# command:# Prefix for input files set to /projects/compbio/experiments/undertaker/atoms-inputs/ # command:# reading dunbrack-2191.atoms # #computed average backbone with maximum peptide_sq_deviance = 0.002 # computed average trans backbone unit from 53157 examples # computed average trans backbone unit before proline from 2010 examples # computed average cis backbone unit from 97 examples # trans (non-proline) backbone unit: # CA= -2.2087 1.0126 -0.0030 # O= -0.1499 2.2440 0.0016 # C= -0.6889 1.1368 -0.0000 # N+1= 0.0000 0.0000 0.0000 # CA+1= 1.4581 -0.0000 0.0000 # cis backbone unit: # CA= -0.1436 2.4534 -0.0002 # O= -2.0284 0.9742 0.0015 # C= -0.8018 1.0771 -0.0000 # N+1= 0.0000 0.0000 0.0000 # CA+1= 1.4668 0.0000 0.0000 # trans backbone unit before proline: # CA= -2.2100 1.0631 -0.0014 # O= -0.1236 2.2458 0.0075 # C= -0.6872 1.1517 -0.0000 # N+1= 0.0000 0.0000 0.0000 # CA+1= 1.4660 0.0000 0.0000 # After reading dunbrack-2191.atoms have 2191 chains in training database # Count of chains,residues,atoms: 2191,500310,3902258 # 493341 residues have no bad marker # 3226 residues lack atoms needed to compute omega # 1453 residues have cis peptide # number of each bad type: # NON_STANDARD_RESIDUE 4 # HAS_OXT 1167 # TOO_MANY_ATOMS 1 # TOO_FEW_ATOMS 3052 # HAS_UNKNOWN_ATOMS 9 # HAS_DUPLICATE_ATOMS 0 # CHAIN_BREAK_BEFORE 979 # NON_PLANAR_PEPTIDE 888 # BAD_PEPTIDE 2680 # Note: may sum to more than number of residues, # because one residue may have multiple problems # command:# Reading rotamer library from dunbrack-2191.rot # command:# Prefix for input files set to /projects/compbio/experiments/undertaker/spots/ # command:# ReadAtomType exp-pdb.types Read AtomType exp-pdb with 49 types. # command:# ReadClashTable exp-pdb-2191-2symm.clash # Read ClashTable exp-pdb-2191-2symm checking bonds symmetric at MaxSep 2 # command:# command:# Prefix for input files set to /projects/compbio/experiments/protein-predict/casp7/T0371/ # command:# Making conformation for sequence T0371 numbered 1 through 283 Created new target T0371 from T0371.a2m # command:# Prefix for input files set to /projects/compbio/experiments/protein-predict/casp7/T0371/ # command:# Prefix for input files set to /projects/compbio/experiments/protein-predict/casp7/constraints_v3/T0371/ # command:# reading script from file servers-clean.under # Prefix for input files set to /projects/compbio/experiments/protein-predict/casp7/T0371/decoys/ # ReadConformPDB reading from PDB file T0371.chimera.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # ReadConformPDB reading from PDB file chimera-14-12.pdb.gz looking for model 1 # choosing archetypes in rotamer library # Found a chain break before 274 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file servers/3D-JIGSAW_POPULUS_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_POPULUS_TS1 # ReadConformPDB reading from PDB file servers/3D-JIGSAW_POPULUS_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_POPULUS_TS2 # ReadConformPDB reading from PDB file servers/3D-JIGSAW_POPULUS_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_POPULUS_TS3 # ReadConformPDB reading from PDB file servers/3D-JIGSAW_POPULUS_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_POPULUS_TS4 # ReadConformPDB reading from PDB file servers/3D-JIGSAW_POPULUS_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_POPULUS_TS5 # ReadConformPDB reading from PDB file servers/3D-JIGSAW_RECOM_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_RECOM_TS1 # ReadConformPDB reading from PDB file servers/3D-JIGSAW_RECOM_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_RECOM_TS2 # ReadConformPDB reading from PDB file servers/3D-JIGSAW_RECOM_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_RECOM_TS3 # ReadConformPDB reading from PDB file servers/3D-JIGSAW_RECOM_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_RECOM_TS4 # ReadConformPDB reading from PDB file servers/3D-JIGSAW_RECOM_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_RECOM_TS5 # ReadConformPDB reading from PDB file servers/3D-JIGSAW_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_TS1 # ReadConformPDB reading from PDB file servers/3D-JIGSAW_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_TS2 # ReadConformPDB reading from PDB file servers/3D-JIGSAW_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_TS3 # ReadConformPDB reading from PDB file servers/3D-JIGSAW_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_TS4 # ReadConformPDB reading from PDB file servers/3D-JIGSAW_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_TS5 # ReadConformPDB reading from PDB file servers/3Dpro_TS1.pdb.gz looking for model 1 # Found a chain break before 217 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS1 # ReadConformPDB reading from PDB file servers/3Dpro_TS2.pdb.gz looking for model 1 # Found a chain break before 218 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS2 # ReadConformPDB reading from PDB file servers/3Dpro_TS3.pdb.gz looking for model 1 # Found a chain break before 220 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS3 # ReadConformPDB reading from PDB file servers/3Dpro_TS4.pdb.gz looking for model 1 # Found a chain break before 271 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS4 # ReadConformPDB reading from PDB file servers/3Dpro_TS5.pdb.gz looking for model 1 # Found a chain break before 218 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS5 # ReadConformPDB reading from PDB file servers/ABIpro_TS1.pdb.gz looking for model 1 # Found a chain break before 274 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS1 # ReadConformPDB reading from PDB file servers/ABIpro_TS2.pdb.gz looking for model 1 # Found a chain break before 275 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS2 # ReadConformPDB reading from PDB file servers/ABIpro_TS3.pdb.gz looking for model 1 # Found a chain break before 271 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS3 # ReadConformPDB reading from PDB file servers/ABIpro_TS4.pdb.gz looking for model 1 # Found a chain break before 275 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS4 # ReadConformPDB reading from PDB file servers/ABIpro_TS5.pdb.gz looking for model 1 # Found a chain break before 280 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS5 # ReadConformPDB reading from PDB file servers/BayesHH_TS1.pdb.gz looking for model 1 # Found a chain break before 220 # copying to AlignedFragments data structure # naming current conformation BayesHH_TS1 # ReadConformPDB reading from PDB file servers/Bilab-ENABLE_TS1.pdb.gz looking for model 1 # Found a chain break before 173 # copying to AlignedFragments data structure # naming current conformation Bilab-ENABLE_TS1 # ReadConformPDB reading from PDB file servers/Bilab-ENABLE_TS2.pdb.gz looking for model 1 # Found a chain break before 129 # copying to AlignedFragments data structure # naming current conformation Bilab-ENABLE_TS2 # ReadConformPDB reading from PDB file servers/Bilab-ENABLE_TS3.pdb.gz looking for model 1 # Found a chain break before 210 # copying to AlignedFragments data structure # naming current conformation Bilab-ENABLE_TS3 # ReadConformPDB reading from PDB file servers/Bilab-ENABLE_TS4.pdb.gz looking for model 1 # Found a chain break before 272 # copying to AlignedFragments data structure # naming current conformation Bilab-ENABLE_TS4 # ReadConformPDB reading from PDB file servers/Bilab-ENABLE_TS5.pdb.gz looking for model 1 # Found a chain break before 281 # copying to AlignedFragments data structure # naming current conformation Bilab-ENABLE_TS5 # ReadConformPDB reading from PDB file servers/CIRCLE_TS1.pdb.gz looking for model 1 # Found a chain break before 281 # copying to AlignedFragments data structure # naming current conformation CIRCLE_TS1 # ReadConformPDB reading from PDB file servers/CIRCLE_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation CIRCLE_TS2 # ReadConformPDB reading from PDB file servers/CIRCLE_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation CIRCLE_TS3 # ReadConformPDB reading from PDB file servers/CIRCLE_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation CIRCLE_TS4 # ReadConformPDB reading from PDB file servers/CIRCLE_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation CIRCLE_TS5 # ReadConformPDB reading from PDB file servers/CPHmodels_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation CPHmodels_TS1 # ReadConformPDB reading from PDB file servers/CaspIta-FOX_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation CaspIta-FOX_TS1 # ReadConformPDB reading from PDB file servers/CaspIta-FOX_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation CaspIta-FOX_TS2 # ReadConformPDB reading from PDB file servers/CaspIta-FOX_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation CaspIta-FOX_TS3 # ReadConformPDB reading from PDB file servers/CaspIta-FOX_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation CaspIta-FOX_TS4 # ReadConformPDB reading from PDB file servers/CaspIta-FOX_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation CaspIta-FOX_TS5 # ReadConformPDB reading from PDB file servers/Distill_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation Distill_TS1 # ReadConformPDB reading from PDB file servers/Distill_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation Distill_TS2 # ReadConformPDB reading from PDB file servers/Distill_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation Distill_TS3 # ReadConformPDB reading from PDB file servers/Distill_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation Distill_TS4 # ReadConformPDB reading from PDB file servers/Distill_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation Distill_TS5 # ReadConformPDB reading from PDB file servers/FAMSD_TS1.pdb.gz looking for model 1 # Found a chain break before 272 # copying to AlignedFragments data structure # naming current conformation FAMSD_TS1 # ReadConformPDB reading from PDB file servers/FAMSD_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation FAMSD_TS2 # ReadConformPDB reading from PDB file servers/FAMSD_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation FAMSD_TS3 # ReadConformPDB reading from PDB file servers/FAMSD_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation FAMSD_TS4 # ReadConformPDB reading from PDB file servers/FAMSD_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation FAMSD_TS5 # ReadConformPDB reading from PDB file servers/FAMS_TS1.pdb.gz looking for model 1 # Found a chain break before 282 # copying to AlignedFragments data structure # naming current conformation FAMS_TS1 # ReadConformPDB reading from PDB file servers/FAMS_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation FAMS_TS2 # ReadConformPDB reading from PDB file servers/FAMS_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation FAMS_TS3 # ReadConformPDB reading from PDB file servers/FAMS_TS4.pdb.gz looking for model 1 # Found a chain break before 281 # copying to AlignedFragments data structure # naming current conformation FAMS_TS4 # ReadConformPDB reading from PDB file servers/FAMS_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation FAMS_TS5 # ReadConformPDB reading from PDB file servers/FOLDpro_TS1.pdb.gz looking for model 1 # Found a chain break before 218 # copying to AlignedFragments data structure # naming current conformation FOLDpro_TS1 # ReadConformPDB reading from PDB file servers/FOLDpro_TS2.pdb.gz looking for model 1 # Found a chain break before 220 # copying to AlignedFragments data structure # naming current conformation FOLDpro_TS2 # ReadConformPDB reading from PDB file servers/FOLDpro_TS3.pdb.gz looking for model 1 # Found a chain break before 251 # copying to AlignedFragments data structure # naming current conformation FOLDpro_TS3 # ReadConformPDB reading from PDB file servers/FOLDpro_TS4.pdb.gz looking for model 1 # Found a chain break before 271 # copying to AlignedFragments data structure # naming current conformation FOLDpro_TS4 # ReadConformPDB reading from PDB file servers/FOLDpro_TS5.pdb.gz looking for model 1 # Found a chain break before 279 # copying to AlignedFragments data structure # naming current conformation FOLDpro_TS5 # ReadConformPDB reading from PDB file servers/FORTE1_AL1.pdb.gz looking for model 1 Skipped atom 86, because occupancy 1 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 87, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 120, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 133, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 806, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 811, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 944, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 969, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation FORTE1_AL1 # ReadConformPDB reading from PDB file servers/FORTE1_AL2.pdb.gz looking for model 1 Skipped atom 66, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL2.pdb.gz Skipped atom 68, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL2.pdb.gz Skipped atom 70, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL2.pdb.gz Skipped atom 72, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL2.pdb.gz Skipped atom 182, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL2.pdb.gz Skipped atom 184, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL2.pdb.gz Skipped atom 186, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL2.pdb.gz Skipped atom 188, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL2.pdb.gz Skipped atom 254, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL2.pdb.gz Skipped atom 256, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL2.pdb.gz Skipped atom 258, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL2.pdb.gz Skipped atom 260, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL2.pdb.gz Skipped atom 418, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL2.pdb.gz Skipped atom 420, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL2.pdb.gz Skipped atom 422, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL2.pdb.gz Skipped atom 424, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL2.pdb.gz Skipped atom 1026, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL2.pdb.gz Skipped atom 1028, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL2.pdb.gz Skipped atom 1030, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL2.pdb.gz Skipped atom 1032, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL2.pdb.gz # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation FORTE1_AL2 # ReadConformPDB reading from PDB file servers/FORTE1_AL3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation FORTE1_AL3 # ReadConformPDB reading from PDB file servers/FORTE1_AL4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation FORTE1_AL4 # ReadConformPDB reading from PDB file servers/FORTE1_AL5.pdb.gz looking for model 1 Skipped atom 167, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL5.pdb.gz Skipped atom 320, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL5.pdb.gz Skipped atom 329, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL5.pdb.gz Skipped atom 358, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL5.pdb.gz Skipped atom 531, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL5.pdb.gz Skipped atom 696, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL5.pdb.gz # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation FORTE1_AL5 # ReadConformPDB reading from PDB file servers/FORTE2_AL1.pdb.gz looking for model 1 Skipped atom 86, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 87, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 120, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 133, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 794, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 799, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 932, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation FORTE2_AL1 # ReadConformPDB reading from PDB file servers/FORTE2_AL2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation FORTE2_AL2 # ReadConformPDB reading from PDB file servers/FORTE2_AL3.pdb.gz looking for model 1 Skipped atom 66, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL3.pdb.gz Skipped atom 68, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL3.pdb.gz Skipped atom 70, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL3.pdb.gz Skipped atom 72, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL3.pdb.gz Skipped atom 182, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL3.pdb.gz Skipped atom 184, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL3.pdb.gz Skipped atom 186, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL3.pdb.gz Skipped atom 188, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL3.pdb.gz Skipped atom 414, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL3.pdb.gz Skipped atom 416, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL3.pdb.gz Skipped atom 418, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL3.pdb.gz Skipped atom 420, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL3.pdb.gz Skipped atom 1022, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL3.pdb.gz Skipped atom 1024, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL3.pdb.gz Skipped atom 1026, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL3.pdb.gz Skipped atom 1028, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL3.pdb.gz # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation FORTE2_AL3 # ReadConformPDB reading from PDB file servers/FORTE2_AL4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation FORTE2_AL4 # ReadConformPDB reading from PDB file servers/FORTE2_AL5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation FORTE2_AL5 # ReadConformPDB reading from PDB file servers/FPSOLVER-SERVER_TS1.pdb.gz looking for model 1 # Found a chain break before 140 # copying to AlignedFragments data structure # naming current conformation FPSOLVER-SERVER_TS1 # ReadConformPDB reading from PDB file servers/FPSOLVER-SERVER_TS2.pdb.gz looking for model 1 # Found a chain break before 183 # copying to AlignedFragments data structure # naming current conformation FPSOLVER-SERVER_TS2 # ReadConformPDB reading from PDB file servers/FPSOLVER-SERVER_TS3.pdb.gz looking for model 1 # Found a chain break before 277 # copying to AlignedFragments data structure # naming current conformation FPSOLVER-SERVER_TS3 # ReadConformPDB reading from PDB file servers/FPSOLVER-SERVER_TS4.pdb.gz looking for model 1 # Found a chain break before 266 # copying to AlignedFragments data structure # naming current conformation FPSOLVER-SERVER_TS4 # ReadConformPDB reading from PDB file servers/FPSOLVER-SERVER_TS5.pdb.gz looking for model 1 # Found a chain break before 270 # copying to AlignedFragments data structure # naming current conformation FPSOLVER-SERVER_TS5 # ReadConformPDB reading from PDB file servers/FUGMOD_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation FUGMOD_TS1 # ReadConformPDB reading from PDB file servers/FUGMOD_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation FUGMOD_TS2 # ReadConformPDB reading from PDB file servers/FUGMOD_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation FUGMOD_TS3 # ReadConformPDB reading from PDB file servers/FUGMOD_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation FUGMOD_TS4 # ReadConformPDB reading from PDB file servers/FUGMOD_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation FUGMOD_TS5 # ReadConformPDB reading from PDB file servers/FUGUE_AL1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation FUGUE_AL1 # ReadConformPDB reading from PDB file servers/FUGUE_AL2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation FUGUE_AL2 # ReadConformPDB reading from PDB file servers/FUGUE_AL3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation FUGUE_AL3 # ReadConformPDB reading from PDB file servers/FUGUE_AL4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation FUGUE_AL4 # ReadConformPDB reading from PDB file servers/FUGUE_AL5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation FUGUE_AL5 # ReadConformPDB reading from PDB file servers/FUNCTION_TS1.pdb.gz looking for model 1 # Found a chain break before 276 # copying to AlignedFragments data structure # naming current conformation FUNCTION_TS1 # ReadConformPDB reading from PDB file servers/FUNCTION_TS2.pdb.gz looking for model 1 # Found a chain break before 281 # copying to AlignedFragments data structure # naming current conformation FUNCTION_TS2 # ReadConformPDB reading from PDB file servers/FUNCTION_TS3.pdb.gz looking for model 1 # Found a chain break before 274 # copying to AlignedFragments data structure # naming current conformation FUNCTION_TS3 # ReadConformPDB reading from PDB file servers/FUNCTION_TS4.pdb.gz looking for model 1 # Found a chain break before 282 # copying to AlignedFragments data structure # naming current conformation FUNCTION_TS4 # ReadConformPDB reading from PDB file servers/FUNCTION_TS5.pdb.gz looking for model 1 # Found a chain break before 272 # copying to AlignedFragments data structure # naming current conformation FUNCTION_TS5 # ReadConformPDB reading from PDB file servers/Frankenstein_TS1.pdb.gz looking for model 1 # Found a chain break before 250 # copying to AlignedFragments data structure # naming current conformation Frankenstein_TS1 # ReadConformPDB reading from PDB file servers/Frankenstein_TS2.pdb.gz looking for model 1 # Found a chain break before 280 # copying to AlignedFragments data structure # naming current conformation Frankenstein_TS2 # ReadConformPDB reading from PDB file servers/GeneSilicoMetaServer_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation GeneSilicoMetaServer_TS1 # ReadConformPDB reading from PDB file servers/GeneSilicoMetaServer_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation GeneSilicoMetaServer_TS2 # ReadConformPDB reading from PDB file servers/GeneSilicoMetaServer_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation GeneSilicoMetaServer_TS3 # ReadConformPDB reading from PDB file servers/GeneSilicoMetaServer_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation GeneSilicoMetaServer_TS4 # ReadConformPDB reading from PDB file servers/GeneSilicoMetaServer_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation GeneSilicoMetaServer_TS5 # ReadConformPDB reading from PDB file servers/HHpred1_TS1.pdb.gz looking for model 1 # Found a chain break before 243 # copying to AlignedFragments data structure # naming current conformation HHpred1_TS1 # ReadConformPDB reading from PDB file servers/HHpred2_TS1.pdb.gz looking for model 1 # Found a chain break before 280 # copying to AlignedFragments data structure # naming current conformation HHpred2_TS1 # ReadConformPDB reading from PDB file servers/HHpred3_TS1.pdb.gz looking for model 1 # Found a chain break before 213 # copying to AlignedFragments data structure # naming current conformation HHpred3_TS1 # ReadConformPDB reading from PDB file servers/Huber-Torda-Server_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation Huber-Torda-Server_TS1 # ReadConformPDB reading from PDB file servers/Huber-Torda-Server_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation Huber-Torda-Server_TS2 # ReadConformPDB reading from PDB file servers/Huber-Torda-Server_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation Huber-Torda-Server_TS3 # ReadConformPDB reading from PDB file servers/Huber-Torda-Server_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation Huber-Torda-Server_TS4 # ReadConformPDB reading from PDB file servers/Huber-Torda-Server_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation Huber-Torda-Server_TS5 # ReadConformPDB reading from PDB file servers/LOOPP_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation LOOPP_TS1 # ReadConformPDB reading from PDB file servers/LOOPP_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation LOOPP_TS2 # ReadConformPDB reading from PDB file servers/LOOPP_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation LOOPP_TS3 # ReadConformPDB reading from PDB file servers/LOOPP_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation LOOPP_TS4 # ReadConformPDB reading from PDB file servers/LOOPP_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation LOOPP_TS5 # ReadConformPDB reading from PDB file servers/MIG_FROST_AL1.pdb.gz looking for model 1 Skipped atom 63, because occupancy 1.000 <= existing 1.000 in servers/MIG_FROST_AL1.pdb.gz Skipped atom 548, because occupancy 1.000 <= existing 1.000 in servers/MIG_FROST_AL1.pdb.gz # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation MIG_FROST_AL1 # ReadConformPDB reading from PDB file servers/Ma-OPUS-server2_TS1.pdb.gz looking for model 1 # Found a chain break before 174 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server2_TS1 # ReadConformPDB reading from PDB file servers/Ma-OPUS-server2_TS2.pdb.gz looking for model 1 # Found a chain break before 282 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server2_TS2 # ReadConformPDB reading from PDB file servers/Ma-OPUS-server2_TS3.pdb.gz looking for model 1 # Found a chain break before 118 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server2_TS3 # ReadConformPDB reading from PDB file servers/Ma-OPUS-server2_TS4.pdb.gz looking for model 1 # Found a chain break before 120 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server2_TS4 # ReadConformPDB reading from PDB file servers/Ma-OPUS-server2_TS5.pdb.gz looking for model 1 # Found a chain break before 243 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server2_TS5 # ReadConformPDB reading from PDB file servers/Ma-OPUS-server_TS1.pdb.gz looking for model 1 # Found a chain break before 282 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS1 # ReadConformPDB reading from PDB file servers/Ma-OPUS-server_TS2.pdb.gz looking for model 1 # Found a chain break before 265 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS2 # ReadConformPDB reading from PDB file servers/Ma-OPUS-server_TS3.pdb.gz looking for model 1 # Found a chain break before 118 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS3 # ReadConformPDB reading from PDB file servers/Ma-OPUS-server_TS4.pdb.gz looking for model 1 # Found a chain break before 243 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS4 # ReadConformPDB reading from PDB file servers/Ma-OPUS-server_TS5.pdb.gz looking for model 1 # Found a chain break before 279 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS5 # ReadConformPDB reading from PDB file servers/MetaTasser_TS1.pdb.gz looking for model 1 # Found a chain break before 282 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS1 # ReadConformPDB reading from PDB file servers/MetaTasser_TS2.pdb.gz looking for model 1 # Found a chain break before 282 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS2 # ReadConformPDB reading from PDB file servers/MetaTasser_TS3.pdb.gz looking for model 1 # Found a chain break before 282 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS3 # ReadConformPDB reading from PDB file servers/MetaTasser_TS4.pdb.gz looking for model 1 # Found a chain break before 280 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS4 # ReadConformPDB reading from PDB file servers/MetaTasser_TS5.pdb.gz looking for model 1 # Found a chain break before 280 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS5 # ReadConformPDB reading from PDB file servers/NN_PUT_lab_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation NN_PUT_lab_TS1 # ReadConformPDB reading from PDB file servers/PROTINFO-AB_TS1.pdb.gz looking for model 1 # Found a chain break before 116 # copying to AlignedFragments data structure # naming current conformation PROTINFO-AB_TS1 # ReadConformPDB reading from PDB file servers/PROTINFO-AB_TS2.pdb.gz looking for model 1 # Found a chain break before 116 # copying to AlignedFragments data structure # naming current conformation PROTINFO-AB_TS2 # ReadConformPDB reading from PDB file servers/PROTINFO-AB_TS3.pdb.gz looking for model 1 # Found a chain break before 116 # copying to AlignedFragments data structure # naming current conformation PROTINFO-AB_TS3 # ReadConformPDB reading from PDB file servers/PROTINFO-AB_TS4.pdb.gz looking for model 1 # Found a chain break before 116 # copying to AlignedFragments data structure # naming current conformation PROTINFO-AB_TS4 # ReadConformPDB reading from PDB file servers/PROTINFO-AB_TS5.pdb.gz looking for model 1 # naming current conformation PROTINFO-AB_TS5 # ReadConformPDB reading from PDB file servers/PROTINFO_TS1.pdb.gz looking for model 1 # Found a chain break before 116 # copying to AlignedFragments data structure # naming current conformation PROTINFO_TS1 # ReadConformPDB reading from PDB file servers/PROTINFO_TS2.pdb.gz looking for model 1 # Found a chain break before 116 # copying to AlignedFragments data structure # naming current conformation PROTINFO_TS2 # ReadConformPDB reading from PDB file servers/PROTINFO_TS3.pdb.gz looking for model 1 # Found a chain break before 116 # copying to AlignedFragments data structure # naming current conformation PROTINFO_TS3 # ReadConformPDB reading from PDB file servers/PROTINFO_TS4.pdb.gz looking for model 1 # Found a chain break before 116 # copying to AlignedFragments data structure # naming current conformation PROTINFO_TS4 # ReadConformPDB reading from PDB file servers/PROTINFO_TS5.pdb.gz looking for model 1 # Found a chain break before 216 # copying to AlignedFragments data structure # naming current conformation PROTINFO_TS5 # ReadConformPDB reading from PDB file servers/Pcons6_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation Pcons6_TS1 # ReadConformPDB reading from PDB file servers/Pcons6_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation Pcons6_TS2 # ReadConformPDB reading from PDB file servers/Pcons6_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation Pcons6_TS3 # ReadConformPDB reading from PDB file servers/Pcons6_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation Pcons6_TS4 # ReadConformPDB reading from PDB file servers/Pcons6_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation Pcons6_TS5 # ReadConformPDB reading from PDB file servers/Phyre-1_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation Phyre-1_TS1 # ReadConformPDB reading from PDB file servers/Phyre-2_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation Phyre-2_TS1 # ReadConformPDB reading from PDB file servers/Phyre-2_TS2.pdb.gz looking for model 1 # Found a chain break before 278 # copying to AlignedFragments data structure # naming current conformation Phyre-2_TS2 # ReadConformPDB reading from PDB file servers/Phyre-2_TS3.pdb.gz looking for model 1 # Found a chain break before 278 # copying to AlignedFragments data structure # naming current conformation Phyre-2_TS3 # ReadConformPDB reading from PDB file servers/Phyre-2_TS4.pdb.gz looking for model 1 # Found a chain break before 278 # copying to AlignedFragments data structure # naming current conformation Phyre-2_TS4 # ReadConformPDB reading from PDB file servers/Phyre-2_TS5.pdb.gz looking for model 1 # Found a chain break before 278 # copying to AlignedFragments data structure # naming current conformation Phyre-2_TS5 # ReadConformPDB reading from PDB file servers/Pmodeller6_TS1.pdb.gz looking for model 1 # Found a chain break before 177 # copying to AlignedFragments data structure # naming current conformation Pmodeller6_TS1 # ReadConformPDB reading from PDB file servers/Pmodeller6_TS2.pdb.gz looking for model 1 # Found a chain break before 279 # copying to AlignedFragments data structure # naming current conformation Pmodeller6_TS2 # ReadConformPDB reading from PDB file servers/Pmodeller6_TS3.pdb.gz looking for model 1 # Found a chain break before 213 # copying to AlignedFragments data structure # naming current conformation Pmodeller6_TS3 # ReadConformPDB reading from PDB file servers/Pmodeller6_TS4.pdb.gz looking for model 1 # Found a chain break before 217 # copying to AlignedFragments data structure # naming current conformation Pmodeller6_TS4 # ReadConformPDB reading from PDB file servers/Pmodeller6_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation Pmodeller6_TS5 # ReadConformPDB reading from PDB file servers/RAPTOR-ACE_TS1.pdb.gz looking for model 1 # Found a chain break before 279 # copying to AlignedFragments data structure # naming current conformation RAPTOR-ACE_TS1 # ReadConformPDB reading from PDB file servers/RAPTOR-ACE_TS2.pdb.gz looking for model 1 # Found a chain break before 221 # copying to AlignedFragments data structure # naming current conformation RAPTOR-ACE_TS2 # ReadConformPDB reading from PDB file servers/RAPTOR-ACE_TS3.pdb.gz looking for model 1 # Found a chain break before 219 # copying to AlignedFragments data structure # naming current conformation RAPTOR-ACE_TS3 # ReadConformPDB reading from PDB file servers/RAPTOR-ACE_TS4.pdb.gz looking for model 1 # Found a chain break before 72 # copying to AlignedFragments data structure # naming current conformation RAPTOR-ACE_TS4 # ReadConformPDB reading from PDB file servers/RAPTOR-ACE_TS5.pdb.gz looking for model 1 # Found a chain break before 280 # copying to AlignedFragments data structure # naming current conformation RAPTOR-ACE_TS5 # ReadConformPDB reading from PDB file servers/RAPTORESS_TS1.pdb.gz looking for model 1 # Found a chain break before 209 # copying to AlignedFragments data structure # naming current conformation RAPTORESS_TS1 # ReadConformPDB reading from PDB file servers/RAPTORESS_TS2.pdb.gz looking for model 1 # Found a chain break before 246 # copying to AlignedFragments data structure # naming current conformation RAPTORESS_TS2 # ReadConformPDB reading from PDB file servers/RAPTORESS_TS3.pdb.gz looking for model 1 # Found a chain break before 263 # copying to AlignedFragments data structure # naming current conformation RAPTORESS_TS3 # ReadConformPDB reading from PDB file servers/RAPTORESS_TS4.pdb.gz looking for model 1 # Found a chain break before 248 # copying to AlignedFragments data structure # naming current conformation RAPTORESS_TS4 # ReadConformPDB reading from PDB file servers/RAPTORESS_TS5.pdb.gz looking for model 1 # Found a chain break before 234 # copying to AlignedFragments data structure # naming current conformation RAPTORESS_TS5 # ReadConformPDB reading from PDB file servers/RAPTOR_TS1.pdb.gz looking for model 1 # Found a chain break before 207 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS1 # ReadConformPDB reading from PDB file servers/RAPTOR_TS2.pdb.gz looking for model 1 # Found a chain break before 96 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS2 # ReadConformPDB reading from PDB file servers/RAPTOR_TS3.pdb.gz looking for model 1 # Found a chain break before 212 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS3 # ReadConformPDB reading from PDB file servers/RAPTOR_TS4.pdb.gz looking for model 1 # Found a chain break before 206 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS4 # ReadConformPDB reading from PDB file servers/RAPTOR_TS5.pdb.gz looking for model 1 # Found a chain break before 280 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS5 # ReadConformPDB reading from PDB file servers/ROBETTA_TS1.pdb.gz looking for model 1 # Found a chain break before 217 # copying to AlignedFragments data structure # naming current conformation ROBETTA_TS1 # ReadConformPDB reading from PDB file servers/ROBETTA_TS2.pdb.gz looking for model 1 # Found a chain break before 177 # copying to AlignedFragments data structure # naming current conformation ROBETTA_TS2 # ReadConformPDB reading from PDB file servers/ROBETTA_TS3.pdb.gz looking for model 1 # Found a chain break before 213 # copying to AlignedFragments data structure # naming current conformation ROBETTA_TS3 # ReadConformPDB reading from PDB file servers/ROBETTA_TS4.pdb.gz looking for model 1 # Found a chain break before 279 # copying to AlignedFragments data structure # naming current conformation ROBETTA_TS4 # ReadConformPDB reading from PDB file servers/ROBETTA_TS5.pdb.gz looking for model 1 # Found a chain break before 177 # copying to AlignedFragments data structure # naming current conformation ROBETTA_TS5 # ReadConformPDB reading from PDB file servers/ROKKY_TS1.pdb.gz looking for model 1 # Found a chain break before 155 # copying to AlignedFragments data structure # naming current conformation ROKKY_TS1 # ReadConformPDB reading from PDB file servers/ROKKY_TS2.pdb.gz looking for model 1 # Found a chain break before 271 # copying to AlignedFragments data structure # naming current conformation ROKKY_TS2 # ReadConformPDB reading from PDB file servers/ROKKY_TS3.pdb.gz looking for model 1 # Found a chain break before 267 # copying to AlignedFragments data structure # naming current conformation ROKKY_TS3 # ReadConformPDB reading from PDB file servers/ROKKY_TS4.pdb.gz looking for model 1 # Found a chain break before 157 # copying to AlignedFragments data structure # naming current conformation ROKKY_TS4 # ReadConformPDB reading from PDB file servers/ROKKY_TS5.pdb.gz looking for model 1 # Found a chain break before 251 # copying to AlignedFragments data structure # naming current conformation ROKKY_TS5 # ReadConformPDB reading from PDB file servers/SAM-T02_AL1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL1 # ReadConformPDB reading from PDB file servers/SAM-T02_AL2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL2 # ReadConformPDB reading from PDB file servers/SAM-T02_AL3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL3 # ReadConformPDB reading from PDB file servers/SAM-T02_AL4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL4 # ReadConformPDB reading from PDB file servers/SAM-T02_AL5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL5 # ReadConformPDB reading from PDB file servers/SAM-T99_AL1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation SAM-T99_AL1 # ReadConformPDB reading from PDB file servers/SAM-T99_AL2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation SAM-T99_AL2 # ReadConformPDB reading from PDB file servers/SAM-T99_AL3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation SAM-T99_AL3 # ReadConformPDB reading from PDB file servers/SAM-T99_AL4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation SAM-T99_AL4 # ReadConformPDB reading from PDB file servers/SAM-T99_AL5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation SAM-T99_AL5 # ReadConformPDB reading from PDB file servers/SAM_T06_server_TS1.pdb.gz looking for model 1 # Found a chain break before 274 # copying to AlignedFragments data structure # naming current conformation SAM_T06_server_TS1 # ReadConformPDB reading from PDB file servers/SAM_T06_server_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation SAM_T06_server_TS2 # ReadConformPDB reading from PDB file servers/SAM_T06_server_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation SAM_T06_server_TS3 # ReadConformPDB reading from PDB file servers/SAM_T06_server_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation SAM_T06_server_TS4 # ReadConformPDB reading from PDB file servers/SAM_T06_server_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation SAM_T06_server_TS5 # ReadConformPDB reading from PDB file servers/SP3_TS1.pdb.gz looking for model 1 # Found a chain break before 221 # copying to AlignedFragments data structure # naming current conformation SP3_TS1 # ReadConformPDB reading from PDB file servers/SP3_TS2.pdb.gz looking for model 1 # Found a chain break before 72 # copying to AlignedFragments data structure # naming current conformation SP3_TS2 # ReadConformPDB reading from PDB file servers/SP3_TS3.pdb.gz looking for model 1 # Found a chain break before 280 # copying to AlignedFragments data structure # naming current conformation SP3_TS3 # ReadConformPDB reading from PDB file servers/SP3_TS4.pdb.gz looking for model 1 # Found a chain break before 280 # copying to AlignedFragments data structure # naming current conformation SP3_TS4 # ReadConformPDB reading from PDB file servers/SP3_TS5.pdb.gz looking for model 1 # Found a chain break before 281 # copying to AlignedFragments data structure # naming current conformation SP3_TS5 # ReadConformPDB reading from PDB file servers/SP4_TS1.pdb.gz looking for model 1 # Found a chain break before 280 # copying to AlignedFragments data structure # naming current conformation SP4_TS1 # ReadConformPDB reading from PDB file servers/SP4_TS2.pdb.gz looking for model 1 # Found a chain break before 279 # copying to AlignedFragments data structure # naming current conformation SP4_TS2 # ReadConformPDB reading from PDB file servers/SP4_TS3.pdb.gz looking for model 1 # Found a chain break before 104 # copying to AlignedFragments data structure # naming current conformation SP4_TS3 # ReadConformPDB reading from PDB file servers/SP4_TS4.pdb.gz looking for model 1 # Found a chain break before 280 # copying to AlignedFragments data structure # naming current conformation SP4_TS4 # ReadConformPDB reading from PDB file servers/SP4_TS5.pdb.gz looking for model 1 # Found a chain break before 172 # copying to AlignedFragments data structure # naming current conformation SP4_TS5 # ReadConformPDB reading from PDB file servers/SPARKS2_TS1.pdb.gz looking for model 1 # Found a chain break before 69 # copying to AlignedFragments data structure # naming current conformation SPARKS2_TS1 # ReadConformPDB reading from PDB file servers/SPARKS2_TS2.pdb.gz looking for model 1 # Found a chain break before 72 # copying to AlignedFragments data structure # naming current conformation SPARKS2_TS2 # ReadConformPDB reading from PDB file servers/SPARKS2_TS3.pdb.gz looking for model 1 # Found a chain break before 174 # copying to AlignedFragments data structure # naming current conformation SPARKS2_TS3 # ReadConformPDB reading from PDB file servers/SPARKS2_TS4.pdb.gz looking for model 1 # Found a chain break before 229 # copying to AlignedFragments data structure # naming current conformation SPARKS2_TS4 # ReadConformPDB reading from PDB file servers/SPARKS2_TS5.pdb.gz looking for model 1 # Found a chain break before 174 # copying to AlignedFragments data structure # naming current conformation SPARKS2_TS5 # ReadConformPDB reading from PDB file servers/UNI-EID_bnmx_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation UNI-EID_bnmx_TS1 # ReadConformPDB reading from PDB file servers/UNI-EID_bnmx_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation UNI-EID_bnmx_TS2 # ReadConformPDB reading from PDB file servers/UNI-EID_bnmx_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation UNI-EID_bnmx_TS3 # ReadConformPDB reading from PDB file servers/UNI-EID_bnmx_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation UNI-EID_bnmx_TS4 # ReadConformPDB reading from PDB file servers/UNI-EID_bnmx_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation UNI-EID_bnmx_TS5 # ReadConformPDB reading from PDB file servers/UNI-EID_expm_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation UNI-EID_expm_TS1 # ReadConformPDB reading from PDB file servers/UNI-EID_sfst_AL1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation UNI-EID_sfst_AL1 # ReadConformPDB reading from PDB file servers/UNI-EID_sfst_AL2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation UNI-EID_sfst_AL2 # ReadConformPDB reading from PDB file servers/UNI-EID_sfst_AL3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation UNI-EID_sfst_AL3 # ReadConformPDB reading from PDB file servers/UNI-EID_sfst_AL4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation UNI-EID_sfst_AL4 # ReadConformPDB reading from PDB file servers/UNI-EID_sfst_AL5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation UNI-EID_sfst_AL5 # ReadConformPDB reading from PDB file servers/Zhang-Server_TS1.pdb.gz looking for model 1 # Found a chain break before 281 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS1 # ReadConformPDB reading from PDB file servers/Zhang-Server_TS2.pdb.gz looking for model 1 # Found a chain break before 281 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS2 # ReadConformPDB reading from PDB file servers/Zhang-Server_TS3.pdb.gz looking for model 1 # Found a chain break before 264 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS3 # ReadConformPDB reading from PDB file servers/Zhang-Server_TS4.pdb.gz looking for model 1 # Found a chain break before 254 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS4 # ReadConformPDB reading from PDB file servers/Zhang-Server_TS5.pdb.gz looking for model 1 # Found a chain break before 281 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS5 # ReadConformPDB reading from PDB file servers/beautshot_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation beautshot_TS1 # ReadConformPDB reading from PDB file servers/beautshotbase_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation beautshotbase_TS1 # ReadConformPDB reading from PDB file servers/forecast-s_AL1.pdb.gz looking for model 1 Skipped atom 79, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL1.pdb.gz Skipped atom 80, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL1.pdb.gz Skipped atom 113, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL1.pdb.gz Skipped atom 126, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL1.pdb.gz Skipped atom 791, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL1.pdb.gz Skipped atom 796, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL1.pdb.gz Skipped atom 921, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL1.pdb.gz Skipped atom 946, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL1.pdb.gz # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation forecast-s_AL1 # ReadConformPDB reading from PDB file servers/forecast-s_AL2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation forecast-s_AL2 # ReadConformPDB reading from PDB file servers/forecast-s_AL3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation forecast-s_AL3 # ReadConformPDB reading from PDB file servers/forecast-s_AL4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation forecast-s_AL4 # ReadConformPDB reading from PDB file servers/forecast-s_AL5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation forecast-s_AL5 # ReadConformPDB reading from PDB file servers/karypis.srv.2_TS1.pdb.gz looking for model 1 # Found a chain break before 160 # copying to AlignedFragments data structure # naming current conformation karypis.srv.2_TS1 # ReadConformPDB reading from PDB file servers/karypis.srv.2_TS2.pdb.gz looking for model 1 # Found a chain break before 279 # copying to AlignedFragments data structure # naming current conformation karypis.srv.2_TS2 # ReadConformPDB reading from PDB file servers/karypis.srv.2_TS3.pdb.gz looking for model 1 # Found a chain break before 243 # copying to AlignedFragments data structure # naming current conformation karypis.srv.2_TS3 # ReadConformPDB reading from PDB file servers/karypis.srv.2_TS4.pdb.gz looking for model 1 # Found a chain break before 141 # copying to AlignedFragments data structure # naming current conformation karypis.srv.2_TS4 # ReadConformPDB reading from PDB file servers/karypis.srv.2_TS5.pdb.gz looking for model 1 # Found a chain break before 266 # copying to AlignedFragments data structure # naming current conformation karypis.srv.2_TS5 # ReadConformPDB reading from PDB file servers/karypis.srv.4_TS1.pdb.gz looking for model 1 WARNING: atoms too close: (T0371)T52.O and (T0371)N53.N only 0.000 apart, marking (T0371)N53.N as missing # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation karypis.srv.4_TS1 # ReadConformPDB reading from PDB file servers/karypis.srv.4_TS2.pdb.gz looking for model 1 WARNING: atoms too close: (T0371)G231.O and (T0371)D232.N only 0.000 apart, marking (T0371)D232.N as missing # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation karypis.srv.4_TS2 # ReadConformPDB reading from PDB file servers/karypis.srv.4_TS3.pdb.gz looking for model 1 WARNING: atoms too close: (T0371)L228.O and (T0371)M229.N only 0.000 apart, marking (T0371)M229.N as missing # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation karypis.srv.4_TS3 # ReadConformPDB reading from PDB file servers/karypis.srv.4_TS4.pdb.gz looking for model 1 # Found a chain break before 281 # copying to AlignedFragments data structure # naming current conformation karypis.srv.4_TS4 # ReadConformPDB reading from PDB file servers/karypis.srv.4_TS5.pdb.gz looking for model 1 # Found a chain break before 280 # copying to AlignedFragments data structure # naming current conformation karypis.srv.4_TS5 # ReadConformPDB reading from PDB file servers/karypis.srv_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation karypis.srv_TS1 # ReadConformPDB reading from PDB file servers/karypis.srv_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation karypis.srv_TS2 # ReadConformPDB reading from PDB file servers/karypis.srv_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation karypis.srv_TS3 # ReadConformPDB reading from PDB file servers/karypis.srv_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation karypis.srv_TS4 # ReadConformPDB reading from PDB file servers/karypis.srv_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation karypis.srv_TS5 # ReadConformPDB reading from PDB file servers/keasar-server_TS1.pdb.gz looking for model 1 # naming current conformation keasar-server_TS1 # ReadConformPDB reading from PDB file servers/keasar-server_TS2.pdb.gz looking for model 1 # naming current conformation keasar-server_TS2 # ReadConformPDB reading from PDB file servers/keasar-server_TS3.pdb.gz looking for model 1 # naming current conformation keasar-server_TS3 # ReadConformPDB reading from PDB file servers/keasar-server_TS4.pdb.gz looking for model 1 # naming current conformation keasar-server_TS4 # ReadConformPDB reading from PDB file servers/keasar-server_TS5.pdb.gz looking for model 1 # naming current conformation keasar-server_TS5 # ReadConformPDB reading from PDB file servers/mGen-3D_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation mGen-3D_TS1 # ReadConformPDB reading from PDB file servers/nFOLD_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation nFOLD_TS1 # ReadConformPDB reading from PDB file servers/nFOLD_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation nFOLD_TS2 # ReadConformPDB reading from PDB file servers/nFOLD_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation nFOLD_TS3 # ReadConformPDB reading from PDB file servers/nFOLD_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation nFOLD_TS4 # ReadConformPDB reading from PDB file servers/nFOLD_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation nFOLD_TS5 # ReadConformPDB reading from PDB file servers/panther2_TS1.pdb.gz looking for model 1 WARNING: atoms too close: (T0371)F72.CA and (T0371)I116.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.O and (T0371)I116.O only 0.000 apart, marking (T0371)I116.O as missing WARNING: atoms too close: (T0371)F72.C and (T0371)I116.C only 0.000 apart, marking (T0371)I116.C as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)K117.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)K117.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.O and (T0371)K117.O only 0.000 apart, marking (T0371)K117.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)K117.O only 0.000 apart, marking (T0371)K117.O as missing WARNING: atoms too close: (T0371)I116.C and (T0371)K117.C only 0.000 apart, marking (T0371)K117.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)K117.C only 0.000 apart, marking (T0371)K117.C as missing WARNING: atoms too close: (T0371)K117.CA and (T0371)M118.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)M118.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)M118.CA only 0.000 apart, marking (T0371)M118.CA as missing WARNING: atoms too close: (T0371)K117.O and (T0371)M118.O only 0.000 apart, marking (T0371)M118.O as missing WARNING: atoms too close: (T0371)I116.O and (T0371)M118.O only 0.000 apart, marking (T0371)M118.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)M118.O only 0.000 apart, marking (T0371)M118.O as missing WARNING: atoms too close: (T0371)K117.C and (T0371)M118.C only 0.000 apart, marking (T0371)M118.C as missing WARNING: atoms too close: (T0371)I116.C and (T0371)M118.C only 0.000 apart, marking (T0371)M118.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)M118.C only 0.000 apart, marking (T0371)M118.C as missing WARNING: atoms too close: (T0371)M118.CA and (T0371)L119.CA only 0.000 apart, marking (T0371)M118.CA as missing WARNING: atoms too close: (T0371)K117.CA and (T0371)L119.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)L119.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)L119.CA only 0.000 apart, marking (T0371)L119.CA as missing WARNING: atoms too close: (T0371)M118.O and (T0371)L119.O only 0.000 apart, marking (T0371)L119.O as missing WARNING: atoms too close: (T0371)K117.O and (T0371)L119.O only 0.000 apart, marking (T0371)L119.O as missing WARNING: atoms too close: (T0371)I116.O and (T0371)L119.O only 0.000 apart, marking (T0371)L119.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)L119.O only 0.000 apart, marking (T0371)L119.O as missing WARNING: atoms too close: (T0371)M118.C and (T0371)L119.C only 0.000 apart, marking (T0371)L119.C as missing WARNING: atoms too close: (T0371)K117.C and (T0371)L119.C only 0.000 apart, marking (T0371)L119.C as missing WARNING: atoms too close: (T0371)I116.C and (T0371)L119.C only 0.000 apart, marking (T0371)L119.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)L119.C only 0.000 apart, marking (T0371)L119.C as missing WARNING: atoms too close: (T0371)L119.CA and (T0371)P120.CA only 0.000 apart, marking (T0371)L119.CA as missing WARNING: atoms too close: (T0371)M118.CA and (T0371)P120.CA only 0.000 apart, marking (T0371)M118.CA as missing WARNING: atoms too close: (T0371)K117.CA and (T0371)P120.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)P120.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)P120.CA only 0.000 apart, marking (T0371)P120.CA as missing WARNING: atoms too close: (T0371)L119.O and (T0371)P120.O only 0.000 apart, marking (T0371)P120.O as missing WARNING: atoms too close: (T0371)M118.O and (T0371)P120.O only 0.000 apart, marking (T0371)P120.O as missing WARNING: atoms too close: (T0371)K117.O and (T0371)P120.O only 0.000 apart, marking (T0371)P120.O as missing WARNING: atoms too close: (T0371)I116.O and (T0371)P120.O only 0.000 apart, marking (T0371)P120.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)P120.O only 0.000 apart, marking (T0371)P120.O as missing WARNING: atoms too close: (T0371)L119.C and (T0371)P120.C only 0.000 apart, marking (T0371)P120.C as missing WARNING: atoms too close: (T0371)M118.C and (T0371)P120.C only 0.000 apart, marking (T0371)P120.C as missing WARNING: atoms too close: (T0371)K117.C and (T0371)P120.C only 0.000 apart, marking (T0371)P120.C as missing WARNING: atoms too close: (T0371)I116.C and (T0371)P120.C only 0.000 apart, marking (T0371)P120.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)P120.C only 0.000 apart, marking (T0371)P120.C as missing WARNING: atoms too close: (T0371)P120.CA and (T0371)V121.CA only 0.000 apart, marking (T0371)P120.CA as missing WARNING: atoms too close: (T0371)L119.CA and (T0371)V121.CA only 0.000 apart, marking (T0371)L119.CA as missing WARNING: atoms too close: (T0371)M118.CA and (T0371)V121.CA only 0.000 apart, marking (T0371)M118.CA as missing WARNING: atoms too close: (T0371)K117.CA and (T0371)V121.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)V121.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)V121.CA only 0.000 apart, marking (T0371)V121.CA as missing WARNING: atoms too close: (T0371)P120.O and (T0371)V121.O only 0.000 apart, marking (T0371)V121.O as missing WARNING: atoms too close: (T0371)L119.O and (T0371)V121.O only 0.000 apart, marking (T0371)V121.O as missing WARNING: atoms too close: (T0371)M118.O and (T0371)V121.O only 0.000 apart, marking (T0371)V121.O as missing WARNING: atoms too close: (T0371)K117.O and (T0371)V121.O only 0.000 apart, marking (T0371)V121.O as missing WARNING: atoms too close: (T0371)I116.O and (T0371)V121.O only 0.000 apart, marking (T0371)V121.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)V121.O only 0.000 apart, marking (T0371)V121.O as missing WARNING: atoms too close: (T0371)P120.C and (T0371)V121.C only 0.000 apart, marking (T0371)V121.C as missing WARNING: atoms too close: (T0371)L119.C and (T0371)V121.C only 0.000 apart, marking (T0371)V121.C as missing WARNING: atoms too close: (T0371)M118.C and (T0371)V121.C only 0.000 apart, marking (T0371)V121.C as missing WARNING: atoms too close: (T0371)K117.C and (T0371)V121.C only 0.000 apart, marking (T0371)V121.C as missing WARNING: atoms too close: (T0371)I116.C and (T0371)V121.C only 0.000 apart, marking (T0371)V121.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)V121.C only 0.000 apart, marking (T0371)V121.C as missing WARNING: atoms too close: (T0371)V121.CA and (T0371)I129.CA only 0.000 apart, marking (T0371)V121.CA as missing WARNING: atoms too close: (T0371)P120.CA and (T0371)I129.CA only 0.000 apart, marking (T0371)P120.CA as missing WARNING: atoms too close: (T0371)L119.CA and (T0371)I129.CA only 0.000 apart, marking (T0371)L119.CA as missing WARNING: atoms too close: (T0371)M118.CA and (T0371)I129.CA only 0.000 apart, marking (T0371)M118.CA as missing WARNING: atoms too close: (T0371)K117.CA and (T0371)I129.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)I129.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)I129.CA only 0.000 apart, marking (T0371)I129.CA as missing WARNING: atoms too close: (T0371)V121.O and (T0371)I129.O only 0.000 apart, marking (T0371)I129.O as missing WARNING: atoms too close: (T0371)P120.O and (T0371)I129.O only 0.000 apart, marking (T0371)I129.O as missing WARNING: atoms too close: (T0371)L119.O and (T0371)I129.O only 0.000 apart, marking (T0371)I129.O as missing WARNING: atoms too close: (T0371)M118.O and (T0371)I129.O only 0.000 apart, marking (T0371)I129.O as missing WARNING: atoms too close: (T0371)K117.O and (T0371)I129.O only 0.000 apart, marking (T0371)I129.O as missing WARNING: atoms too close: (T0371)I116.O and (T0371)I129.O only 0.000 apart, marking (T0371)I129.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)I129.O only 0.000 apart, marking (T0371)I129.O as missing WARNING: atoms too close: (T0371)V121.C and (T0371)I129.C only 0.000 apart, marking (T0371)I129.C as missing WARNING: atoms too close: (T0371)P120.C and (T0371)I129.C only 0.000 apart, marking (T0371)I129.C as missing WARNING: atoms too close: (T0371)L119.C and (T0371)I129.C only 0.000 apart, marking (T0371)I129.C as missing WARNING: atoms too close: (T0371)M118.C and (T0371)I129.C only 0.000 apart, marking (T0371)I129.C as missing WARNING: atoms too close: (T0371)K117.C and (T0371)I129.C only 0.000 apart, marking (T0371)I129.C as missing WARNING: atoms too close: (T0371)I116.C and (T0371)I129.C only 0.000 apart, marking (T0371)I129.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)I129.C only 0.000 apart, marking (T0371)I129.C as missing WARNING: atoms too close: (T0371)I129.CA and (T0371)G130.CA only 0.000 apart, marking (T0371)I129.CA as missing WARNING: atoms too close: (T0371)V121.CA and (T0371)G130.CA only 0.000 apart, marking (T0371)V121.CA as missing WARNING: atoms too close: (T0371)P120.CA and (T0371)G130.CA only 0.000 apart, marking (T0371)P120.CA as missing WARNING: atoms too close: (T0371)L119.CA and (T0371)G130.CA only 0.000 apart, marking (T0371)L119.CA as missing WARNING: atoms too close: (T0371)M118.CA and (T0371)G130.CA only 0.000 apart, marking (T0371)M118.CA as missing WARNING: atoms too close: (T0371)K117.CA and (T0371)G130.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)G130.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)G130.CA only 0.000 apart, marking (T0371)G130.CA as missing WARNING: atoms too close: (T0371)I129.O and (T0371)G130.O only 0.000 apart, marking (T0371)G130.O as missing WARNING: atoms too close: (T0371)V121.O and (T0371)G130.O only 0.000 apart, marking (T0371)G130.O as missing WARNING: atoms too close: (T0371)P120.O and (T0371)G130.O only 0.000 apart, marking (T0371)G130.O as missing WARNING: atoms too close: (T0371)L119.O and (T0371)G130.O only 0.000 apart, marking (T0371)G130.O as missing WARNING: atoms too close: (T0371)M118.O and (T0371)G130.O only 0.000 apart, marking (T0371)G130.O as missing WARNING: atoms too close: (T0371)K117.O and (T0371)G130.O only 0.000 apart, marking (T0371)G130.O as missing WARNING: atoms too close: (T0371)I116.O and (T0371)G130.O only 0.000 apart, marking (T0371)G130.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)G130.O only 0.000 apart, marking (T0371)G130.O as missing WARNING: atoms too close: (T0371)I129.C and (T0371)G130.C only 0.000 apart, marking (T0371)G130.C as missing WARNING: atoms too close: (T0371)V121.C and (T0371)G130.C only 0.000 apart, marking (T0371)G130.C as missing WARNING: atoms too close: (T0371)P120.C and (T0371)G130.C only 0.000 apart, marking (T0371)G130.C as missing WARNING: atoms too close: (T0371)L119.C and (T0371)G130.C only 0.000 apart, marking (T0371)G130.C as missing WARNING: atoms too close: (T0371)M118.C and (T0371)G130.C only 0.000 apart, marking (T0371)G130.C as missing WARNING: atoms too close: (T0371)K117.C and (T0371)G130.C only 0.000 apart, marking (T0371)G130.C as missing WARNING: atoms too close: (T0371)I116.C and (T0371)G130.C only 0.000 apart, marking (T0371)G130.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)G130.C only 0.000 apart, marking (T0371)G130.C as missing WARNING: atoms too close: (T0371)G130.CA and (T0371)E131.CA only 0.000 apart, marking (T0371)G130.CA as missing WARNING: atoms too close: (T0371)I129.CA and (T0371)E131.CA only 0.000 apart, marking (T0371)I129.CA as missing WARNING: atoms too close: (T0371)V121.CA and (T0371)E131.CA only 0.000 apart, marking (T0371)V121.CA as missing WARNING: atoms too close: (T0371)P120.CA and (T0371)E131.CA only 0.000 apart, marking (T0371)P120.CA as missing WARNING: atoms too close: (T0371)L119.CA and (T0371)E131.CA only 0.000 apart, marking (T0371)L119.CA as missing WARNING: atoms too close: (T0371)M118.CA and (T0371)E131.CA only 0.000 apart, marking (T0371)M118.CA as missing WARNING: atoms too close: (T0371)K117.CA and (T0371)E131.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)E131.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)E131.CA only 0.000 apart, marking (T0371)E131.CA as missing WARNING: atoms too close: (T0371)G130.O and (T0371)E131.O only 0.000 apart, marking (T0371)E131.O as missing WARNING: atoms too close: (T0371)I129.O and (T0371)E131.O only 0.000 apart, marking (T0371)E131.O as missing WARNING: atoms too close: (T0371)V121.O and (T0371)E131.O only 0.000 apart, marking (T0371)E131.O as missing WARNING: atoms too close: (T0371)P120.O and (T0371)E131.O only 0.000 apart, marking (T0371)E131.O as missing WARNING: atoms too close: (T0371)L119.O and (T0371)E131.O only 0.000 apart, marking (T0371)E131.O as missing WARNING: atoms too close: (T0371)M118.O and (T0371)E131.O only 0.000 apart, marking (T0371)E131.O as missing WARNING: atoms too close: (T0371)K117.O and (T0371)E131.O only 0.000 apart, marking (T0371)E131.O as missing WARNING: atoms too close: (T0371)I116.O and (T0371)E131.O only 0.000 apart, marking (T0371)E131.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)E131.O only 0.000 apart, marking (T0371)E131.O as missing WARNING: atoms too close: (T0371)G130.C and (T0371)E131.C only 0.000 apart, marking (T0371)E131.C as missing WARNING: atoms too close: (T0371)I129.C and (T0371)E131.C only 0.000 apart, marking (T0371)E131.C as missing WARNING: atoms too close: (T0371)V121.C and (T0371)E131.C only 0.000 apart, marking (T0371)E131.C as missing WARNING: atoms too close: (T0371)P120.C and (T0371)E131.C only 0.000 apart, marking (T0371)E131.C as missing WARNING: atoms too close: (T0371)L119.C and (T0371)E131.C only 0.000 apart, marking (T0371)E131.C as missing WARNING: atoms too close: (T0371)M118.C and (T0371)E131.C only 0.000 apart, marking (T0371)E131.C as missing WARNING: atoms too close: (T0371)K117.C and (T0371)E131.C only 0.000 apart, marking (T0371)E131.C as missing WARNING: atoms too close: (T0371)I116.C and (T0371)E131.C only 0.000 apart, marking (T0371)E131.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)E131.C only 0.000 apart, marking (T0371)E131.C as missing WARNING: atoms too close: (T0371)E131.CA and (T0371)W145.CA only 0.000 apart, marking (T0371)E131.CA as missing WARNING: atoms too close: (T0371)G130.CA and (T0371)W145.CA only 0.000 apart, marking (T0371)G130.CA as missing WARNING: atoms too close: (T0371)I129.CA and (T0371)W145.CA only 0.000 apart, marking (T0371)I129.CA as missing WARNING: atoms too close: (T0371)V121.CA and (T0371)W145.CA only 0.000 apart, marking (T0371)V121.CA as missing WARNING: atoms too close: (T0371)P120.CA and (T0371)W145.CA only 0.000 apart, marking (T0371)P120.CA as missing WARNING: atoms too close: (T0371)L119.CA and (T0371)W145.CA only 0.000 apart, marking (T0371)L119.CA as missing WARNING: atoms too close: (T0371)M118.CA and (T0371)W145.CA only 0.000 apart, marking (T0371)M118.CA as missing WARNING: atoms too close: (T0371)K117.CA and (T0371)W145.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)W145.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)W145.CA only 0.000 apart, marking (T0371)W145.CA as missing WARNING: atoms too close: (T0371)E131.O and (T0371)W145.O only 0.000 apart, marking (T0371)W145.O as missing WARNING: atoms too close: (T0371)G130.O and (T0371)W145.O only 0.000 apart, marking (T0371)W145.O as missing WARNING: atoms too close: (T0371)I129.O and (T0371)W145.O only 0.000 apart, marking (T0371)W145.O as missing WARNING: atoms too close: (T0371)V121.O and (T0371)W145.O only 0.000 apart, marking (T0371)W145.O as missing WARNING: atoms too close: (T0371)P120.O and (T0371)W145.O only 0.000 apart, marking (T0371)W145.O as missing WARNING: atoms too close: (T0371)L119.O and (T0371)W145.O only 0.000 apart, marking (T0371)W145.O as missing WARNING: atoms too close: (T0371)M118.O and (T0371)W145.O only 0.000 apart, marking (T0371)W145.O as missing WARNING: atoms too close: (T0371)K117.O and (T0371)W145.O only 0.000 apart, marking (T0371)W145.O as missing WARNING: atoms too close: (T0371)I116.O and (T0371)W145.O only 0.000 apart, marking (T0371)W145.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)W145.O only 0.000 apart, marking (T0371)W145.O as missing WARNING: atoms too close: (T0371)E131.C and (T0371)W145.C only 0.000 apart, marking (T0371)W145.C as missing WARNING: atoms too close: (T0371)G130.C and (T0371)W145.C only 0.000 apart, marking (T0371)W145.C as missing WARNING: atoms too close: (T0371)I129.C and (T0371)W145.C only 0.000 apart, marking (T0371)W145.C as missing WARNING: atoms too close: (T0371)V121.C and (T0371)W145.C only 0.000 apart, marking (T0371)W145.C as missing WARNING: atoms too close: (T0371)P120.C and (T0371)W145.C only 0.000 apart, marking (T0371)W145.C as missing WARNING: atoms too close: (T0371)L119.C and (T0371)W145.C only 0.000 apart, marking (T0371)W145.C as missing WARNING: atoms too close: (T0371)M118.C and (T0371)W145.C only 0.000 apart, marking (T0371)W145.C as missing WARNING: atoms too close: (T0371)K117.C and (T0371)W145.C only 0.000 apart, marking (T0371)W145.C as missing WARNING: atoms too close: (T0371)I116.C and (T0371)W145.C only 0.000 apart, marking (T0371)W145.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)W145.C only 0.000 apart, marking (T0371)W145.C as missing WARNING: atoms too close: (T0371)W145.CA and (T0371)P162.CA only 0.000 apart, marking (T0371)W145.CA as missing WARNING: atoms too close: (T0371)E131.CA and (T0371)P162.CA only 0.000 apart, marking (T0371)E131.CA as missing WARNING: atoms too close: (T0371)G130.CA and (T0371)P162.CA only 0.000 apart, marking (T0371)G130.CA as missing WARNING: atoms too close: (T0371)I129.CA and (T0371)P162.CA only 0.000 apart, marking (T0371)I129.CA as missing WARNING: atoms too close: (T0371)V121.CA and (T0371)P162.CA only 0.000 apart, marking (T0371)V121.CA as missing WARNING: atoms too close: (T0371)P120.CA and (T0371)P162.CA only 0.000 apart, marking (T0371)P120.CA as missing WARNING: atoms too close: (T0371)L119.CA and (T0371)P162.CA only 0.000 apart, marking (T0371)L119.CA as missing WARNING: atoms too close: (T0371)M118.CA and (T0371)P162.CA only 0.000 apart, marking (T0371)M118.CA as missing WARNING: atoms too close: (T0371)K117.CA and (T0371)P162.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)P162.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)P162.CA only 0.000 apart, marking (T0371)P162.CA as missing WARNING: atoms too close: (T0371)W145.O and (T0371)P162.O only 0.000 apart, marking (T0371)P162.O as missing WARNING: atoms too close: (T0371)E131.O and (T0371)P162.O only 0.000 apart, marking (T0371)P162.O as missing WARNING: atoms too close: (T0371)G130.O and (T0371)P162.O only 0.000 apart, marking (T0371)P162.O as missing WARNING: atoms too close: (T0371)I129.O and (T0371)P162.O only 0.000 apart, marking (T0371)P162.O as missing WARNING: atoms too close: (T0371)V121.O and (T0371)P162.O only 0.000 apart, marking (T0371)P162.O as missing WARNING: atoms too close: (T0371)P120.O and (T0371)P162.O only 0.000 apart, marking (T0371)P162.O as missing WARNING: atoms too close: (T0371)L119.O and (T0371)P162.O only 0.000 apart, marking (T0371)P162.O as missing WARNING: atoms too close: (T0371)M118.O and (T0371)P162.O only 0.000 apart, marking (T0371)P162.O as missing WARNING: atoms too close: (T0371)K117.O and (T0371)P162.O only 0.000 apart, marking (T0371)P162.O as missing WARNING: atoms too close: (T0371)I116.O and (T0371)P162.O only 0.000 apart, marking (T0371)P162.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)P162.O only 0.000 apart, marking (T0371)P162.O as missing WARNING: atoms too close: (T0371)W145.C and (T0371)P162.C only 0.000 apart, marking (T0371)P162.C as missing WARNING: atoms too close: (T0371)E131.C and (T0371)P162.C only 0.000 apart, marking (T0371)P162.C as missing WARNING: atoms too close: (T0371)G130.C and (T0371)P162.C only 0.000 apart, marking (T0371)P162.C as missing WARNING: atoms too close: (T0371)I129.C and (T0371)P162.C only 0.000 apart, marking (T0371)P162.C as missing WARNING: atoms too close: (T0371)V121.C and (T0371)P162.C only 0.000 apart, marking (T0371)P162.C as missing WARNING: atoms too close: (T0371)P120.C and (T0371)P162.C only 0.000 apart, marking (T0371)P162.C as missing WARNING: atoms too close: (T0371)L119.C and (T0371)P162.C only 0.000 apart, marking (T0371)P162.C as missing WARNING: atoms too close: (T0371)M118.C and (T0371)P162.C only 0.000 apart, marking (T0371)P162.C as missing WARNING: atoms too close: (T0371)K117.C and (T0371)P162.C only 0.000 apart, marking (T0371)P162.C as missing WARNING: atoms too close: (T0371)I116.C and (T0371)P162.C only 0.000 apart, marking (T0371)P162.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)P162.C only 0.000 apart, marking (T0371)P162.C as missing WARNING: atoms too close: (T0371)P162.CA and (T0371)L174.CA only 0.000 apart, marking (T0371)P162.CA as missing WARNING: atoms too close: (T0371)W145.CA and (T0371)L174.CA only 0.000 apart, marking (T0371)W145.CA as missing WARNING: atoms too close: (T0371)E131.CA and (T0371)L174.CA only 0.000 apart, marking (T0371)E131.CA as missing WARNING: atoms too close: (T0371)G130.CA and (T0371)L174.CA only 0.000 apart, marking (T0371)G130.CA as missing WARNING: atoms too close: (T0371)I129.CA and (T0371)L174.CA only 0.000 apart, marking (T0371)I129.CA as missing WARNING: atoms too close: (T0371)V121.CA and (T0371)L174.CA only 0.000 apart, marking (T0371)V121.CA as missing WARNING: atoms too close: (T0371)P120.CA and (T0371)L174.CA only 0.000 apart, marking (T0371)P120.CA as missing WARNING: atoms too close: (T0371)L119.CA and (T0371)L174.CA only 0.000 apart, marking (T0371)L119.CA as missing WARNING: atoms too close: (T0371)M118.CA and (T0371)L174.CA only 0.000 apart, marking (T0371)M118.CA as missing WARNING: atoms too close: (T0371)K117.CA and (T0371)L174.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)L174.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)L174.CA only 0.000 apart, marking (T0371)L174.CA as missing WARNING: atoms too close: (T0371)P162.O and (T0371)L174.O only 0.000 apart, marking (T0371)L174.O as missing WARNING: atoms too close: (T0371)W145.O and (T0371)L174.O only 0.000 apart, marking (T0371)L174.O as missing WARNING: atoms too close: (T0371)E131.O and (T0371)L174.O only 0.000 apart, marking (T0371)L174.O as missing WARNING: atoms too close: (T0371)G130.O and (T0371)L174.O only 0.000 apart, marking (T0371)L174.O as missing WARNING: atoms too close: (T0371)I129.O and (T0371)L174.O only 0.000 apart, marking (T0371)L174.O as missing WARNING: atoms too close: (T0371)V121.O and (T0371)L174.O only 0.000 apart, marking (T0371)L174.O as missing WARNING: atoms too close: (T0371)P120.O and (T0371)L174.O only 0.000 apart, marking (T0371)L174.O as missing WARNING: atoms too close: (T0371)L119.O and (T0371)L174.O only 0.000 apart, marking (T0371)L174.O as missing WARNING: atoms too close: (T0371)M118.O and (T0371)L174.O only 0.000 apart, marking (T0371)L174.O as missing WARNING: atoms too close: (T0371)K117.O and (T0371)L174.O only 0.000 apart, marking (T0371)L174.O as missing WARNING: atoms too close: (T0371)I116.O and (T0371)L174.O only 0.000 apart, marking (T0371)L174.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)L174.O only 0.000 apart, marking (T0371)L174.O as missing WARNING: atoms too close: (T0371)P162.C and (T0371)L174.C only 0.000 apart, marking (T0371)L174.C as missing WARNING: atoms too close: (T0371)W145.C and (T0371)L174.C only 0.000 apart, marking (T0371)L174.C as missing WARNING: atoms too close: (T0371)E131.C and (T0371)L174.C only 0.000 apart, marking (T0371)L174.C as missing WARNING: atoms too close: (T0371)G130.C and (T0371)L174.C only 0.000 apart, marking (T0371)L174.C as missing WARNING: atoms too close: (T0371)I129.C and (T0371)L174.C only 0.000 apart, marking (T0371)L174.C as missing WARNING: atoms too close: (T0371)V121.C and (T0371)L174.C only 0.000 apart, marking (T0371)L174.C as missing WARNING: atoms too close: (T0371)P120.C and (T0371)L174.C only 0.000 apart, marking (T0371)L174.C as missing WARNING: atoms too close: (T0371)L119.C and (T0371)L174.C only 0.000 apart, marking (T0371)L174.C as missing WARNING: atoms too close: (T0371)M118.C and (T0371)L174.C only 0.000 apart, marking (T0371)L174.C as missing WARNING: atoms too close: (T0371)K117.C and (T0371)L174.C only 0.000 apart, marking (T0371)L174.C as missing WARNING: atoms too close: (T0371)I116.C and (T0371)L174.C only 0.000 apart, marking (T0371)L174.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)L174.C only 0.000 apart, marking (T0371)L174.C as missing WARNING: atoms too close: (T0371)L174.CA and (T0371)F209.CA only 0.000 apart, marking (T0371)L174.CA as missing WARNING: atoms too close: (T0371)P162.CA and (T0371)F209.CA only 0.000 apart, marking (T0371)P162.CA as missing WARNING: atoms too close: (T0371)W145.CA and (T0371)F209.CA only 0.000 apart, marking (T0371)W145.CA as missing WARNING: atoms too close: (T0371)E131.CA and (T0371)F209.CA only 0.000 apart, marking (T0371)E131.CA as missing WARNING: atoms too close: (T0371)G130.CA and (T0371)F209.CA only 0.000 apart, marking (T0371)G130.CA as missing WARNING: atoms too close: (T0371)I129.CA and (T0371)F209.CA only 0.000 apart, marking (T0371)I129.CA as missing WARNING: atoms too close: (T0371)V121.CA and (T0371)F209.CA only 0.000 apart, marking (T0371)V121.CA as missing WARNING: atoms too close: (T0371)P120.CA and (T0371)F209.CA only 0.000 apart, marking (T0371)P120.CA as missing WARNING: atoms too close: (T0371)L119.CA and (T0371)F209.CA only 0.000 apart, marking (T0371)L119.CA as missing WARNING: atoms too close: (T0371)M118.CA and (T0371)F209.CA only 0.000 apart, marking (T0371)M118.CA as missing WARNING: atoms too close: (T0371)K117.CA and (T0371)F209.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)F209.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)F209.CA only 0.000 apart, marking (T0371)F209.CA as missing WARNING: atoms too close: (T0371)L174.O and (T0371)F209.O only 0.000 apart, marking (T0371)F209.O as missing WARNING: atoms too close: (T0371)P162.O and (T0371)F209.O only 0.000 apart, marking (T0371)F209.O as missing WARNING: atoms too close: (T0371)W145.O and (T0371)F209.O only 0.000 apart, marking (T0371)F209.O as missing WARNING: atoms too close: (T0371)E131.O and (T0371)F209.O only 0.000 apart, marking (T0371)F209.O as missing WARNING: atoms too close: (T0371)G130.O and (T0371)F209.O only 0.000 apart, marking (T0371)F209.O as missing WARNING: atoms too close: (T0371)I129.O and (T0371)F209.O only 0.000 apart, marking (T0371)F209.O as missing WARNING: atoms too close: (T0371)V121.O and (T0371)F209.O only 0.000 apart, marking (T0371)F209.O as missing WARNING: atoms too close: (T0371)P120.O and (T0371)F209.O only 0.000 apart, marking (T0371)F209.O as missing WARNING: atoms too close: (T0371)L119.O and (T0371)F209.O only 0.000 apart, marking (T0371)F209.O as missing WARNING: atoms too close: (T0371)M118.O and (T0371)F209.O only 0.000 apart, marking (T0371)F209.O as missing WARNING: atoms too close: (T0371)K117.O and (T0371)F209.O only 0.000 apart, marking (T0371)F209.O as missing WARNING: atoms too close: (T0371)I116.O and (T0371)F209.O only 0.000 apart, marking (T0371)F209.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)F209.O only 0.000 apart, marking (T0371)F209.O as missing WARNING: atoms too close: (T0371)L174.C and (T0371)F209.C only 0.000 apart, marking (T0371)F209.C as missing WARNING: atoms too close: (T0371)P162.C and (T0371)F209.C only 0.000 apart, marking (T0371)F209.C as missing WARNING: atoms too close: (T0371)W145.C and (T0371)F209.C only 0.000 apart, marking (T0371)F209.C as missing WARNING: atoms too close: (T0371)E131.C and (T0371)F209.C only 0.000 apart, marking (T0371)F209.C as missing WARNING: atoms too close: (T0371)G130.C and (T0371)F209.C only 0.000 apart, marking (T0371)F209.C as missing WARNING: atoms too close: (T0371)I129.C and (T0371)F209.C only 0.000 apart, marking (T0371)F209.C as missing WARNING: atoms too close: (T0371)V121.C and (T0371)F209.C only 0.000 apart, marking (T0371)F209.C as missing WARNING: atoms too close: (T0371)P120.C and (T0371)F209.C only 0.000 apart, marking (T0371)F209.C as missing WARNING: atoms too close: (T0371)L119.C and (T0371)F209.C only 0.000 apart, marking (T0371)F209.C as missing WARNING: atoms too close: (T0371)M118.C and (T0371)F209.C only 0.000 apart, marking (T0371)F209.C as missing WARNING: atoms too close: (T0371)K117.C and (T0371)F209.C only 0.000 apart, marking (T0371)F209.C as missing WARNING: atoms too close: (T0371)I116.C and (T0371)F209.C only 0.000 apart, marking (T0371)F209.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)F209.C only 0.000 apart, marking (T0371)F209.C as missing WARNING: atoms too close: (T0371)F209.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)F209.CA as missing WARNING: atoms too close: (T0371)L174.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)L174.CA as missing WARNING: atoms too close: (T0371)P162.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)P162.CA as missing WARNING: atoms too close: (T0371)W145.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)W145.CA as missing WARNING: atoms too close: (T0371)E131.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)E131.CA as missing WARNING: atoms too close: (T0371)G130.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)G130.CA as missing WARNING: atoms too close: (T0371)I129.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)I129.CA as missing WARNING: atoms too close: (T0371)V121.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)V121.CA as missing WARNING: atoms too close: (T0371)P120.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)P120.CA as missing WARNING: atoms too close: (T0371)L119.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)L119.CA as missing WARNING: atoms too close: (T0371)M118.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)M118.CA as missing WARNING: atoms too close: (T0371)K117.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)M210.CA as missing WARNING: atoms too close: (T0371)F209.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)L174.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)P162.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)W145.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)E131.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)G130.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)I129.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)V121.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)P120.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)L119.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)M118.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)K117.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)I116.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)F209.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing WARNING: atoms too close: (T0371)L174.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing WARNING: atoms too close: (T0371)P162.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing WARNING: atoms too close: (T0371)W145.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing WARNING: atoms too close: (T0371)E131.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing WARNING: atoms too close: (T0371)G130.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing WARNING: atoms too close: (T0371)I129.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing WARNING: atoms too close: (T0371)V121.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing WARNING: atoms too close: (T0371)P120.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing WARNING: atoms too close: (T0371)L119.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing WARNING: atoms too close: (T0371)M118.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing WARNING: atoms too close: (T0371)K117.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing WARNING: atoms too close: (T0371)I116.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing WARNING: atoms too close: (T0371)M210.CA and (T0371)F211.CA only 0.000 apart, marking (T0371)M210.CA as missing WARNING: atoms too close: (T0371)F209.CA and (T0371)F211.CA only 0.000 apart, marking (T0371)F209.CA as missing WARNING: atoms too close: (T0371)L174.CA and (T0371)F211.CA only 0.000 apart, marking (T0371)L174.CA as missing WARNING: atoms too close: (T0371)P162.CA and (T0371)F211.CA only 0.000 apart, marking (T0371)P162.CA as missing WARNING: atoms too close: (T0371)W145.CA and (T0371)F211.CA only 0.000 apart, marking (T0371)W145.CA as missing WARNING: atoms too close: (T0371)E131.CA and (T0371)F211.CA only 0.000 apart, marking (T0371)E131.CA as missing WARNING: atoms too close: (T0371)G130.CA and (T0371)F211.CA only 0.000 apart, marking (T0371)G130.CA as missing WARNING: atoms too close: (T0371)I129.CA and (T0371)F211.CA only 0.000 apart, marking (T0371)I129.CA as missing WARNING: atoms too close: (T0371)V121.CA and (T0371)F211.CA only 0.000 apart, marking (T0371)V121.CA as missing WARNING: atoms too close: (T0371)P120.CA and (T0371)F211.CA only 0.000 apart, marking (T0371)P120.CA as missing WARNING: atoms too close: (T0371)L119.CA and (T0371)F211.CA only 0.000 apart, marking (T0371)L119.CA as missing WARNING: atoms too close: (T0371)M118.CA and (T0371)F211.CA only 0.000 apart, marking (T0371)M118.CA as missing WARNING: atoms too close: (T0371)K117.CA and (T0371)F211.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)F211.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)F211.CA only 0.000 apart, marking (T0371)F211.CA as missing WARNING: atoms too close: (T0371)M210.O and (T0371)F211.O only 0.000 apart, marking (T0371)F211.O as missing WARNING: atoms too close: (T0371)F209.O and (T0371)F211.O only 0.000 apart, marking (T0371)F211.O as missing WARNING: atoms too close: (T0371)L174.O and (T0371)F211.O only 0.000 apart, marking (T0371)F211.O as missing WARNING: atoms too close: (T0371)P162.O and (T0371)F211.O only 0.000 apart, marking (T0371)F211.O as missing WARNING: atoms too close: (T0371)W145.O and (T0371)F211.O only 0.000 apart, marking (T0371)F211.O as missing WARNING: atoms too close: (T0371)E131.O and (T0371)F211.O only 0.000 apart, marking (T0371)F211.O as missing WARNING: atoms too close: (T0371)G130.O and (T0371)F211.O only 0.000 apart, marking (T0371)F211.O as missing WARNING: atoms too close: (T0371)I129.O and (T0371)F211.O only 0.000 apart, marking (T0371)F211.O as missing WARNING: atoms too close: (T0371)V121.O and (T0371)F211.O only 0.000 apart, marking (T0371)F211.O as missing WARNING: atoms too close: (T0371)P120.O and (T0371)F211.O only 0.000 apart, marking (T0371)F211.O as missing WARNING: atoms too close: (T0371)L119.O and (T0371)F211.O only 0.000 apart, marking (T0371)F211.O as missing WARNING: atoms too close: (T0371)M118.O and (T0371)F211.O only 0.000 apart, marking (T0371)F211.O as missing WARNING: atoms too close: (T0371)K117.O and (T0371)F211.O only 0.000 apart, marking (T0371)F211.O as missing WARNING: atoms too close: (T0371)I116.O and (T0371)F211.O only 0.000 apart, marking (T0371)F211.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)F211.O only 0.000 apart, marking (T0371)F211.O as missing WARNING: atoms too close: (T0371)M210.C and (T0371)F211.C only 0.000 apart, marking (T0371)F211.C as missing WARNING: atoms too close: (T0371)F209.C and (T0371)F211.C only 0.000 apart, marking (T0371)F211.C as missing WARNING: atoms too close: (T0371)L174.C and (T0371)F211.C only 0.000 apart, marking (T0371)F211.C as missing WARNING: atoms too close: (T0371)P162.C and (T0371)F211.C only 0.000 apart, marking (T0371)F211.C as missing WARNING: atoms too close: (T0371)W145.C and (T0371)F211.C only 0.000 apart, marking (T0371)F211.C as missing WARNING: atoms too close: (T0371)E131.C and (T0371)F211.C only 0.000 apart, marking (T0371)F211.C as missing WARNING: atoms too close: (T0371)G130.C and (T0371)F211.C only 0.000 apart, marking (T0371)F211.C as missing WARNING: atoms too close: (T0371)I129.C and (T0371)F211.C only 0.000 apart, marking (T0371)F211.C as missing WARNING: atoms too close: (T0371)V121.C and (T0371)F211.C only 0.000 apart, marking (T0371)F211.C as missing WARNING: atoms too close: (T0371)P120.C and (T0371)F211.C only 0.000 apart, marking (T0371)F211.C as missing WARNING: atoms too close: (T0371)L119.C and (T0371)F211.C only 0.000 apart, marking (T0371)F211.C as missing WARNING: atoms too close: (T0371)M118.C and (T0371)F211.C only 0.000 apart, marking (T0371)F211.C as missing WARNING: atoms too close: (T0371)K117.C and (T0371)F211.C only 0.000 apart, marking (T0371)F211.C as missing WARNING: atoms too close: (T0371)I116.C and (T0371)F211.C only 0.000 apart, marking (T0371)F211.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)F211.C only 0.000 apart, marking (T0371)F211.C as missing WARNING: atoms too close: (T0371)F211.CA and (T0371)A212.CA only 0.000 apart, marking (T0371)F211.CA as missing WARNING: atoms too close: (T0371)M210.CA and (T0371)A212.CA only 0.000 apart, marking (T0371)M210.CA as missing WARNING: atoms too close: (T0371)F209.CA and (T0371)A212.CA only 0.000 apart, marking (T0371)F209.CA as missing WARNING: atoms too close: (T0371)L174.CA and (T0371)A212.CA only 0.000 apart, marking (T0371)L174.CA as missing WARNING: atoms too close: (T0371)P162.CA and (T0371)A212.CA only 0.000 apart, marking (T0371)P162.CA as missing WARNING: atoms too close: (T0371)W145.CA and (T0371)A212.CA only 0.000 apart, marking (T0371)W145.CA as missing WARNING: atoms too close: (T0371)E131.CA and (T0371)A212.CA only 0.000 apart, marking (T0371)E131.CA as missing WARNING: atoms too close: (T0371)G130.CA and (T0371)A212.CA only 0.000 apart, marking (T0371)G130.CA as missing WARNING: atoms too close: (T0371)I129.CA and (T0371)A212.CA only 0.000 apart, marking (T0371)I129.CA as missing WARNING: atoms too close: (T0371)V121.CA and (T0371)A212.CA only 0.000 apart, marking (T0371)V121.CA as missing WARNING: atoms too close: (T0371)P120.CA and (T0371)A212.CA only 0.000 apart, marking (T0371)P120.CA as missing WARNING: atoms too close: (T0371)L119.CA and (T0371)A212.CA only 0.000 apart, marking (T0371)L119.CA as missing WARNING: atoms too close: (T0371)M118.CA and (T0371)A212.CA only 0.000 apart, marking (T0371)M118.CA as missing WARNING: atoms too close: (T0371)K117.CA and (T0371)A212.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)A212.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)A212.CA only 0.000 apart, marking (T0371)A212.CA as missing WARNING: atoms too close: (T0371)F211.O and (T0371)A212.O only 0.000 apart, marking (T0371)A212.O as missing WARNING: atoms too close: (T0371)M210.O and (T0371)A212.O only 0.000 apart, marking (T0371)A212.O as missing WARNING: atoms too close: (T0371)F209.O and (T0371)A212.O only 0.000 apart, marking (T0371)A212.O as missing WARNING: atoms too close: (T0371)L174.O and (T0371)A212.O only 0.000 apart, marking (T0371)A212.O as missing WARNING: atoms too close: (T0371)P162.O and (T0371)A212.O only 0.000 apart, marking (T0371)A212.O as missing WARNING: atoms too close: (T0371)W145.O and (T0371)A212.O only 0.000 apart, marking (T0371)A212.O as missing WARNING: atoms too close: (T0371)E131.O and (T0371)A212.O only 0.000 apart, marking (T0371)A212.O as missing WARNING: atoms too close: (T0371)G130.O and (T0371)A212.O only 0.000 apart, marking (T0371)A212.O as missing WARNING: atoms too close: (T0371)I129.O and (T0371)A212.O only 0.000 apart, marking (T0371)A212.O as missing WARNING: atoms too close: (T0371)V121.O and (T0371)A212.O only 0.000 apart, marking (T0371)A212.O as missing WARNING: atoms too close: (T0371)P120.O and (T0371)A212.O only 0.000 apart, marking (T0371)A212.O as missing WARNING: atoms too close: (T0371)L119.O and (T0371)A212.O only 0.000 apart, marking (T0371)A212.O as missing WARNING: atoms too close: (T0371)M118.O and (T0371)A212.O only 0.000 apart, marking (T0371)A212.O as missing WARNING: atoms too close: (T0371)K117.O and (T0371)A212.O only 0.000 apart, marking (T0371)A212.O as missing WARNING: atoms too close: (T0371)I116.O and (T0371)A212.O only 0.000 apart, marking (T0371)A212.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)A212.O only 0.000 apart, marking (T0371)A212.O as missing WARNING: atoms too close: (T0371)F211.C and (T0371)A212.C only 0.000 apart, marking (T0371)A212.C as missing WARNING: atoms too close: (T0371)M210.C and (T0371)A212.C only 0.000 apart, marking (T0371)A212.C as missing WARNING: atoms too close: (T0371)F209.C and (T0371)A212.C only 0.000 apart, marking (T0371)A212.C as missing WARNING: atoms too close: (T0371)L174.C and (T0371)A212.C only 0.000 apart, marking (T0371)A212.C as missing WARNING: atoms too close: (T0371)P162.C and (T0371)A212.C only 0.000 apart, marking (T0371)A212.C as missing WARNING: atoms too close: (T0371)W145.C and (T0371)A212.C only 0.000 apart, marking (T0371)A212.C as missing WARNING: atoms too close: (T0371)E131.C and (T0371)A212.C only 0.000 apart, marking (T0371)A212.C as missing WARNING: atoms too close: (T0371)G130.C and (T0371)A212.C only 0.000 apart, marking (T0371)A212.C as missing WARNING: atoms too close: (T0371)I129.C and (T0371)A212.C only 0.000 apart, marking (T0371)A212.C as missing WARNING: atoms too close: (T0371)V121.C and (T0371)A212.C only 0.000 apart, marking (T0371)A212.C as missing WARNING: atoms too close: (T0371)P120.C and (T0371)A212.C only 0.000 apart, marking (T0371)A212.C as missing WARNING: atoms too close: (T0371)L119.C and (T0371)A212.C only 0.000 apart, marking (T0371)A212.C as missing WARNING: atoms too close: (T0371)M118.C and (T0371)A212.C only 0.000 apart, marking (T0371)A212.C as missing WARNING: atoms too close: (T0371)K117.C and (T0371)A212.C only 0.000 apart, marking (T0371)A212.C as missing WARNING: atoms too close: (T0371)I116.C and (T0371)A212.C only 0.000 apart, marking (T0371)A212.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)A212.C only 0.000 apart, marking (T0371)A212.C as missing # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation panther2_TS1 # ReadConformPDB reading from PDB file servers/panther3_TS1.pdb.gz looking for model 1 WARNING: atoms too close: (T0371)F72.CA and (T0371)I116.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.O and (T0371)I116.O only 0.000 apart, marking (T0371)I116.O as missing WARNING: atoms too close: (T0371)F72.C and (T0371)I116.C only 0.000 apart, marking (T0371)I116.C as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)K117.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)K117.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.O and (T0371)K117.O only 0.000 apart, marking (T0371)K117.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)K117.O only 0.000 apart, marking (T0371)K117.O as missing WARNING: atoms too close: (T0371)I116.C and (T0371)K117.C only 0.000 apart, marking (T0371)K117.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)K117.C only 0.000 apart, marking (T0371)K117.C as missing WARNING: atoms too close: (T0371)K117.CA and (T0371)M118.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)M118.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)M118.CA only 0.000 apart, marking (T0371)M118.CA as missing WARNING: atoms too close: (T0371)K117.O and (T0371)M118.O only 0.000 apart, marking (T0371)M118.O as missing WARNING: atoms too close: (T0371)I116.O and (T0371)M118.O only 0.000 apart, marking (T0371)M118.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)M118.O only 0.000 apart, marking (T0371)M118.O as missing WARNING: atoms too close: (T0371)K117.C and (T0371)M118.C only 0.000 apart, marking (T0371)M118.C as missing WARNING: atoms too close: (T0371)I116.C and (T0371)M118.C only 0.000 apart, marking (T0371)M118.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)M118.C only 0.000 apart, marking (T0371)M118.C as missing WARNING: atoms too close: (T0371)M118.CA and (T0371)L119.CA only 0.000 apart, marking (T0371)M118.CA as missing WARNING: atoms too close: (T0371)K117.CA and (T0371)L119.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)L119.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)L119.CA only 0.000 apart, marking (T0371)L119.CA as missing WARNING: atoms too close: (T0371)M118.O and (T0371)L119.O only 0.000 apart, marking (T0371)L119.O as missing WARNING: atoms too close: (T0371)K117.O and (T0371)L119.O only 0.000 apart, marking (T0371)L119.O as missing WARNING: atoms too close: (T0371)I116.O and (T0371)L119.O only 0.000 apart, marking (T0371)L119.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)L119.O only 0.000 apart, marking (T0371)L119.O as missing WARNING: atoms too close: (T0371)M118.C and (T0371)L119.C only 0.000 apart, marking (T0371)L119.C as missing WARNING: atoms too close: (T0371)K117.C and (T0371)L119.C only 0.000 apart, marking (T0371)L119.C as missing WARNING: atoms too close: (T0371)I116.C and (T0371)L119.C only 0.000 apart, marking (T0371)L119.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)L119.C only 0.000 apart, marking (T0371)L119.C as missing WARNING: atoms too close: (T0371)L119.CA and (T0371)P120.CA only 0.000 apart, marking (T0371)L119.CA as missing WARNING: atoms too close: (T0371)M118.CA and (T0371)P120.CA only 0.000 apart, marking (T0371)M118.CA as missing WARNING: atoms too close: (T0371)K117.CA and (T0371)P120.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)P120.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)P120.CA only 0.000 apart, marking (T0371)P120.CA as missing WARNING: atoms too close: (T0371)L119.O and (T0371)P120.O only 0.000 apart, marking (T0371)P120.O as missing WARNING: atoms too close: (T0371)M118.O and (T0371)P120.O only 0.000 apart, marking (T0371)P120.O as missing WARNING: atoms too close: (T0371)K117.O and (T0371)P120.O only 0.000 apart, marking (T0371)P120.O as missing WARNING: atoms too close: (T0371)I116.O and (T0371)P120.O only 0.000 apart, marking (T0371)P120.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)P120.O only 0.000 apart, marking (T0371)P120.O as missing WARNING: atoms too close: (T0371)L119.C and (T0371)P120.C only 0.000 apart, marking (T0371)P120.C as missing WARNING: atoms too close: (T0371)M118.C and (T0371)P120.C only 0.000 apart, marking (T0371)P120.C as missing WARNING: atoms too close: (T0371)K117.C and (T0371)P120.C only 0.000 apart, marking (T0371)P120.C as missing WARNING: atoms too close: (T0371)I116.C and (T0371)P120.C only 0.000 apart, marking (T0371)P120.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)P120.C only 0.000 apart, marking (T0371)P120.C as missing WARNING: atoms too close: (T0371)P120.CA and (T0371)V121.CA only 0.000 apart, marking (T0371)P120.CA as missing WARNING: atoms too close: (T0371)L119.CA and (T0371)V121.CA only 0.000 apart, marking (T0371)L119.CA as missing WARNING: atoms too close: (T0371)M118.CA and (T0371)V121.CA only 0.000 apart, marking (T0371)M118.CA as missing WARNING: atoms too close: (T0371)K117.CA and (T0371)V121.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)V121.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)V121.CA only 0.000 apart, marking (T0371)V121.CA as missing WARNING: atoms too close: (T0371)P120.O and (T0371)V121.O only 0.000 apart, marking (T0371)V121.O as missing WARNING: atoms too close: (T0371)L119.O and (T0371)V121.O only 0.000 apart, marking (T0371)V121.O as missing WARNING: atoms too close: (T0371)M118.O and (T0371)V121.O only 0.000 apart, marking (T0371)V121.O as missing WARNING: atoms too close: (T0371)K117.O and (T0371)V121.O only 0.000 apart, marking (T0371)V121.O as missing WARNING: atoms too close: (T0371)I116.O and (T0371)V121.O only 0.000 apart, marking (T0371)V121.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)V121.O only 0.000 apart, marking (T0371)V121.O as missing WARNING: atoms too close: (T0371)P120.C and (T0371)V121.C only 0.000 apart, marking (T0371)V121.C as missing WARNING: atoms too close: (T0371)L119.C and (T0371)V121.C only 0.000 apart, marking (T0371)V121.C as missing WARNING: atoms too close: (T0371)M118.C and (T0371)V121.C only 0.000 apart, marking (T0371)V121.C as missing WARNING: atoms too close: (T0371)K117.C and (T0371)V121.C only 0.000 apart, marking (T0371)V121.C as missing WARNING: atoms too close: (T0371)I116.C and (T0371)V121.C only 0.000 apart, marking (T0371)V121.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)V121.C only 0.000 apart, marking (T0371)V121.C as missing WARNING: atoms too close: (T0371)V121.CA and (T0371)I129.CA only 0.000 apart, marking (T0371)V121.CA as missing WARNING: atoms too close: (T0371)P120.CA and (T0371)I129.CA only 0.000 apart, marking (T0371)P120.CA as missing WARNING: atoms too close: (T0371)L119.CA and (T0371)I129.CA only 0.000 apart, marking (T0371)L119.CA as missing WARNING: atoms too close: (T0371)M118.CA and (T0371)I129.CA only 0.000 apart, marking (T0371)M118.CA as missing WARNING: atoms too close: (T0371)K117.CA and (T0371)I129.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)I129.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)I129.CA only 0.000 apart, marking (T0371)I129.CA as missing WARNING: atoms too close: (T0371)V121.O and (T0371)I129.O only 0.000 apart, marking (T0371)I129.O as missing WARNING: atoms too close: (T0371)P120.O and (T0371)I129.O only 0.000 apart, marking (T0371)I129.O as missing WARNING: atoms too close: (T0371)L119.O and (T0371)I129.O only 0.000 apart, marking (T0371)I129.O as missing WARNING: atoms too close: (T0371)M118.O and (T0371)I129.O only 0.000 apart, marking (T0371)I129.O as missing WARNING: atoms too close: (T0371)K117.O and (T0371)I129.O only 0.000 apart, marking (T0371)I129.O as missing WARNING: atoms too close: (T0371)I116.O and (T0371)I129.O only 0.000 apart, marking (T0371)I129.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)I129.O only 0.000 apart, marking (T0371)I129.O as missing WARNING: atoms too close: (T0371)V121.C and (T0371)I129.C only 0.000 apart, marking (T0371)I129.C as missing WARNING: atoms too close: (T0371)P120.C and (T0371)I129.C only 0.000 apart, marking (T0371)I129.C as missing WARNING: atoms too close: (T0371)L119.C and (T0371)I129.C only 0.000 apart, marking (T0371)I129.C as missing WARNING: atoms too close: (T0371)M118.C and (T0371)I129.C only 0.000 apart, marking (T0371)I129.C as missing WARNING: atoms too close: (T0371)K117.C and (T0371)I129.C only 0.000 apart, marking (T0371)I129.C as missing WARNING: atoms too close: (T0371)I116.C and (T0371)I129.C only 0.000 apart, marking (T0371)I129.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)I129.C only 0.000 apart, marking (T0371)I129.C as missing WARNING: atoms too close: (T0371)I129.CA and (T0371)G130.CA only 0.000 apart, marking (T0371)I129.CA as missing WARNING: atoms too close: (T0371)V121.CA and (T0371)G130.CA only 0.000 apart, marking (T0371)V121.CA as missing WARNING: atoms too close: (T0371)P120.CA and (T0371)G130.CA only 0.000 apart, marking (T0371)P120.CA as missing WARNING: atoms too close: (T0371)L119.CA and (T0371)G130.CA only 0.000 apart, marking (T0371)L119.CA as missing WARNING: atoms too close: (T0371)M118.CA and (T0371)G130.CA only 0.000 apart, marking (T0371)M118.CA as missing WARNING: atoms too close: (T0371)K117.CA and (T0371)G130.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)G130.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)G130.CA only 0.000 apart, marking (T0371)G130.CA as missing WARNING: atoms too close: (T0371)I129.O and (T0371)G130.O only 0.000 apart, marking (T0371)G130.O as missing WARNING: atoms too close: (T0371)V121.O and (T0371)G130.O only 0.000 apart, marking (T0371)G130.O as missing WARNING: atoms too close: (T0371)P120.O and (T0371)G130.O only 0.000 apart, marking (T0371)G130.O as missing WARNING: atoms too close: (T0371)L119.O and (T0371)G130.O only 0.000 apart, marking (T0371)G130.O as missing WARNING: atoms too close: (T0371)M118.O and (T0371)G130.O only 0.000 apart, marking (T0371)G130.O as missing WARNING: atoms too close: (T0371)K117.O and (T0371)G130.O only 0.000 apart, marking (T0371)G130.O as missing WARNING: atoms too close: (T0371)I116.O and (T0371)G130.O only 0.000 apart, marking (T0371)G130.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)G130.O only 0.000 apart, marking (T0371)G130.O as missing WARNING: atoms too close: (T0371)I129.C and (T0371)G130.C only 0.000 apart, marking (T0371)G130.C as missing WARNING: atoms too close: (T0371)V121.C and (T0371)G130.C only 0.000 apart, marking (T0371)G130.C as missing WARNING: atoms too close: (T0371)P120.C and (T0371)G130.C only 0.000 apart, marking (T0371)G130.C as missing WARNING: atoms too close: (T0371)L119.C and (T0371)G130.C only 0.000 apart, marking (T0371)G130.C as missing WARNING: atoms too close: (T0371)M118.C and (T0371)G130.C only 0.000 apart, marking (T0371)G130.C as missing WARNING: atoms too close: (T0371)K117.C and (T0371)G130.C only 0.000 apart, marking (T0371)G130.C as missing WARNING: atoms too close: (T0371)I116.C and (T0371)G130.C only 0.000 apart, marking (T0371)G130.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)G130.C only 0.000 apart, marking (T0371)G130.C as missing WARNING: atoms too close: (T0371)G130.CA and (T0371)E131.CA only 0.000 apart, marking (T0371)G130.CA as missing WARNING: atoms too close: (T0371)I129.CA and (T0371)E131.CA only 0.000 apart, marking (T0371)I129.CA as missing WARNING: atoms too close: (T0371)V121.CA and (T0371)E131.CA only 0.000 apart, marking (T0371)V121.CA as missing WARNING: atoms too close: (T0371)P120.CA and (T0371)E131.CA only 0.000 apart, marking (T0371)P120.CA as missing WARNING: atoms too close: (T0371)L119.CA and (T0371)E131.CA only 0.000 apart, marking (T0371)L119.CA as missing WARNING: atoms too close: (T0371)M118.CA and (T0371)E131.CA only 0.000 apart, marking (T0371)M118.CA as missing WARNING: atoms too close: (T0371)K117.CA and (T0371)E131.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)E131.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)E131.CA only 0.000 apart, marking (T0371)E131.CA as missing WARNING: atoms too close: (T0371)G130.O and (T0371)E131.O only 0.000 apart, marking (T0371)E131.O as missing WARNING: atoms too close: (T0371)I129.O and (T0371)E131.O only 0.000 apart, marking (T0371)E131.O as missing WARNING: atoms too close: (T0371)V121.O and (T0371)E131.O only 0.000 apart, marking (T0371)E131.O as missing WARNING: atoms too close: (T0371)P120.O and (T0371)E131.O only 0.000 apart, marking (T0371)E131.O as missing WARNING: atoms too close: (T0371)L119.O and (T0371)E131.O only 0.000 apart, marking (T0371)E131.O as missing WARNING: atoms too close: (T0371)M118.O and (T0371)E131.O only 0.000 apart, marking (T0371)E131.O as missing WARNING: atoms too close: (T0371)K117.O and (T0371)E131.O only 0.000 apart, marking (T0371)E131.O as missing WARNING: atoms too close: (T0371)I116.O and (T0371)E131.O only 0.000 apart, marking (T0371)E131.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)E131.O only 0.000 apart, marking (T0371)E131.O as missing WARNING: atoms too close: (T0371)G130.C and (T0371)E131.C only 0.000 apart, marking (T0371)E131.C as missing WARNING: atoms too close: (T0371)I129.C and (T0371)E131.C only 0.000 apart, marking (T0371)E131.C as missing WARNING: atoms too close: (T0371)V121.C and (T0371)E131.C only 0.000 apart, marking (T0371)E131.C as missing WARNING: atoms too close: (T0371)P120.C and (T0371)E131.C only 0.000 apart, marking (T0371)E131.C as missing WARNING: atoms too close: (T0371)L119.C and (T0371)E131.C only 0.000 apart, marking (T0371)E131.C as missing WARNING: atoms too close: (T0371)M118.C and (T0371)E131.C only 0.000 apart, marking (T0371)E131.C as missing WARNING: atoms too close: (T0371)K117.C and (T0371)E131.C only 0.000 apart, marking (T0371)E131.C as missing WARNING: atoms too close: (T0371)I116.C and (T0371)E131.C only 0.000 apart, marking (T0371)E131.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)E131.C only 0.000 apart, marking (T0371)E131.C as missing WARNING: atoms too close: (T0371)E131.CA and (T0371)W145.CA only 0.000 apart, marking (T0371)E131.CA as missing WARNING: atoms too close: (T0371)G130.CA and (T0371)W145.CA only 0.000 apart, marking (T0371)G130.CA as missing WARNING: atoms too close: (T0371)I129.CA and (T0371)W145.CA only 0.000 apart, marking (T0371)I129.CA as missing WARNING: atoms too close: (T0371)V121.CA and (T0371)W145.CA only 0.000 apart, marking (T0371)V121.CA as missing WARNING: atoms too close: (T0371)P120.CA and (T0371)W145.CA only 0.000 apart, marking (T0371)P120.CA as missing WARNING: atoms too close: (T0371)L119.CA and (T0371)W145.CA only 0.000 apart, marking (T0371)L119.CA as missing WARNING: atoms too close: (T0371)M118.CA and (T0371)W145.CA only 0.000 apart, marking (T0371)M118.CA as missing WARNING: atoms too close: (T0371)K117.CA and (T0371)W145.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)W145.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)W145.CA only 0.000 apart, marking (T0371)W145.CA as missing WARNING: atoms too close: (T0371)E131.O and (T0371)W145.O only 0.000 apart, marking (T0371)W145.O as missing WARNING: atoms too close: (T0371)G130.O and (T0371)W145.O only 0.000 apart, marking (T0371)W145.O as missing WARNING: atoms too close: (T0371)I129.O and (T0371)W145.O only 0.000 apart, marking (T0371)W145.O as missing WARNING: atoms too close: (T0371)V121.O and (T0371)W145.O only 0.000 apart, marking (T0371)W145.O as missing WARNING: atoms too close: (T0371)P120.O and (T0371)W145.O only 0.000 apart, marking (T0371)W145.O as missing WARNING: atoms too close: (T0371)L119.O and (T0371)W145.O only 0.000 apart, marking (T0371)W145.O as missing WARNING: atoms too close: (T0371)M118.O and (T0371)W145.O only 0.000 apart, marking (T0371)W145.O as missing WARNING: atoms too close: (T0371)K117.O and (T0371)W145.O only 0.000 apart, marking (T0371)W145.O as missing WARNING: atoms too close: (T0371)I116.O and (T0371)W145.O only 0.000 apart, marking (T0371)W145.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)W145.O only 0.000 apart, marking (T0371)W145.O as missing WARNING: atoms too close: (T0371)E131.C and (T0371)W145.C only 0.000 apart, marking (T0371)W145.C as missing WARNING: atoms too close: (T0371)G130.C and (T0371)W145.C only 0.000 apart, marking (T0371)W145.C as missing WARNING: atoms too close: (T0371)I129.C and (T0371)W145.C only 0.000 apart, marking (T0371)W145.C as missing WARNING: atoms too close: (T0371)V121.C and (T0371)W145.C only 0.000 apart, marking (T0371)W145.C as missing WARNING: atoms too close: (T0371)P120.C and (T0371)W145.C only 0.000 apart, marking (T0371)W145.C as missing WARNING: atoms too close: (T0371)L119.C and (T0371)W145.C only 0.000 apart, marking (T0371)W145.C as missing WARNING: atoms too close: (T0371)M118.C and (T0371)W145.C only 0.000 apart, marking (T0371)W145.C as missing WARNING: atoms too close: (T0371)K117.C and (T0371)W145.C only 0.000 apart, marking (T0371)W145.C as missing WARNING: atoms too close: (T0371)I116.C and (T0371)W145.C only 0.000 apart, marking (T0371)W145.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)W145.C only 0.000 apart, marking (T0371)W145.C as missing WARNING: atoms too close: (T0371)W145.CA and (T0371)P162.CA only 0.000 apart, marking (T0371)W145.CA as missing WARNING: atoms too close: (T0371)E131.CA and (T0371)P162.CA only 0.000 apart, marking (T0371)E131.CA as missing WARNING: atoms too close: (T0371)G130.CA and (T0371)P162.CA only 0.000 apart, marking (T0371)G130.CA as missing WARNING: atoms too close: (T0371)I129.CA and (T0371)P162.CA only 0.000 apart, marking (T0371)I129.CA as missing WARNING: atoms too close: (T0371)V121.CA and (T0371)P162.CA only 0.000 apart, marking (T0371)V121.CA as missing WARNING: atoms too close: (T0371)P120.CA and (T0371)P162.CA only 0.000 apart, marking (T0371)P120.CA as missing WARNING: atoms too close: (T0371)L119.CA and (T0371)P162.CA only 0.000 apart, marking (T0371)L119.CA as missing WARNING: atoms too close: (T0371)M118.CA and (T0371)P162.CA only 0.000 apart, marking (T0371)M118.CA as missing WARNING: atoms too close: (T0371)K117.CA and (T0371)P162.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)P162.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)P162.CA only 0.000 apart, marking (T0371)P162.CA as missing WARNING: atoms too close: (T0371)W145.O and (T0371)P162.O only 0.000 apart, marking (T0371)P162.O as missing WARNING: atoms too close: (T0371)E131.O and (T0371)P162.O only 0.000 apart, marking (T0371)P162.O as missing WARNING: atoms too close: (T0371)G130.O and (T0371)P162.O only 0.000 apart, marking (T0371)P162.O as missing WARNING: atoms too close: (T0371)I129.O and (T0371)P162.O only 0.000 apart, marking (T0371)P162.O as missing WARNING: atoms too close: (T0371)V121.O and (T0371)P162.O only 0.000 apart, marking (T0371)P162.O as missing WARNING: atoms too close: (T0371)P120.O and (T0371)P162.O only 0.000 apart, marking (T0371)P162.O as missing WARNING: atoms too close: (T0371)L119.O and (T0371)P162.O only 0.000 apart, marking (T0371)P162.O as missing WARNING: atoms too close: (T0371)M118.O and (T0371)P162.O only 0.000 apart, marking (T0371)P162.O as missing WARNING: atoms too close: (T0371)K117.O and (T0371)P162.O only 0.000 apart, marking (T0371)P162.O as missing WARNING: atoms too close: (T0371)I116.O and (T0371)P162.O only 0.000 apart, marking (T0371)P162.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)P162.O only 0.000 apart, marking (T0371)P162.O as missing WARNING: atoms too close: (T0371)W145.C and (T0371)P162.C only 0.000 apart, marking (T0371)P162.C as missing WARNING: atoms too close: (T0371)E131.C and (T0371)P162.C only 0.000 apart, marking (T0371)P162.C as missing WARNING: atoms too close: (T0371)G130.C and (T0371)P162.C only 0.000 apart, marking (T0371)P162.C as missing WARNING: atoms too close: (T0371)I129.C and (T0371)P162.C only 0.000 apart, marking (T0371)P162.C as missing WARNING: atoms too close: (T0371)V121.C and (T0371)P162.C only 0.000 apart, marking (T0371)P162.C as missing WARNING: atoms too close: (T0371)P120.C and (T0371)P162.C only 0.000 apart, marking (T0371)P162.C as missing WARNING: atoms too close: (T0371)L119.C and (T0371)P162.C only 0.000 apart, marking (T0371)P162.C as missing WARNING: atoms too close: (T0371)M118.C and (T0371)P162.C only 0.000 apart, marking (T0371)P162.C as missing WARNING: atoms too close: (T0371)K117.C and (T0371)P162.C only 0.000 apart, marking (T0371)P162.C as missing WARNING: atoms too close: (T0371)I116.C and (T0371)P162.C only 0.000 apart, marking (T0371)P162.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)P162.C only 0.000 apart, marking (T0371)P162.C as missing WARNING: atoms too close: (T0371)P162.CA and (T0371)I183.CA only 0.000 apart, marking (T0371)P162.CA as missing WARNING: atoms too close: (T0371)W145.CA and (T0371)I183.CA only 0.000 apart, marking (T0371)W145.CA as missing WARNING: atoms too close: (T0371)E131.CA and (T0371)I183.CA only 0.000 apart, marking (T0371)E131.CA as missing WARNING: atoms too close: (T0371)G130.CA and (T0371)I183.CA only 0.000 apart, marking (T0371)G130.CA as missing WARNING: atoms too close: (T0371)I129.CA and (T0371)I183.CA only 0.000 apart, marking (T0371)I129.CA as missing WARNING: atoms too close: (T0371)V121.CA and (T0371)I183.CA only 0.000 apart, marking (T0371)V121.CA as missing WARNING: atoms too close: (T0371)P120.CA and (T0371)I183.CA only 0.000 apart, marking (T0371)P120.CA as missing WARNING: atoms too close: (T0371)L119.CA and (T0371)I183.CA only 0.000 apart, marking (T0371)L119.CA as missing WARNING: atoms too close: (T0371)M118.CA and (T0371)I183.CA only 0.000 apart, marking (T0371)M118.CA as missing WARNING: atoms too close: (T0371)K117.CA and (T0371)I183.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)I183.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)I183.CA only 0.000 apart, marking (T0371)I183.CA as missing WARNING: atoms too close: (T0371)P162.O and (T0371)I183.O only 0.000 apart, marking (T0371)I183.O as missing WARNING: atoms too close: (T0371)W145.O and (T0371)I183.O only 0.000 apart, marking (T0371)I183.O as missing WARNING: atoms too close: (T0371)E131.O and (T0371)I183.O only 0.000 apart, marking (T0371)I183.O as missing WARNING: atoms too close: (T0371)G130.O and (T0371)I183.O only 0.000 apart, marking (T0371)I183.O as missing WARNING: atoms too close: (T0371)I129.O and (T0371)I183.O only 0.000 apart, marking (T0371)I183.O as missing WARNING: atoms too close: (T0371)V121.O and (T0371)I183.O only 0.000 apart, marking (T0371)I183.O as missing WARNING: atoms too close: (T0371)P120.O and (T0371)I183.O only 0.000 apart, marking (T0371)I183.O as missing WARNING: atoms too close: (T0371)L119.O and (T0371)I183.O only 0.000 apart, marking (T0371)I183.O as missing WARNING: atoms too close: (T0371)M118.O and (T0371)I183.O only 0.000 apart, marking (T0371)I183.O as missing WARNING: atoms too close: (T0371)K117.O and (T0371)I183.O only 0.000 apart, marking (T0371)I183.O as missing WARNING: atoms too close: (T0371)I116.O and (T0371)I183.O only 0.000 apart, marking (T0371)I183.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)I183.O only 0.000 apart, marking (T0371)I183.O as missing WARNING: atoms too close: (T0371)P162.C and (T0371)I183.C only 0.000 apart, marking (T0371)I183.C as missing WARNING: atoms too close: (T0371)W145.C and (T0371)I183.C only 0.000 apart, marking (T0371)I183.C as missing WARNING: atoms too close: (T0371)E131.C and (T0371)I183.C only 0.000 apart, marking (T0371)I183.C as missing WARNING: atoms too close: (T0371)G130.C and (T0371)I183.C only 0.000 apart, marking (T0371)I183.C as missing WARNING: atoms too close: (T0371)I129.C and (T0371)I183.C only 0.000 apart, marking (T0371)I183.C as missing WARNING: atoms too close: (T0371)V121.C and (T0371)I183.C only 0.000 apart, marking (T0371)I183.C as missing WARNING: atoms too close: (T0371)P120.C and (T0371)I183.C only 0.000 apart, marking (T0371)I183.C as missing WARNING: atoms too close: (T0371)L119.C and (T0371)I183.C only 0.000 apart, marking (T0371)I183.C as missing WARNING: atoms too close: (T0371)M118.C and (T0371)I183.C only 0.000 apart, marking (T0371)I183.C as missing WARNING: atoms too close: (T0371)K117.C and (T0371)I183.C only 0.000 apart, marking (T0371)I183.C as missing WARNING: atoms too close: (T0371)I116.C and (T0371)I183.C only 0.000 apart, marking (T0371)I183.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)I183.C only 0.000 apart, marking (T0371)I183.C as missing WARNING: atoms too close: (T0371)I183.CA and (T0371)Q207.CA only 0.000 apart, marking (T0371)I183.CA as missing WARNING: atoms too close: (T0371)P162.CA and (T0371)Q207.CA only 0.000 apart, marking (T0371)P162.CA as missing WARNING: atoms too close: (T0371)W145.CA and (T0371)Q207.CA only 0.000 apart, marking (T0371)W145.CA as missing WARNING: atoms too close: (T0371)E131.CA and (T0371)Q207.CA only 0.000 apart, marking (T0371)E131.CA as missing WARNING: atoms too close: (T0371)G130.CA and (T0371)Q207.CA only 0.000 apart, marking (T0371)G130.CA as missing WARNING: atoms too close: (T0371)I129.CA and (T0371)Q207.CA only 0.000 apart, marking (T0371)I129.CA as missing WARNING: atoms too close: (T0371)V121.CA and (T0371)Q207.CA only 0.000 apart, marking (T0371)V121.CA as missing WARNING: atoms too close: (T0371)P120.CA and (T0371)Q207.CA only 0.000 apart, marking (T0371)P120.CA as missing WARNING: atoms too close: (T0371)L119.CA and (T0371)Q207.CA only 0.000 apart, marking (T0371)L119.CA as missing WARNING: atoms too close: (T0371)M118.CA and (T0371)Q207.CA only 0.000 apart, marking (T0371)M118.CA as missing WARNING: atoms too close: (T0371)K117.CA and (T0371)Q207.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)Q207.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)Q207.CA only 0.000 apart, marking (T0371)Q207.CA as missing WARNING: atoms too close: (T0371)I183.O and (T0371)Q207.O only 0.000 apart, marking (T0371)Q207.O as missing WARNING: atoms too close: (T0371)P162.O and (T0371)Q207.O only 0.000 apart, marking (T0371)Q207.O as missing WARNING: atoms too close: (T0371)W145.O and (T0371)Q207.O only 0.000 apart, marking (T0371)Q207.O as missing WARNING: atoms too close: (T0371)E131.O and (T0371)Q207.O only 0.000 apart, marking (T0371)Q207.O as missing WARNING: atoms too close: (T0371)G130.O and (T0371)Q207.O only 0.000 apart, marking (T0371)Q207.O as missing WARNING: atoms too close: (T0371)I129.O and (T0371)Q207.O only 0.000 apart, marking (T0371)Q207.O as missing WARNING: atoms too close: (T0371)V121.O and (T0371)Q207.O only 0.000 apart, marking (T0371)Q207.O as missing WARNING: atoms too close: (T0371)P120.O and (T0371)Q207.O only 0.000 apart, marking (T0371)Q207.O as missing WARNING: atoms too close: (T0371)L119.O and (T0371)Q207.O only 0.000 apart, marking (T0371)Q207.O as missing WARNING: atoms too close: (T0371)M118.O and (T0371)Q207.O only 0.000 apart, marking (T0371)Q207.O as missing WARNING: atoms too close: (T0371)K117.O and (T0371)Q207.O only 0.000 apart, marking (T0371)Q207.O as missing WARNING: atoms too close: (T0371)I116.O and (T0371)Q207.O only 0.000 apart, marking (T0371)Q207.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)Q207.O only 0.000 apart, marking (T0371)Q207.O as missing WARNING: atoms too close: (T0371)I183.C and (T0371)Q207.C only 0.000 apart, marking (T0371)Q207.C as missing WARNING: atoms too close: (T0371)P162.C and (T0371)Q207.C only 0.000 apart, marking (T0371)Q207.C as missing WARNING: atoms too close: (T0371)W145.C and (T0371)Q207.C only 0.000 apart, marking (T0371)Q207.C as missing WARNING: atoms too close: (T0371)E131.C and (T0371)Q207.C only 0.000 apart, marking (T0371)Q207.C as missing WARNING: atoms too close: (T0371)G130.C and (T0371)Q207.C only 0.000 apart, marking (T0371)Q207.C as missing WARNING: atoms too close: (T0371)I129.C and (T0371)Q207.C only 0.000 apart, marking (T0371)Q207.C as missing WARNING: atoms too close: (T0371)V121.C and (T0371)Q207.C only 0.000 apart, marking (T0371)Q207.C as missing WARNING: atoms too close: (T0371)P120.C and (T0371)Q207.C only 0.000 apart, marking (T0371)Q207.C as missing WARNING: atoms too close: (T0371)L119.C and (T0371)Q207.C only 0.000 apart, marking (T0371)Q207.C as missing WARNING: atoms too close: (T0371)M118.C and (T0371)Q207.C only 0.000 apart, marking (T0371)Q207.C as missing WARNING: atoms too close: (T0371)K117.C and (T0371)Q207.C only 0.000 apart, marking (T0371)Q207.C as missing WARNING: atoms too close: (T0371)I116.C and (T0371)Q207.C only 0.000 apart, marking (T0371)Q207.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)Q207.C only 0.000 apart, marking (T0371)Q207.C as missing WARNING: atoms too close: (T0371)Q207.CA and (T0371)M208.CA only 0.000 apart, marking (T0371)Q207.CA as missing WARNING: atoms too close: (T0371)I183.CA and (T0371)M208.CA only 0.000 apart, marking (T0371)I183.CA as missing WARNING: atoms too close: (T0371)P162.CA and (T0371)M208.CA only 0.000 apart, marking (T0371)P162.CA as missing WARNING: atoms too close: (T0371)W145.CA and (T0371)M208.CA only 0.000 apart, marking (T0371)W145.CA as missing WARNING: atoms too close: (T0371)E131.CA and (T0371)M208.CA only 0.000 apart, marking (T0371)E131.CA as missing WARNING: atoms too close: (T0371)G130.CA and (T0371)M208.CA only 0.000 apart, marking (T0371)G130.CA as missing WARNING: atoms too close: (T0371)I129.CA and (T0371)M208.CA only 0.000 apart, marking (T0371)I129.CA as missing WARNING: atoms too close: (T0371)V121.CA and (T0371)M208.CA only 0.000 apart, marking (T0371)V121.CA as missing WARNING: atoms too close: (T0371)P120.CA and (T0371)M208.CA only 0.000 apart, marking (T0371)P120.CA as missing WARNING: atoms too close: (T0371)L119.CA and (T0371)M208.CA only 0.000 apart, marking (T0371)L119.CA as missing WARNING: atoms too close: (T0371)M118.CA and (T0371)M208.CA only 0.000 apart, marking (T0371)M118.CA as missing WARNING: atoms too close: (T0371)K117.CA and (T0371)M208.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)M208.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)M208.CA only 0.000 apart, marking (T0371)M208.CA as missing WARNING: atoms too close: (T0371)Q207.O and (T0371)M208.O only 0.000 apart, marking (T0371)M208.O as missing WARNING: atoms too close: (T0371)I183.O and (T0371)M208.O only 0.000 apart, marking (T0371)M208.O as missing WARNING: atoms too close: (T0371)P162.O and (T0371)M208.O only 0.000 apart, marking (T0371)M208.O as missing WARNING: atoms too close: (T0371)W145.O and (T0371)M208.O only 0.000 apart, marking (T0371)M208.O as missing WARNING: atoms too close: (T0371)E131.O and (T0371)M208.O only 0.000 apart, marking (T0371)M208.O as missing WARNING: atoms too close: (T0371)G130.O and (T0371)M208.O only 0.000 apart, marking (T0371)M208.O as missing WARNING: atoms too close: (T0371)I129.O and (T0371)M208.O only 0.000 apart, marking (T0371)M208.O as missing WARNING: atoms too close: (T0371)V121.O and (T0371)M208.O only 0.000 apart, marking (T0371)M208.O as missing WARNING: atoms too close: (T0371)P120.O and (T0371)M208.O only 0.000 apart, marking (T0371)M208.O as missing WARNING: atoms too close: (T0371)L119.O and (T0371)M208.O only 0.000 apart, marking (T0371)M208.O as missing WARNING: atoms too close: (T0371)M118.O and (T0371)M208.O only 0.000 apart, marking (T0371)M208.O as missing WARNING: atoms too close: (T0371)K117.O and (T0371)M208.O only 0.000 apart, marking (T0371)M208.O as missing WARNING: atoms too close: (T0371)I116.O and (T0371)M208.O only 0.000 apart, marking (T0371)M208.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)M208.O only 0.000 apart, marking (T0371)M208.O as missing WARNING: atoms too close: (T0371)Q207.C and (T0371)M208.C only 0.000 apart, marking (T0371)M208.C as missing WARNING: atoms too close: (T0371)I183.C and (T0371)M208.C only 0.000 apart, marking (T0371)M208.C as missing WARNING: atoms too close: (T0371)P162.C and (T0371)M208.C only 0.000 apart, marking (T0371)M208.C as missing WARNING: atoms too close: (T0371)W145.C and (T0371)M208.C only 0.000 apart, marking (T0371)M208.C as missing WARNING: atoms too close: (T0371)E131.C and (T0371)M208.C only 0.000 apart, marking (T0371)M208.C as missing WARNING: atoms too close: (T0371)G130.C and (T0371)M208.C only 0.000 apart, marking (T0371)M208.C as missing WARNING: atoms too close: (T0371)I129.C and (T0371)M208.C only 0.000 apart, marking (T0371)M208.C as missing WARNING: atoms too close: (T0371)V121.C and (T0371)M208.C only 0.000 apart, marking (T0371)M208.C as missing WARNING: atoms too close: (T0371)P120.C and (T0371)M208.C only 0.000 apart, marking (T0371)M208.C as missing WARNING: atoms too close: (T0371)L119.C and (T0371)M208.C only 0.000 apart, marking (T0371)M208.C as missing WARNING: atoms too close: (T0371)M118.C and (T0371)M208.C only 0.000 apart, marking (T0371)M208.C as missing WARNING: atoms too close: (T0371)K117.C and (T0371)M208.C only 0.000 apart, marking (T0371)M208.C as missing WARNING: atoms too close: (T0371)I116.C and (T0371)M208.C only 0.000 apart, marking (T0371)M208.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)M208.C only 0.000 apart, marking (T0371)M208.C as missing WARNING: atoms too close: (T0371)E131.N and (T0371)F209.N only 0.000 apart, marking (T0371)E131.N as missing WARNING: atoms too close: (T0371)M208.CA and (T0371)F209.CA only 0.000 apart, marking (T0371)M208.CA as missing WARNING: atoms too close: (T0371)Q207.CA and (T0371)F209.CA only 0.000 apart, marking (T0371)Q207.CA as missing WARNING: atoms too close: (T0371)I183.CA and (T0371)F209.CA only 0.000 apart, marking (T0371)I183.CA as missing WARNING: atoms too close: (T0371)P162.CA and (T0371)F209.CA only 0.000 apart, marking (T0371)P162.CA as missing WARNING: atoms too close: (T0371)W145.CA and (T0371)F209.CA only 0.000 apart, marking (T0371)W145.CA as missing WARNING: atoms too close: (T0371)E131.CA and (T0371)F209.CA only 0.000 apart, marking (T0371)E131.CA as missing WARNING: atoms too close: (T0371)G130.CA and (T0371)F209.CA only 0.000 apart, marking (T0371)G130.CA as missing WARNING: atoms too close: (T0371)I129.CA and (T0371)F209.CA only 0.000 apart, marking (T0371)I129.CA as missing WARNING: atoms too close: (T0371)V121.CA and (T0371)F209.CA only 0.000 apart, marking (T0371)V121.CA as missing WARNING: atoms too close: (T0371)P120.CA and (T0371)F209.CA only 0.000 apart, marking (T0371)P120.CA as missing WARNING: atoms too close: (T0371)L119.CA and (T0371)F209.CA only 0.000 apart, marking (T0371)L119.CA as missing WARNING: atoms too close: (T0371)M118.CA and (T0371)F209.CA only 0.000 apart, marking (T0371)M118.CA as missing WARNING: atoms too close: (T0371)K117.CA and (T0371)F209.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)F209.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)F209.CA only 0.000 apart, marking (T0371)F209.CA as missing WARNING: atoms too close: (T0371)M208.O and (T0371)F209.O only 0.000 apart, marking (T0371)F209.O as missing WARNING: atoms too close: (T0371)Q207.O and (T0371)F209.O only 0.000 apart, marking (T0371)F209.O as missing WARNING: atoms too close: (T0371)I183.O and (T0371)F209.O only 0.000 apart, marking (T0371)F209.O as missing WARNING: atoms too close: (T0371)P162.O and (T0371)F209.O only 0.000 apart, marking (T0371)F209.O as missing WARNING: atoms too close: (T0371)W145.O and (T0371)F209.O only 0.000 apart, marking (T0371)F209.O as missing WARNING: atoms too close: (T0371)E131.O and (T0371)F209.O only 0.000 apart, marking (T0371)F209.O as missing WARNING: atoms too close: (T0371)G130.O and (T0371)F209.O only 0.000 apart, marking (T0371)F209.O as missing WARNING: atoms too close: (T0371)I129.O and (T0371)F209.O only 0.000 apart, marking (T0371)F209.O as missing WARNING: atoms too close: (T0371)V121.O and (T0371)F209.O only 0.000 apart, marking (T0371)F209.O as missing WARNING: atoms too close: (T0371)P120.O and (T0371)F209.O only 0.000 apart, marking (T0371)F209.O as missing WARNING: atoms too close: (T0371)L119.O and (T0371)F209.O only 0.000 apart, marking (T0371)F209.O as missing WARNING: atoms too close: (T0371)M118.O and (T0371)F209.O only 0.000 apart, marking (T0371)F209.O as missing WARNING: atoms too close: (T0371)K117.O and (T0371)F209.O only 0.000 apart, marking (T0371)F209.O as missing WARNING: atoms too close: (T0371)I116.O and (T0371)F209.O only 0.000 apart, marking (T0371)F209.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)F209.O only 0.000 apart, marking (T0371)F209.O as missing WARNING: atoms too close: (T0371)M208.C and (T0371)F209.C only 0.000 apart, marking (T0371)F209.C as missing WARNING: atoms too close: (T0371)Q207.C and (T0371)F209.C only 0.000 apart, marking (T0371)F209.C as missing WARNING: atoms too close: (T0371)I183.C and (T0371)F209.C only 0.000 apart, marking (T0371)F209.C as missing WARNING: atoms too close: (T0371)P162.C and (T0371)F209.C only 0.000 apart, marking (T0371)F209.C as missing WARNING: atoms too close: (T0371)W145.C and (T0371)F209.C only 0.000 apart, marking (T0371)F209.C as missing WARNING: atoms too close: (T0371)E131.C and (T0371)F209.C only 0.000 apart, marking (T0371)F209.C as missing WARNING: atoms too close: (T0371)G130.C and (T0371)F209.C only 0.000 apart, marking (T0371)F209.C as missing WARNING: atoms too close: (T0371)I129.C and (T0371)F209.C only 0.000 apart, marking (T0371)F209.C as missing WARNING: atoms too close: (T0371)V121.C and (T0371)F209.C only 0.000 apart, marking (T0371)F209.C as missing WARNING: atoms too close: (T0371)P120.C and (T0371)F209.C only 0.000 apart, marking (T0371)F209.C as missing WARNING: atoms too close: (T0371)L119.C and (T0371)F209.C only 0.000 apart, marking (T0371)F209.C as missing WARNING: atoms too close: (T0371)M118.C and (T0371)F209.C only 0.000 apart, marking (T0371)F209.C as missing WARNING: atoms too close: (T0371)K117.C and (T0371)F209.C only 0.000 apart, marking (T0371)F209.C as missing WARNING: atoms too close: (T0371)I116.C and (T0371)F209.C only 0.000 apart, marking (T0371)F209.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)F209.C only 0.000 apart, marking (T0371)F209.C as missing WARNING: atoms too close: (T0371)F209.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)F209.CA as missing WARNING: atoms too close: (T0371)M208.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)M208.CA as missing WARNING: atoms too close: (T0371)Q207.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)Q207.CA as missing WARNING: atoms too close: (T0371)I183.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)I183.CA as missing WARNING: atoms too close: (T0371)P162.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)P162.CA as missing WARNING: atoms too close: (T0371)W145.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)W145.CA as missing WARNING: atoms too close: (T0371)E131.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)E131.CA as missing WARNING: atoms too close: (T0371)G130.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)G130.CA as missing WARNING: atoms too close: (T0371)I129.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)I129.CA as missing WARNING: atoms too close: (T0371)V121.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)V121.CA as missing WARNING: atoms too close: (T0371)P120.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)P120.CA as missing WARNING: atoms too close: (T0371)L119.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)L119.CA as missing WARNING: atoms too close: (T0371)M118.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)M118.CA as missing WARNING: atoms too close: (T0371)K117.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)K117.CA as missing WARNING: atoms too close: (T0371)I116.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)I116.CA as missing WARNING: atoms too close: (T0371)F72.CA and (T0371)M210.CA only 0.000 apart, marking (T0371)M210.CA as missing WARNING: atoms too close: (T0371)F209.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)M208.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)Q207.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)I183.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)P162.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)W145.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)E131.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)G130.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)I129.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)V121.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)P120.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)L119.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)M118.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)K117.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)I116.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)F72.O and (T0371)M210.O only 0.000 apart, marking (T0371)M210.O as missing WARNING: atoms too close: (T0371)F209.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing WARNING: atoms too close: (T0371)M208.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing WARNING: atoms too close: (T0371)Q207.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing WARNING: atoms too close: (T0371)I183.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing WARNING: atoms too close: (T0371)P162.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing WARNING: atoms too close: (T0371)W145.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing WARNING: atoms too close: (T0371)E131.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing WARNING: atoms too close: (T0371)G130.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing WARNING: atoms too close: (T0371)I129.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing WARNING: atoms too close: (T0371)V121.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing WARNING: atoms too close: (T0371)P120.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing WARNING: atoms too close: (T0371)L119.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing WARNING: atoms too close: (T0371)M118.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing WARNING: atoms too close: (T0371)K117.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing WARNING: atoms too close: (T0371)I116.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing WARNING: atoms too close: (T0371)F72.C and (T0371)M210.C only 0.000 apart, marking (T0371)M210.C as missing # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation panther3_TS1 # ReadConformPDB reading from PDB file servers/shub_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0371 can't currently be optimized by undertaker # naming current conformation shub_TS1 # command:Using radius: 8.0000 Metaserver mode NUMB_ALIGNS: 264 Adding 10906 constraints to all.constraints Done adding distance constraints # command:Reading probabilities from probabilities.dat Reading constraints from ConstraintSet all.constraints maxweight: 216.0000 Optimizing... Probability sum: -512.4087, CN propb: -512.4087 weights: 0.3691 constraints: 901 # command:Found ConstraintSet # PrintContacts align.constraints_meta01 Number of constraints in align.constraints 901 # command:Found ConstraintSet # PrintContacts align_bonus.constraints_meta01 Number of constraints in align.constraints.bonus 901 # command:Found ConstraintSet # PrintContacts rejected.constraints_meta01 Number of constraints in rejected.constraints 10005 # command:Found ConstraintSet # PrintContacts rejected_bonus.constraints_meta01 Number of constraints in rejected.constraints.bonus 10005 # command:Found ConstraintSet # PrintContacts non_contacts.constraints_meta01 Number of constraints in noncontact.constraints 0 # command:Found ConstraintSet # PrintContacts non_contacts_bonus.constraints_meta01 Number of constraints in noncontact.constraints.bonus 0 # command:Found ConstraintSet # PrintContacts all.constraints_meta01 Number of constraints in all.constraints 10906 # command: