: 3rd4-1 -<<< Too many missing values in the ends: 3r9i-2 -<<< Too many missing values in the middle: 3rpg-3 -<<< Sequence is too short: 3rqf-3 -<<< Sequence is too short: 3rwg-1 -<<< Sequence is too short: 3si3-1 -<<< Unnatural amino acids found: 3stj-3 -<<< Too many missing values in the middle: 3sy3-1 -<<< Too many missing values in the middle: 3t8b-1 -<<< Sequence is too short: 3tbt-1 -<<< Too many missing values in the middle: 3tii-1 -<<< Too many missing values in total: 3tdi-1 -<<< Too many missing values in the ends: 3tnp-1 -<<< Sequence is too short: 3tkn-1 -<<< Too many missing values in total: 3tsw-4 -<<< Too many missing values in total: 3u1j-1 -<<< Sequence is too short: 3u3f-3 -<<< Sequence is too short: 3u98-1 -<<< Too many missing values in the middle: 3ub3-1 -<<< Too many missing values in the middle: 3ujz-1 -<<< Too many missing values in total: 3ul6-1 -<<< Sequence is too short: 3uvn-2 -<<< Too many missing values in the middle: 3v6o-1 -<<< Too many missing values in the middle: 3v9r-1 -<<< Too many missing values in the ends: 3vb7-1 -<<< Sequence is too short: 3vfo-1 -<<< Sequence is too short: 3vi1-1 -<<< Sequence is too short: 3vru-1 -<<< Too many missing values in the middle: 3vu4-3 -<<< Too many missing values in total: 3vx8-2 -<<< Too many missing values in total: 3wdd-1 -<<< Too many missing values in the middle: 3wyf-1 -<<< Too many missing values in total: 3ziq-1 -<<< Too many missing values in the middle: 4a2q-2 -<<< Sequence is too short: 4aen-1 -<<< Too many missing values in the ends: 4ag2-2 -<<< Unnatural amino acids found: 4aze-1 -<<< Too many missing values in the middle: 4ay9-2 -<<< Sequence is too short: 4axa-1 -<<< Too many missing values in the middle: 4b86-1 -<<< Too many missing values in the middle: 4bj6-1 -<<< Sequence is too short: 4boh-2 -<<< Too many missing values in total: 4btt-2 -<<< Too many missing values in the middle: 4cbt-3 -<<< Too many missing values in the middle: 4ce0-1 -<<< Too many missing values in total: 4cfg-1 -<<< Sequence is too short: 4cim-2 -<<< Too many missing values in the middle: 4ckw-4 -<<< Too many missing values in the middle: 4cz2-1 -<<< Sequence is too short: 4d2l-1 -<<< Too many missing values in the middle: 4da9-3 -<<< Too many missing values in total: 4d4o-1 -<<< Sequence is too short: 4dos-2 -<<< Too many missing values in the middle: 4dx8-2 -<<< Sequence is too short: 4e06-1 -<<< Sequence is too short: 4e2j-2 -<<< Too many missing values in the ends: 4ec6-4 -<<< Too many missing values in total: 4edn-3 -<<< Too many missing values in the middle: 4em0-1 -<<< Sequence is too short: 4eqf-1 -<<< Sequence is too short: 4ezr-2 -<<< Too many missing values in total: 4fgx-2 -<<< Too many missing values in the middle: 4fxu-1 -<<< Too many missing values in total: 4gln-1 -<<< Too many missing values in the middle: 4go7-1 -<<< Sequence is too short: 4ht6-4 -<<< Sequence is too short: 4hs3-1 -<<< Too many missing values in the middle: 4hvh-1 -<<< Sequence is too short: 4i32-2 -<<< Sequence is too short: 4iw6-1 -<<< Too many missing values in total: 4j40-1 -<<< Too many missing values in total: 4j1v-2 -<<< Too many missing values in total: 4imy-1 -<<< Sequence is too short: 4j9h-1 -<<< Sequence is too short: 4j84-2 -<<< Too many missing values in the middle: 4jdx-3 -<<< Sequence is too short: 4jbn-1 -<<< Too many missing values in total: 4jmg-1 -<<< Sequence is too short: 4js0-1 -<<< Sequence is too short: 4jzz-1 -<<< Too many missing values in total: 4k39-1 -<<< Too many missing values in the middle: 4kg8-1 -<<< Too many missing values in total: 4kv4-1 -<<< Too many missing values in the middle: 4kya-1 -<<< Too many missing values in the middle: 4lop-2 -<<< Too many missing values in the middle: 4m6h-2 -<<< Too many missing values in total: 4mbe-2 -<<< Sequence is too short: 4mgp-1 -<<< Sequence is too short: 4n0c-2 -<<< Too many missing values in the middle: 4n77-1 -<<< Unexpected atoms (D): 4n9v-1 -<<< Too many missing values in total: 4n1a-2 -<<< Sequence is too short: 4nin-1 -<<< Too many missing values in the middle: 4nks-1 -<<< Unexpected atoms (DA): 4ny6-1 -<<< Too many missing values in the ends: 4ol4-1 -<<< Sequence is too short: 4onf-1 -<<< Sequence is too short: 4p6k-1 -<<< Unnatural amino acids found: 4p1w-1 -<<< Too many missing values in the ends: 4p3w-3 -<<< Too many missing values in the middle: 4p7s-1 -<<< Sequence is too short: 4pg2-1 -<<< Too many missing values in the middle: 4pnh-1 -<<< Too many missing values in total: 4pl8-1 -<<< Too many missing values in the middle: 4psi-1 -<<< Sequence is too short: 4prd-1 -<<< Sequence is too short: 4q6s-1 -<<< Too many missing values in the middle: 4qnq-1 -<<< Too many missing values in total: 4qmg-1 -<<< Too many missing values in the middle: 4r0j-2 -<<< Sequence is too short: 4r3s-1 -<<< Too many missing values in total: 4qxb-2 -<<< Too many missing values in the ends: 4rxh-1 -<<< Too many missing values in total: 4ryd-3 -<<< Sequence is too short: 4tzl-1 -<<< Too many missing values in the ends: 4ug3-2 -<<< Too many missing values in the middle: 4v0m-4 -<<< Too many missing values in the ends: 4ux9-2 -<<< Too many missing values in the ends: 4w2o-4 -<<< Unknown: 4v7n-17 -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert - for (chain,) in pdb_entry.get_chains(): -ValueError: too many values to unpack (expected 1) - -<<< Unknown: 4v4c-11 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in the ends: 4wci-2 -<<< Too many missing values in the middle: 4w9l-4 -<<< Too many missing values in total: 4uvb-1 -<<< Sequence is too short: 4wb7-1 -<<< Too many missing values in the middle: 4x34-2 -<<< Too many missing values in total: 4wyb-11 -<<< Sequence is too short: 4xaw-1 -<<< Too many missing values in the middle: 4y4s-1 -<<< Sequence is too short: 4xi9-2 -<<< Too many missing values in the middle: 4yo1-1 -<<< Too many missing values in total: 4ycw-1 -<<< Too many missing values in the middle: 4zb7-2 -<<< Too many missing values in the ends: 4zhy-1 -<<< Too many missing values in total: 4zh8-1 -<<< Too many missing values in the middle: 4zyn-1 -<<< Too many missing values in the middle: 5aeo-2 -<<< Too many missing values in total: 5afp-1 -<<< Sequence is too short: 5ajp-1 -<<< Sequence is too short: 5boq-1 -<<< Sequence is too short: 5b62-1 -<<< Sequence is too short: 5b4w-3 -<<< Too many missing values in the middle: 5c03-2 -<<< Too many missing values in the middle: 5c26-1 -<<< Too many missing values in total: 5c6d-1 -<<< Sequence is too short: 5c7f-1 -<<< Too many missing values in the middle: 5cil-1 -<<< Too many missing values in the middle: 5dg6-2 -<<< Too many missing values in the middle: 5da9-1 -<<< Too many missing values in the ends: 5dpw-3 -<<< Too many missing values in the middle: 5dxf-1 -<<< Sequence is too short: 5eoj-1 -<<< Too many missing values in the middle: 5eqj-1 -<<< Too many missing values in total: 5et0-2 -<<< Too many missing values in the middle: 5f7c-5 -<<< Unnatural amino acids found: 5fcd-1 -<<< Too many missing values in the middle: 5fei-1 -<<< Too many missing values in total: 5fvd-2 -<<< Too many missing values in total: 5ghw-1 -<<< Too many missing values in the middle: 5gyd-2 -<<< Too many missing values in the middle: 5h5c-2 -<<< Too many missing values in total: 5h2w-1 -<<< Too many missing values in the middle: 5hmk-1 -<<< Sequence is too short: 5hoy-3 -<<< Too many missing values in the middle: 5hzr-1 -<<< Too many missing values in the middle: 5hyr-1 -<<< Too many missing values in the ends: 5i9b-1 -<<< Too many missing values in total: 5ic3-2 -<<< Sequence is too short: 5iaw-1 -<<< Sequence is too short: 5id1-1 -<<< Too many missing values in total: 5iq9-2 -<<< Too many missing values in total: 5iue-4 -<<< Sequence is too short: 5jhc-12 -<<< Sequence is too short: 5jwe-4 -<<< Too many missing values in the middle: 5k1a-2 -<<< Too many missing values in the middle: 5k5w-1 -<<< Too many missing values in the middle: 5kam-1 -<<< Too many missing values in the middle: 5keu-3 -<<< Too many missing values in the middle: 5ksy-1 -<<< Sequence is too short: 5krc-1 -<<< Too many missing values in the ends: 5low-1 -<<< Too many missing values in the middle: 5lsb-2 -<<< Sequence is too short: 5lw1-2 -<<< Too many missing values in total: 5m9n-1 -<<< Sequence is too short: 5m5t-1 -<<< Too many missing values in the middle: 5mio-3 -<<< Too many missing values in the ends: 5mk3-1 -<<< Too many missing values in total: 5msu-3 -<<< Too many missing values in total: 5mu0-7 -<<< Too many missing values in the middle: 5n4g-1 -<<< Too many missing values in total: 5mzl-1 -<<< Too many missing values in the middle: 5mvi-3 -<<< Too many missing values in the middle: 5nb2-1 -<<< Sequence is too short: 5n75-1 -<<< Sequence is too short: 5nht-1 -<<< Too many missing values in total: 5npw-4 -<<< Too many missing values in the middle: 5nyp-1 -<<< Too many missing values in the middle: 5o3s-1 -<<< Sequence is too short: 5o9v-2 -<<< Sequence is too short: 5otg-1 -<<< Sequence is too short: 5ov3-1 -<<< Too many missing values in total: 5oo6-8 -<<< Sequence is too short: 5q0n-1 -<<< Sequence is too short: 5q1h-1 -<<< Too many missing values in total: 5oqr-2 -<<< Sequence is too short: 5qu2-2 -<<< Too many missing values in the middle: 5r4c-1 -<<< Sequence is too short: 5r1r-11 -<<< Too many missing values in the middle: 5s4m-1 -<<< Too many missing values in the middle: 5s60-1 -<<< Too many missing values in the middle: 5sbd-1 -<<< Too many missing values in the middle: 5sus-2 -<<< Sequence is too short: 5t1m-2 -<<< Too many missing values in the middle: 5tqb-1 -<<< Too many missing values in the middle: 5tgc-2 -<<< Too many missing values in the middle: 5u4u-1 -<<< Sequence is too short: 5u98-2 -<<< Sequence is too short: 5um1-1 -<<< Too many missing values in the middle: 5un6-3 -<<< Sequence is too short: 5vab-1 -<<< Sequence is too short: 5v5l-2 -<<< Too many missing values in the middle: 5veb-1 -<<< Sequence is too short: 5vko-1 -<<< Too many missing values in the middle: 5vvv-1 -<<< Too many missing values in the middle: 5w4j-1 -<<< Too many missing values in the middle: 5wa3-1 -<<< Sequence is too short: 5wes-1 -<<< Sequence is too short: 5wha-4 -<<< Sequence is too short: 5wlj-2 -<<< Sequence is too short: 5wqd-2 -<<< Sequence is too short: 5wsh-1 -<<< Sequence is too short: 5wtt-1 -<<< Too many missing values in total: 5wzz-1 -<<< Too many missing values in total: 5wby-1 -<<< Too many missing values in the ends: 5xor-1 -<<< Too many missing values in the middle: 5xjo-1 -<<< Too many missing values in the middle: 5xq0-1 -<<< Too many missing values in total: 5y9w-1 -<<< Too many missing values in the ends: 5yir-1 -<<< Too many missing values in the middle: 5yj1-16 -<<< Too many missing values in the middle: 5ynl-1 -<<< Too many missing values in the middle: 5ytu-4 -<<< Too many missing values in the middle: 5yrp-1 -<<< Too many missing values in total: 5zgc-4 -<<< Unexpected atoms (D): 5zn0-1 -<<< Too many missing values in the middle: 5zia-6 -<<< Too many missing values in the ends: 5zx3-1 -<<< Too many missing values in the middle: 6a2m-1 -<<< Too many missing values in the middle: 6a9e-1 -<<< Too many missing values in the middle: 6ae1-2 -<<< Too many missing values in the middle: 6akj-1 -<<< Too many missing values in total: 6ahc-1 -<<< Sequence is too short: 6ati-1 -<<< Sequence is too short: 6azk-2 -<<< Too many missing values in the middle: 6b4c-3 -<<< Too many missing values in total: 6bd1-1 -<<< Too many missing values in total: 6bqt-3 -<<< Too many missing values in total: 6bvv-1 -<<< Too many missing values in the middle: 6brp-2 -<<< Too many missing values in the middle: 6c4u-5 -<<< Too many missing values in total: 6c1r-1 -<<< Too many missing values in the middle: 6cj5-1 -<<< Sequence is too short: 6cqq-2 -<<< Too many missing values in the middle: 6dft-2 -<<< Sequence is too short: 6di8-1 -<<< Too many missing values in the middle: 6dr6-2 -<<< Too many missing values in the ends: 6cxs-1 -<<< Sequence is too short: 6e3i-1 -<<< Sequence is too short: 6eex-1 -<<< Sequence is too short: 6em6-1 -<<< Sequence is too short: 6f14-1 -<<< Too many missing values in the ends: 6fmp-1 -<<< Too many missing values in the middle: 6fy3-1 -<<< Sequence is too short: 6gfx-1 -<<< Sequence is too short: 6gh1-3 -<<< Sequence is too short: 6h41-1 -<<< Too many missing values in the middle: 6how-1 -<<< Too many missing values in the middle: 6hzl-1 -<<< Too many missing values in the middle: 6i8b-2 -<<< Some chains in the PDB do not appear in the fasta file: 6i48-1 -<<< Too many missing values in the middle: 6ima-2 -<<< Sequence is too short: 6iwh-1 -<<< Sequence is too short: 6j2f-2 -<<< Too many missing values in the middle: 6hx8-1 -<<< Too many missing values in total: 6jzc-2 -<<< Too many missing values in the middle: 6k9g-2 -<<< Too many missing values in the middle: 6kmt-4 -<<< Too many missing values in the middle: 6kny-1 -<<< Sequence is too short: 6kwk-1 -<<< Sequence is too short: 6l96-1 -<<< Too many missing values in total: 6ldw-2 -<<< Sequence is too short: 6lf8-1 -<<< Sequence is too short: 6lry-1 -<<< Too many missing values in the middle: 6lto-1 -<<< Too many missing values in the ends: 6lx0-1 -<<< Too many missing values in total: 6m90-1 -<<< Sequence is too short: 6mjc-1 -<<< Too many missing values in the middle: 6mnn-1 -<<< Sequence is too short: 6mm5-1 -<<< Too many missing values in the ends: 6mwl-1 -<<< Too many missing values in the ends: 6n2b-2 -<<< Sequence is too short: 6nca-15 -<<< Too many missing values in the middle: 6nb0-1 -<<< Too many missing values in the middle: 6no1-1 -<<< Too many missing values in the middle: 6ntc-1 -<<< Too many missing values in the middle: 6nxf-1 -<<< Too many missing values in total: 6o3y-1 -<<< Too many missing values in the ends: 6nv2-1 -<<< Too many missing values in the middle: 6p6z-1 -<<< Too many missing values in the middle: 6pdm-1 -<<< Sequence is too short: 6php-1 -<<< Sequence is too short: 6pau-1 -<<< Too many missing values in total: 6psd-7 -<<< Unexpected atoms (D): 6ptp-1 -<<< Too many missing values in the middle: 6puo-1 -<<< Too many missing values in the middle: 6pc4-1 -<<< Too many missing values in total: 6qsz-6 -<<< Sequence is too short: 6r51-3 -<<< Too many missing values in total: 6qh5-1 -<<< Too many missing values in the middle: 6riy-1 -<<< Too many missing values in the middle: 6qpg-2 -<<< Too many missing values in the middle: 6roy-1 -<<< Too many missing values in total: 6s33-1 -<<< Too many missing values in the middle: 6rrp-1 -<<< Too many missing values in the ends: 6sb4-2 -<<< Some chains in the PDB do not appear in the fasta file: 6slb-1 -<<< Some chains in the PDB do not appear in the fasta file: 6sqv-3 -<<< Some chains in the PDB do not appear in the fasta file: 6t2o-1 -<<< Some chains in the PDB do not appear in the fasta file: 6syo-1 -<<< Some chains in the PDB do not appear in the fasta file: 6t9r-2 -<<< Some chains in the PDB do not appear in the fasta file: 6tkr-2 -<<< Too many missing values in total: 6tou-1 -<<< Sequence is too short: 6tno-1 -<<< Sequence is too short: 6tq0-8 -<<< Sequence is too short: 6u39-5 -<<< Too many missing values in total: 6uun-1 -<<< Too many missing values in the middle: 6uz8-1 -<<< Sequence is too short: 6vbx-2 -<<< Incorrect alignment: 6vmk-10 -<<< Too many missing values in the middle: 6vwa-1 -<<< Unknown: 6wat-7 -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert - for (chain,) in pdb_entry.get_chains(): -ValueError: too many values to unpack (expected 1) - -<<< Too many missing values in the middle: 6wcc-1 -<<< Too many missing values in total: 6wmf-1 -<<< Sequence is too short: 6wg0-1 -<<< Incorrect alignment: 6x0a-5 -<<< Too many missing values in total: 6x1s-3 -<<< Too many missing values in total: 6wsl-1 -<<< Sequence is too short: 6xqa-1 -<<< Sequence is too short: 6xxs-1 -<<< Too many missing values in total: 6xoh-1 -<<< Too many missing values in total: 6y73-4 -<<< Some chains in the PDB do not appear in the fasta file: 6yab-4 -<<< Incorrect alignment: 6yn1-4 -<<< Too many missing values in the middle: 6yyf-2 -<<< Sequence is too short: 6yx2-2 -<<< Too many missing values in the ends: 6z11-1 -<<< Unnatural amino acids found: 6z3r-1 -<<< Sequence is too short: 6z7y-1 -<<< Some chains in the PDB do not appear in the fasta file: 6zed-1 -<<< Some chains in the PDB do not appear in the fasta file: 6za8-1 -<<< Unnatural amino acids found: 6zfp-1 -<<< Some chains in the PDB do not appear in the fasta file: 6ziv-7 -<<< Sequence is too short: 6zmp-1 -<<< Unknown: 6zk7-1 -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert - for (chain,) in pdb_entry.get_chains(): -ValueError: too many values to unpack (expected 1) - -<<< Some chains in the PDB do not appear in the fasta file: 6zrz-2 -<<< Sequence is too short: 7a2y-1 -<<< Some chains in the PDB do not appear in the fasta file: 6zzh-1 -<<< Too many missing values in the middle: 7a6r-1 -<<< Too many missing values in total: 7acv-2 -<<< Some chains in the PDB do not appear in the fasta file: 7aae-1 -<<< Some chains in the PDB do not appear in the fasta file: 7aly-2 -<<< Too many missing values in the middle: 7b16-1 -<<< Too many missing values in the middle: 7ba3-1 -<<< Some chains in the PDB do not appear in the fasta file: 7bec-1 -<<< Too many missing values in the middle: 7azg-1 -<<< Too many missing values in the middle: 7bii-2 -<<< Too many missing values in total: 7bqz-4 -<<< Too many missing values in total: 7cfd-5 -<<< Too many missing values in the middle: 7cmv-1 -<<< Sequence is too short: 7co3-1 -<<< Too many missing values in the middle: 7dai-1 -<<< Too many missing values in total: 7dfl-1 -<<< Too many missing values in the middle: 7dmx-3 -<<< Too many missing values in total: 7dtc-1 -<<< Too many missing values in the ends: 7duv-2 -<<< Too many missing values in the middle: 7cda-1 -<<< Too many missing values in the middle: 7ce8-1 -<<< Sequence is too short: 7e5e-1 -<<< Too many missing values in the middle: 7eg1-1 -<<< Sequence is too short: 7eu2-1 -<<< Too many missing values in the middle: 7ezk-1 -<<< Sequence is too short: 7f7g-2 -<<< Too many missing values in total: 7f60-1 -<<< Too many missing values in the middle: 7fit-1 -<<< Unknown: 7f8i-2 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in total: 7jne-1 -<<< Too many missing values in the middle: 7k7t-1 -<<< Too many missing values in the middle: 7kgv-2 -<<< Too many missing values in the ends: 7l2h-1 -<<< Sequence is too short: 7lfd-1 -<<< Too many missing values in total: 7lkq-1 -<<< Too many missing values in the middle: 7mby-1 -<<< Too many missing values in the middle: 7mxo-1 -<<< Too many missing values in total: 7n27-4 -<<< Too many missing values in total: 7n5e-1 -<<< Too many missing values in the middle: 7ni8-1 -<<< Too many missing values in the ends: 7nku-1 -<<< Sequence is too short: 7nmd-1 -<<< Too many missing values in the middle: 7n3n-1 -<<< Some chains in the PDB do not appear in the fasta file: 7nzb-3 -<<< Too many missing values in the middle: 7o49-5 -<<< Too many missing values in the middle: 7o0m-1 -<<< Too many missing values in the middle: 7o2h-1 -<<< Too many missing values in the ends: 7ohi-1 -<<< Too many missing values in the middle: 7ov9-1 -<<< Too many missing values in total: 7ort-1 -<<< Some chains in the PDB do not appear in the fasta file: 7ozb-2 -<<< Some chains in the PDB do not appear in the fasta file: 7p1y-2 -<<< Too many missing values in the ends: 7p9d-1 -<<< Unknown: 7oxp-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Some chains in the PDB do not appear in the fasta file: 7pj4-1 -<<< Some chains in the PDB do not appear in the fasta file: 7plr-2 -<<< Too many missing values in total: 7ppl-1 -<<< Sequence is too short: 7pul-1 -<<< Sequence is too short: 7q51-1 -<<< Unknown: 7pkc-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Unknown: 7q8k-2 -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert - for (chain,) in pdb_entry.get_chains(): -ValueError: too many values to unpack (expected 1) - -<<< Some chains in the PDB do not appear in the fasta file: 7qel-2 -<<< Sequence is too short: 7rnc-1 -<<< Too many missing values in total: 7rm0-2 -<<< Too many missing values in the middle: 7s1x-1 -<<< Sequence is too short: 7s8s-1 -<<< Too many missing values in total: 7sy4-1 -<<< Too many missing values in the middle: 7st3-8 -<<< Unknown: 7su4-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in the ends: 7t8w-1 -<<< Incorrect alignment: 7tl7-3 -<<< Unexpected atoms (D1): 7tur-1 -<<< Too many missing values in total: 7tyh-1 -<<< Too many missing values in total: 7un6-1 -<<< Too many missing values in total: 7v0u-1 -<<< Too many missing values in total: 7v47-1 -<<< Too many missing values in total: 7vab-1 -<<< Too many missing values in total: 7vec-12 -<<< Too many missing values in the middle: 7vpn-1 -<<< Too many missing values in the middle: 7vr7-1 -<<< Too many missing values in the ends: 7w08-2 -<<< Too many missing values in the middle: 7w6k-1 -<<< Too many missing values in total: 7wu5-1 -<<< Too many missing values in the middle: 7x9y-1 -<<< Too many missing values in the middle: 7xjh-1 -<<< Too many missing values in total: 7xp5-1 -<<< Too many missing values in the middle: 7xr6-1 -<<< Too many missing values in the middle: 7xms-1 -<<< Too many missing values in the middle: 7xuq-1 -<<< Too many missing values in the middle: 7xwk-1 -<<< Too many missing values in the middle: 7ye8-2 -<<< Some chains in the PDB do not appear in the fasta file: 7zaj-1 -<<< Some chains in the PDB do not appear in the fasta file: 7zfn-1 -<<< Too many missing values in total: 7zir-1 -<<< Too many missing values in total: 7zh7-1 -<<< Too many missing values in total: 7wjy-1 -<<< Too many missing values in total: 8ag3-1 -<<< Too many missing values in the middle: 8bfe-8 -<<< Too many missing values in total: 8b8x-1 -<<< Unnatural amino acids found: 8dds-1 -<<< Sequence is too short: 8d5j-1 -<<< Too many missing values in total: 8dph-1 -<<< Unnatural amino acids found: 8eiq-1 -<<< Too many missing values in the ends: 8ev1-1 -<<< Sequence is too short: 8gch-2 -<<< Too many missing values in the middle: 8h15-1 -<<< Too many missing values in total: 1hha-2 -<<< Too many missing values in total: 1jma-1 -<<< Sequence is too short: 1nam-1 -<<< Too many missing values in the middle: 8eaq-1 -<<< Sequence is too short: 2aij-1 -<<< Too many missing values in total: 1r9n-2 -<<< Too many missing values in the middle: 3muu-1 -<<< Unknown: 3l4v-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Sequence is too short: 3n96-1 -<<< Sequence is too short: 3wv0-1 -<<< Too many missing values in the middle: 4cp0-1 -<<< Too many missing values in the ends: 4eef-1 -<<< Too many missing values in the middle: 3cu7-3 -<<< Too many missing values in total: 4wjv-1 -<<< Sequence is too short: 4um9-1 -<<< Sequence is too short: 5dk0-1 -<<< Too many missing values in the middle: 4z64-1 -<<< Sequence is too short: 5ab0-2 -<<< Sequence is too short: 5j51-2 -<<< Too many missing values in the middle: 5l1x-2 -<<< Too many missing values in the middle: 5hz0-1 -<<< Too many missing values in the middle: 5m5e-1 -<<< Too many missing values in the middle: 6huo-1 -<<< Unknown: 6m8p-9 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in the middle: 6pm2-1 -<<< Too many missing values in the middle: 6uz0-1 -<<< Unnatural amino acids found: 6wth-1 -<<< Some chains in the PDB do not appear in the fasta file: 6yut-2 -<<< Some chains in the PDB do not appear in the fasta file: 7b6v-2 -<<< Too many missing values in the middle: 7my3-1 -<<< Some chains in the PDB do not appear in the fasta file: 7oa1-1 -<<< Too many missing values in the middle: 7lab-1 -<<< Too many missing values in the middle: 7r16-1 -<<< Too many missing values in total: 7ddh-1 -<<< Unknown: 7pbd-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Too many missing values in the middle: 7sy3-1 -<<< Unknown: 8a47-1 -Traceback (most recent call last): - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3653, in get_loc - return self._engine.get_loc(casted_key) - File "pandas/_libs/index.pyx", line 147, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/index.pyx", line 176, in pandas._libs.index.IndexEngine.get_loc - File "pandas/_libs/hashtable_class_helper.pxi", line 7080, in pandas._libs.hashtable.PyObjectHashTable.get_item - File "pandas/_libs/hashtable_class_helper.pxi", line 7088, in pandas._libs.hashtable.PyObjectHashTable.get_item -KeyError: 'unique_residue_number' - -The above exception was the direct cause of the following exception: - -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 334, in filter_and_convert - crd_arr = pdb_entry.get_coordinates_array(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1328, in get_coordinates_array - unique_numbers = self.get_unique_residue_numbers(chain) - File "/home/ubuntu/proteinflow/proteinflow/data/__init__.py", line 1353, in get_unique_residue_numbers - return self.get_pdb_df(chain)["unique_residue_number"].unique().tolist() - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/frame.py", line 3761, in __getitem__ - indexer = self.columns.get_loc(key) - File "/home/ubuntu/miniconda3/envs/proteinflow/lib/python3.9/site-packages/pandas/core/indexes/base.py", line 3655, in get_loc - raise KeyError(key) from err -KeyError: 'unique_residue_number' - -<<< Sequence is too short: 1a4w-1 -<<< Too many missing values in the middle: 1aat-1 -<<< Sequence is too short: 1avf-2 -<<< Sequence is too short: 1b07-1 -<<< Sequence is too short: 1awr-4 -<<< Sequence is too short: 1b18-1 -<<< Sequence is too short: 1b40-1 -<<< Sequence is too short: 1bph-3 -<<< Too many missing values in total: 1c4u-1 -<<< Too many missing values in the middle: 1com-3 -<<< Unnatural amino acids found: 1deq-2 -<<< Sequence is too short: 1ddh-1 -<<< Sequence is too short: 1dkd-1 -<<< Sequence is too short: 1dph-4 -<<< Too many missing values in the ends: 7v82-1 -<<< Too many missing values in the middle: 1e69-1 -<<< Sequence is too short: 1ee5-1 -<<< Sequence is too short: 1ejh-2 -<<< Too many missing values in the middle: 1es8-1 -<<< Too many missing values in the middle: 1ex4-10 -<<< Too many missing values in total: 1ffs-2 -<<< Too many missing values in the middle: 1ft4-1 -<<< Sequence is too short: 1gy3-1 -<<< Sequence is too short: 1h25-1 -<<< Too many missing values in the middle: 1huu-4 -<<< Sequence is too short: 1jd5-1 -<<< Sequence is too short: 1jq9-1 -<<< Too many missing values in total: 1k8k-1 -<<< Sequence is too short: 1kyc-1 -<<< Too many missing values in the ends: 1ktr-1 -<<< Too many missing values in the middle: 1l8w-5 -<<< Too many missing values in the middle: 1miu-1 -<<< Sequence is too short: 1mk9-4 -<<< Too many missing values in the middle: 1mul-2 -<<< Too many missing values in total: 1n0y-1 -<<< Too many missing values in total: 1n4s-1 -<<< Sequence is too short: 1o2g-1 -<<< Too many missing values in total: 1o6p-1 -<<< Too many missing values in the middle: 1ofp-2 -<<< Too many missing values in total: 1p16-1 -<<< Too many missing values in total: 1p8d-2 -<<< Sequence is too short: 1pj8-1 -<<< Sequence is too short: 1pu9-1 -<<< Too many missing values in the ends: 1q4q-5 -<<< Sequence is too short: 1q24-1 -<<< Sequence is too short: 1q94-2 -<<< Unnatural amino acids found: 1r4l-1 -<<< Sequence is too short: 1rbh-2 -<<< Too many missing values in the middle: 1rea-1 -<<< Sequence is too short: 1r5w-2 -<<< Too many missing values in total: 1s4v-2 -<<< Sequence is too short: 1sfq-1 -<<< Sequence is too short: 1s7t-2 -<<< Too many missing values in the middle: 1so8-1 -<<< Too many missing values in total: 1sps-2 -<<< Too many missing values in the middle: 1t2v-6 -<<< Sequence is too short: 1tom-1 -<<< Too many missing values in total: 1tno-5 -<<< Sequence is too short: 1u00-1 -<<< Too many missing values in the ends: 1u9g-3 -<<< Sequence is too short: 1uef-2 -<<< Sequence is too short: 1unz-1 -<<< Too many missing values in total: 1vr9-2 -<<< Too many missing values in total: 1w7r-4 -<<< Too many missing values in total: 1w6i-2 -<<< Too many missing values in total: 1wu1-1 -<<< Sequence is too short: 1x2r-1 -<<< Sequence is too short: 1xda-3 -<<< Sequence is too short: 1x7b-1 -<<< Unnatural amino acids found: 1xgf-1 -<<< Too many missing values in the middle: 1y01-1 -<<< Too many missing values in the middle: 1y14-2 -<<< Too many missing values in total: 1y80-1 -<<< Too many missing values in the middle: 1yb2-1 -<<< Sequence is too short: 1zmk-2 -<<< Sequence is too short: 1zni-6 -<<< Too many missing values in the middle: 1zw0-4 -<<< Too many missing values in total: 2ahl-1 -<<< Too many missing values in the ends: 1zzd-1 -<<< Too many missing values in the ends: 2b1h-1 -<<< Too many missing values in the middle: 2bbo-1 -<<< Too many missing values in total: 2bd8-1 -<<< Too many missing values in total: 2aka-1 -<<< Sequence is too short: 2bxt-1 -<<< Sequence is too short: 2c8w-1 -<<< Too many missing values in the middle: 2cn5-1 -<<< Too many missing values in the middle: 2b5l-1 -<<< Sequence is too short: 2clv-2 -<<< Too many missing values in the middle: 2cy7-1 -<<< Too many missing values in the middle: 2eq5-2 -<<< Too many missing values in the middle: 2f1m-1 -<<< Sequence is too short: 2fx8-4 -<<< Too many missing values in the middle: 2g2q-3 -<<< Too many missing values in the ends: 2g1t-1 -<<< Too many missing values in the middle: 2gjv-1 -<<< Too many missing values in the middle: 2gmt-1 -<<< Sequence is too short: 2gt9-2 -<<< Too many missing values in the middle: 2h3r-2 -<<< Too many missing values in the ends: 2h4y-1 -<<< Sequence is too short: 2h96-3 -<<< Sequence is too short: 2hjk-1 -<<< Unnatural amino acids found: 2hpe-1 -<<< Too many missing values in the middle: 2hwy-2 -<<< Too many missing values in the middle: 2ic9-2 -<<< Unnatural amino acids found: 2iv2-1 -<<< Too many missing values in the middle: 2nye-4 -<<< Too many missing values in the middle: 2op1-1 -<<< Too many missing values in the middle: 2oq1-1 -<<< Too many missing values in the ends: 2p32-2 -<<< Too many missing values in the middle: 2p22-5 -<<< Sequence is too short: 2p54-1 -<<< Too many missing values in total: 2pxj-2 -<<< Sequence is too short: 2q3y-1 -<<< Too many missing values in the middle: 2q97-1 -<<< Too many missing values in the middle: 2qoc-1 -<<< Sequence is too short: 2qgw-1 -<<< Too many missing values in the middle: 2qv8-2 -<<< Too many missing values in the middle: 2qsx-1 -<<< Too many missing values in the middle: 2qym-1 -<<< Too many missing values in total: 2r3c-1 -<<< Too many missing values in the middle: 2vo9-3 -<<< Too many missing values in the middle: 2vgi-1 -<<< Unknown: 2vvj-1 -Traceback (most recent call last): - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 190, in process_f - protein_dict = filter_and_convert( - File "/home/ubuntu/proteinflow/proteinflow/processing/__init__.py", line 306, in filter_and_convert - for (chain,) in pdb_entry.get_chains(): -ValueError: too many values to unpack (expected 1) - -<<< Too many missing values in the ends: 2w0p-1 -<<< Too many missing values in the middle: 2waz-1 -<<< Sequence is too short: 2wpm-1 -<<< Too many missing values in total: 2wtt-4 -<<< Sequence is too short: 2x4o-1 -<<< Too many missing values in total: 2xi1-2 -<<< Too many missing values in the middle: 2xk6-1 -<<< Too many missing values in the middle: 2yqy-4 -<<< Too many missing values in the ends: 2z5s-3 -<<< Too many missing values in the middle: 2z9h-1 -<<< Sequence is too short: 2zhw-1 -<<< Sequence is too short: 2zla-1 -<<< Sequence is too short: 3a0m-1 -<<< Too many missing values in the ends: 3a1m-1 -<<< Too many missing values in the middle: 3b0s-1 -<<< Sequence is too short: 3b23-1 -<<< Too many missing values in total: 3b71-3 -<<< Too many missing values in the middle: 3b80-1 -<<< Too many missing values in the middle: 3bby-1 -<<< Too many missing values in the middle: 3bd1-2 -<<< Too many missing values in the middle: 3bku-3 -<<< Sequence is too short: 3bw9-1 -<<< Too many missing values in total: 3bzy-3 -<<< Too many missing values in total: 3c57-1 -<<< Sequence is too short: 3cay-2 -<<< Sequence is too short: 3c9n-1 -<<< Too many missing values in the middle: 3cjr-1 -<<< Too many missing values in the middle: 3d8f-2 -<<< Too many missing values in the middle: 3db4-1 -<<< Too many missing values in total: 3dnj-1 -<<< Too many missing values in the ends: 3dom-1 -<<< Too many missing values in the middle: 3dpo-3 -<<< Too many missing values in the middle: 3ddr-2 -<<< Sequence is too short: 3e1r-1 -<<< Sequence is too short: 3dx6-1 -<<< Too many missing values in the middle: 3e9c-1 -<<< Sequence is too short: 3e8d-1 -<<< Too many missing values in the middle: 3efk-1 From 7a946bb46ee9baa29dc79b946fed6753ef9e7a57 Mon Sep 17 00:00:00 2001 From: Liza Kozlova Date: Wed, 19 Jul 2023 12:49:16 +0000 Subject: [PATCH 7/7] build: fix pyyaml version to avoid cython issues in python 3.10 --- pyproject.toml | 1 + 1 file changed, 1 insertion(+) diff --git a/pyproject.toml b/pyproject.toml index 954d6df..495721b 100644 --- a/pyproject.toml +++ b/pyproject.toml @@ -29,6 +29,7 @@ dependencies = [ "aiobotocore==2.4.2", "awscli==1.25.60", "bs4>=0.0.1", + "pyyaml==5.3", "rcsbsearch", "blosum", "pre-commit",