make[1]: Entering directory `/projects/compbio/experiments/protein-predict/casp7/T0365' /projects/compbio/experiments/protein-predict/casp7/starter-directory/Make.main:725: SECONDARY_TARGET = T0365.t06.str2 mkdir -p decoys rm decoys/read-pdb+servers.under cd decoys; shopt -s nullglob ; for x in ../*.ts-submitted* ; do echo ReadConformPDB $x >> read-pdb+servers.under ; done cd decoys; shopt -s nullglob ; for x in *.pdb* ; do echo ReadConformPDB $x >> read-pdb+servers.under ; done cd decoys; shopt -s nullglob ; for x in ../*mer/decoys/*.pdb* ; \ do echo ReadConformPDB $x chain A >> read-pdb+servers.under ; \ y=${x#../} ;\ z=${y/decoys} ;\ a=${z/T0365.} ;\ b=${a%.gz} ;\ c=${b%.pdb} ;\ echo NameConform $c >> read-pdb+servers.under ; \ done cd decoys; shopt -s nullglob ; for x in servers/*.pdb.gz ; do \ echo ReadConformPDB $x >> read-pdb+servers.under ; \ y=${x%.pdb.gz} ; \ z=${y#servers/} ; \ echo NameConform $z >> read-pdb+servers.under ; \ echo SCWRLConform >> read-pdb+servers.under ; \ echo NameConform $z-scwrl >> read-pdb+servers.under ; \ done chgrp protein decoys/read-pdb+servers.under chmod g+w decoys/read-pdb+servers.under rm -f decoys/evaluate.anglevector.rdb sed -e s/XXX0000/T0365/ -e s/START_COL/1/ \ -e s/COSTFCN/anglevector/ \ -e s/_domain// \ -e s/read-pdb/read-pdb+servers/ \ -e s/REAL_PDB/2iiuA/ \ < /projects/compbio/experiments/protein-predict/casp7/starter-directory/evaluate.under \ | nice -2 /cse/grads/jarchie/projects/cvs/karplus/undertaker/undertaker # command:# Seed set to 1182745447 # command:# Prefix for input files set to /projects/compbio/experiments/undertaker/atoms-inputs/ # command:# reading monomeric-50pc.atoms # #computed average backbone with maximum peptide_sq_deviance = 0.002 # computed average trans backbone unit from 8101 examples # computed average cis backbone unit from 20 examples # computed average trans backbone unit before proline from 332 examples # trans (non-proline) backbone unit: # CA= -2.2101 1.0129 -0.0033 # O= -0.1508 2.2440 0.0016 # C= -0.6897 1.1364 -0.0000 # N+1= 0.0000 0.0000 0.0000 # CA+1= 1.4583 -0.0000 -0.0000 # cis backbone unit: # CA= -0.1438 2.4522 0.0007 # O= -2.0283 0.9702 0.0005 # C= -0.8017 1.0759 0.0000 # N+1= 0.0000 0.0000 0.0000 # CA+1= 1.4664 -0.0000 0.0000 # trans backbone unit before proline: # CA= -2.2110 1.0636 -0.0014 # O= -0.1234 2.2469 0.0075 # C= -0.6877 1.1518 0.0000 # N+1= 0.0000 0.0000 0.0000 # CA+1= 1.4665 0.0000 0.0000 # After reading monomeric-50pc.atoms have 448 chains in training database # Count of chains,residues,atoms: 448,112605,876684 # 111048 residues have no bad marker # 665 residues lack atoms needed to compute omega # 322 residues have cis peptide # number of each bad type: # NON_STANDARD_RESIDUE 6 # HAS_OXT 325 # TOO_MANY_ATOMS 1 # TOO_FEW_ATOMS 523 # HAS_UNKNOWN_ATOMS 2 # HAS_DUPLICATE_ATOMS 0 # CHAIN_BREAK_BEFORE 208 # NON_PLANAR_PEPTIDE 143 # BAD_PEPTIDE 685 # Note: may sum to more than number of residues, # because one residue may have multiple problems # command:# Reading rotamer library from dunbrack-1332.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:CPU_time= 9.280 sec, elapsed time= 19.034 sec. # command:# Reading spots from monomeric-50pc-dry-5.spot Read prototypes from /projects/compbio/experiments/undertaker/spots/../normalize_prototypes/prototypes # reading histogram from smoothed-monomeric-50pc-dry-5.hist # created burial cost function dry5 with radius 5.000 with spots at monomeric-50pc-dry-5.spot # command:# Reading spots from monomeric-50pc-wet-6.5.spot Read prototypes from /projects/compbio/experiments/undertaker/spots/../normalize_prototypes/prototypes # reading histogram from smoothed-monomeric-50pc-wet-6.5.hist # created burial cost function wet6.5 with radius 6.500 with spots at monomeric-50pc-wet-6.5.spot # command:# Reading spots from monomeric-50pc-dry-6.5.spot Read prototypes from /projects/compbio/experiments/undertaker/spots/../normalize_prototypes/prototypes # reading histogram from smoothed-monomeric-50pc-dry-6.5.hist # created burial cost function dry6.5 with radius 6.500 with spots at monomeric-50pc-dry-6.5.spot # command:# Reading spots from monomeric-50pc-generic-6.5.spot Read prototypes from /projects/compbio/experiments/undertaker/spots/../normalize_prototypes/prototypes # reading histogram from smoothed-monomeric-50pc-generic-6.5.hist # created burial cost function gen6.5 with radius 6.500 with spots at monomeric-50pc-generic-6.5.spot # command:# Reading spots from near-backbone-center.spot # reading histogram from smoothed-near-backbone-2spot.hist # Reading spots from near-backbone-count.spot # created burial cost function near_backbone with radius 9.650 with spots at near-backbone-center.spot counting only near-backbone-count.spot # command:# Reading spots from way-back-center.spot # reading histogram from smoothed-way-back-2spot.hist # Reading spots from way-back-count.spot # created burial cost function way_back with radius 8.900 with spots at way-back-center.spot counting only way-back-count.spot # command:# Reading spots from monomeric-50pc-dry-8.spot Read prototypes from /projects/compbio/experiments/undertaker/spots/../normalize_prototypes/prototypes # reading histogram from smoothed-monomeric-50pc-dry-8.hist # created burial cost function dry8 with radius 8.000 with spots at monomeric-50pc-dry-8.spot # command:# Reading spots from monomeric-50pc-dry-10.spot Read prototypes from /projects/compbio/experiments/undertaker/spots/../normalize_prototypes/prototypes # reading histogram from smoothed-monomeric-50pc-dry-10.hist # created burial cost function dry10 with radius 10.000 with spots at monomeric-50pc-dry-10.spot # command:# Reading spots from monomeric-50pc-dry-12.spot Read prototypes from /projects/compbio/experiments/undertaker/spots/../normalize_prototypes/prototypes # reading histogram from smoothed-monomeric-50pc-dry-12.hist # created burial cost function dry12 with radius 12.000 with spots at monomeric-50pc-dry-12.spot # command:# reading histogram from dunbrack-2191-alpha.hist # created alpha cost function alpha with offset 0 and 360 bins # command:# reading histogram from dunbrack-2191-alpha-1.hist # created alpha cost function alpha_prev with offset -1 and 360 bins # command:# Prefix for input files set to /projects/compbio/lib/alphabet/ # command:# Read 3 alphabets from alpha.alphabet # command:CPU_time= 9.403 sec, elapsed time= 19.349 sec. # command:# Prefix for input files set to # command:# Making conformation for sequence T0365 numbered 1 through 226 Created new target T0365 from T0365.a2m # command:# command:# No conformations to remove in PopConform # command:# cleared Id set # command:# command:2iiuA expands to /projects/compbio/data/pdb/2iiu.pdb.gz 2iiuA:Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Skipped atom 227, because occupancy 0.5 <= existing 0.500 in 2iiuA Skipped atom 229, because occupancy 0.500 <= existing 0.500 in 2iiuA Skipped atom 231, because occupancy 0.500 <= existing 0.500 in 2iiuA Skipped atom 233, because occupancy 0.500 <= existing 0.500 in 2iiuA Skipped atom 235, because occupancy 0.500 <= existing 0.500 in 2iiuA Skipped atom 237, because occupancy 0.500 <= existing 0.500 in 2iiuA Skipped atom 239, because occupancy 0.500 <= existing 0.500 in 2iiuA Skipped atom 241, because occupancy 0.500 <= existing 0.500 in 2iiuA Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Skipped atom 607, because occupancy 0.500 <= existing 0.500 in 2iiuA Skipped atom 609, because occupancy 0.500 <= existing 0.500 in 2iiuA Skipped atom 611, because occupancy 0.500 <= existing 0.500 in 2iiuA Skipped atom 613, because occupancy 0.500 <= existing 0.500 in 2iiuA Skipped atom 615, because occupancy 0.500 <= existing 0.500 in 2iiuA Skipped atom 617, because occupancy 0.500 <= existing 0.500 in 2iiuA Skipped atom 619, because occupancy 0.500 <= existing 0.500 in 2iiuA Skipped atom 621, because occupancy 0.500 <= existing 0.500 in 2iiuA Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Skipped atom 1381, because occupancy 0.300 <= existing 0.700 in 2iiuA Skipped atom 1383, because occupancy 0.300 <= existing 0.700 in 2iiuA Skipped atom 1385, because occupancy 0.300 <= existing 0.700 in 2iiuA Skipped atom 1387, because occupancy 0.300 <= existing 0.700 in 2iiuA Skipped atom 1389, because occupancy 0.300 <= existing 0.700 in 2iiuA Skipped atom 1391, because occupancy 0.300 <= existing 0.700 in 2iiuA Skipped atom 1393, because occupancy 0.300 <= existing 0.700 in 2iiuA Skipped atom 1395, because occupancy 0.300 <= existing 0.700 in 2iiuA Skipped atom 1397, because occupancy 0.300 <= existing 0.700 in 2iiuA Skipped atom 1399, because occupancy 0.300 <= existing 0.700 in 2iiuA Skipped atom 1401, because occupancy 0.300 <= existing 0.700 in 2iiuA Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Read 208 residues and 1591 atoms. # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # command:# Saving current conformation as real # command:# Prefix for output files set to decoys/ # command:# SetRealCost created real_cost = # ( 50.000 * real_hbond + 50.000 * real_hbond_u + 50.000 * decoy_hbond + 50.000 * decoy_hbond_u + 10.000 * real_NO_hbond + 10.000 * real_NO_hbond_u + 10.000 * decoy_NO_hbond + 10.000 * decoy_NO_hbond_u + 10.000 * knot + 200.000 * clens + 0.000 * rmsd + 35.000 * log_rmsd + 0.000 * rmsd_ca + 30.000 * log_rmsd_ca + 1.000 * GDT + 1.000 * smooth_GDT + 0.200 * missing_atoms ) # command:# SetCost created cost = # ) # command:# reading script from file anglevector.costfcn # Prefix for input files set to /projects/compbio/lib/alphabet/ # Read 2 alphabets from anglevector.alphabet # Prefix for input files set to # CreateCombinedNNet created CombinedNNet bys_t2k # CreateCombinedNNet created CombinedNNet bys_t04 # CreateCombinedNNet created CombinedNNet bys_t06 # CreateCombinedNNet created CombinedNNet bys_mean # created predicted AngleVectorPredCostFcn pred_bys_t2k # created predicted AngleVectorPredCostFcn pred_bys_t04 # created predicted AngleVectorPredCostFcn pred_bys_t06 # created predicted AngleVectorPredCostFcn pred_bys_mean # CreateCombinedNNet created CombinedNNet pb_t2k # CreateCombinedNNet created CombinedNNet pb_t04 # CreateCombinedNNet created CombinedNNet pb_t06 # CreateCombinedNNet created CombinedNNet pb_mean # created predicted AngleVectorPredCostFcn pred_pb_t2k # created predicted AngleVectorPredCostFcn pred_pb_t04 # created predicted AngleVectorPredCostFcn pred_pb_t06 # created predicted AngleVectorPredCostFcn pred_pb_mean # SetCost created cost = # ( 5.000 * bystroff + 5.000 * pred_bys_t2k + 5.000 * pred_bys_t04 + 5.000 * pred_bys_t06 + 5.000 * pred_bys_mean + 5.000 * pred_pb_t2k + 5.000 * pred_pb_t04 + 5.000 * pred_pb_t06 + 5.000 * pred_pb_mean ) # command:CPU_time= 13.644 sec, elapsed time= 28.451 sec. # command:# Prefix for input files set to # command:# ReadConformPDB reading from PDB file model1.ts-submitted looking for model 1 # choosing archetypes in rotamer library # Found a chain break before 192 # copying to AlignedFragments data structure # command:Warning: Couldn't open file decoys/model1.gdt for output # fraction of real conformation used = 1.000 # GDT_score = -51.923 # GDT_score(maxd=8.000,maxw=2.900)= -49.760 # GDT_score(maxd=8.000,maxw=3.200)= -46.527 # GDT_score(maxd=8.000,maxw=3.500)= -43.589 # GDT_score(maxd=10.000,maxw=3.800)= -48.315 # GDT_score(maxd=10.000,maxw=4.000)= -46.416 # GDT_score(maxd=10.000,maxw=4.200)= -44.642 # GDT_score(maxd=12.000,maxw=4.300)= -49.357 # GDT_score(maxd=12.000,maxw=4.500)= -47.569 # GDT_score(maxd=12.000,maxw=4.700)= -45.890 # GDT_score(maxd=14.000,maxw=5.200)= -46.140 # GDT_score(maxd=14.000,maxw=5.500)= -43.989 # command:# Prefix for output files set to # command:Warning: Couldn't open file T0365.model1-real.pdb for output Error: Couldn't open file T0365.model1-real.pdb for output superimposing iter= 0 total_weight= 2423.000 rmsd (weighted)= 5.270 (unweighted)= 14.805 superimposing iter= 1 total_weight= 4866.052 rmsd (weighted)= 2.900 (unweighted)= 14.889 superimposing iter= 2 total_weight= 2314.453 rmsd (weighted)= 2.376 (unweighted)= 14.927 superimposing iter= 3 total_weight= 1831.531 rmsd (weighted)= 2.203 (unweighted)= 14.945 superimposing iter= 4 total_weight= 1679.517 rmsd (weighted)= 2.137 (unweighted)= 14.953 superimposing iter= 5 total_weight= 1625.198 rmsd (weighted)= 2.108 (unweighted)= 14.957 EXPDTA model1.ts-submitted MODEL 1 REMARK 44 REMARK 44 model 1 is called model1.ts-submitted ATOM 1 N MET A 1 -5.963 0.828 -3.148 1.00 0.00 ATOM 2 CA MET A 1 -7.273 1.518 -3.330 1.00 0.00 ATOM 3 CB MET A 1 -8.124 1.375 -2.065 1.00 0.00 ATOM 4 CG MET A 1 -7.497 1.978 -0.818 1.00 0.00 ATOM 5 SD MET A 1 -8.525 1.769 0.652 1.00 0.00 ATOM 6 CE MET A 1 -9.640 3.156 0.485 1.00 0.00 ATOM 7 O MET A 1 -5.923 3.474 -3.615 1.00 0.00 ATOM 8 C MET A 1 -7.059 2.995 -3.654 1.00 0.00 ATOM 9 N PRO A 2 -7.995 3.676 -4.276 1.00 0.00 ATOM 10 CA PRO A 2 -7.775 5.083 -4.660 1.00 0.00 ATOM 11 CB PRO A 2 -9.103 5.507 -5.304 1.00 0.00 ATOM 12 CG PRO A 2 -9.717 4.218 -5.774 1.00 0.00 ATOM 13 CD PRO A 2 -9.282 3.147 -4.763 1.00 0.00 ATOM 14 O PRO A 2 -6.496 6.824 -3.645 1.00 0.00 ATOM 15 C PRO A 2 -7.306 5.918 -3.481 1.00 0.00 ATOM 16 N VAL A 3 -7.797 5.625 -2.279 1.00 0.00 ATOM 17 CA VAL A 3 -7.410 6.391 -1.093 1.00 0.00 ATOM 18 CB VAL A 3 -8.266 5.989 0.112 1.00 0.00 ATOM 19 CG1 VAL A 3 -7.638 6.434 1.384 1.00 0.00 ATOM 20 CG2 VAL A 3 -9.668 6.618 -0.012 1.00 0.00 ATOM 21 O VAL A 3 -5.177 7.122 -0.503 1.00 0.00 ATOM 22 C VAL A 3 -5.928 6.178 -0.805 1.00 0.00 ATOM 23 N ASN A 4 -5.448 4.936 -0.857 1.00 0.00 ATOM 24 CA ASN A 4 -4.022 4.698 -0.633 1.00 0.00 ATOM 25 CB ASN A 4 -3.668 3.232 -0.782 1.00 0.00 ATOM 26 CG ASN A 4 -2.325 2.805 -0.375 1.00 0.00 ATOM 27 ND2 ASN A 4 -1.437 2.408 -1.269 1.00 0.00 ATOM 28 OD1 ASN A 4 -2.185 2.842 0.846 1.00 0.00 ATOM 29 O ASN A 4 -2.144 6.065 -1.237 1.00 0.00 ATOM 30 C ASN A 4 -3.174 5.491 -1.617 1.00 0.00 ATOM 31 N SER A 5 -3.536 5.512 -2.910 1.00 0.00 ATOM 32 CA SER A 5 -2.755 6.231 -3.892 1.00 0.00 ATOM 33 CB SER A 5 -3.222 5.879 -5.274 1.00 0.00 ATOM 34 OG SER A 5 -2.958 4.543 -5.596 1.00 0.00 ATOM 35 O SER A 5 -1.825 8.436 -3.762 1.00 0.00 ATOM 36 C SER A 5 -2.833 7.731 -3.675 1.00 0.00 ATOM 37 N ILE A 6 -4.027 8.245 -3.416 1.00 0.00 ATOM 38 CA ILE A 6 -4.201 9.672 -3.162 1.00 0.00 ATOM 39 CB ILE A 6 -5.658 10.002 -2.892 1.00 0.00 ATOM 40 CG1 ILE A 6 -6.472 9.793 -4.179 1.00 0.00 ATOM 41 CG2 ILE A 6 -5.783 11.431 -2.373 1.00 0.00 ATOM 42 CD1 ILE A 6 -7.989 9.904 -3.947 1.00 0.00 ATOM 43 O ILE A 6 -2.695 11.141 -2.008 1.00 0.00 ATOM 44 C ILE A 6 -3.393 10.127 -1.954 1.00 0.00 ATOM 45 N LEU A 7 -3.456 9.353 -0.874 1.00 0.00 ATOM 46 CA LEU A 7 -2.723 9.703 0.335 1.00 0.00 ATOM 47 CB LEU A 7 -2.920 8.660 1.430 1.00 0.00 ATOM 48 CG LEU A 7 -4.351 8.316 1.848 1.00 0.00 ATOM 49 CD1 LEU A 7 -4.274 7.571 3.177 1.00 0.00 ATOM 50 CD2 LEU A 7 -5.209 9.574 1.991 1.00 0.00 ATOM 51 O LEU A 7 -0.542 10.554 0.793 1.00 0.00 ATOM 52 C LEU A 7 -1.209 9.739 0.165 1.00 0.00 ATOM 53 N GLY A 8 -0.656 8.841 -0.640 1.00 0.00 ATOM 54 CA GLY A 8 0.789 8.805 -0.863 1.00 0.00 ATOM 55 O GLY A 8 2.324 10.672 -0.983 1.00 0.00 ATOM 56 C GLY A 8 1.295 10.135 -1.416 1.00 0.00 ATOM 57 N VAL A 9 0.531 10.738 -2.370 1.00 0.00 ATOM 58 CA VAL A 9 0.893 12.011 -2.978 1.00 0.00 ATOM 59 CB VAL A 9 -0.074 12.272 -4.165 1.00 0.00 ATOM 60 CG1 VAL A 9 0.064 13.713 -4.651 1.00 0.00 ATOM 61 CG2 VAL A 9 0.218 11.296 -5.298 1.00 0.00 ATOM 62 O VAL A 9 1.699 13.924 -1.743 1.00 0.00 ATOM 63 C VAL A 9 0.794 13.102 -1.903 1.00 0.00 ATOM 64 N PHE A 10 -0.299 13.083 -1.172 1.00 0.00 ATOM 65 CA PHE A 10 -0.506 14.073 -0.114 1.00 0.00 ATOM 66 CB PHE A 10 -1.797 14.035 0.579 1.00 0.00 ATOM 67 CG PHE A 10 -2.966 14.277 -0.355 1.00 0.00 ATOM 68 CD1 PHE A 10 -2.850 15.104 -1.493 1.00 0.00 ATOM 69 CD2 PHE A 10 -4.202 13.661 -0.095 1.00 0.00 ATOM 70 CE1 PHE A 10 -3.954 15.315 -2.368 1.00 0.00 ATOM 71 CE2 PHE A 10 -5.317 13.859 -0.957 1.00 0.00 ATOM 72 CZ PHE A 10 -5.192 14.688 -2.098 1.00 0.00 ATOM 73 O PHE A 10 1.087 14.834 1.540 1.00 0.00 ATOM 74 C PHE A 10 0.494 13.873 1.036 1.00 0.00 ATOM 75 N ALA A 11 0.641 12.644 1.467 1.00 0.00 ATOM 76 CA ALA A 11 1.379 12.367 2.709 1.00 0.00 ATOM 77 CB ALA A 11 1.407 10.872 2.993 1.00 0.00 ATOM 78 O ALA A 11 3.321 13.432 3.630 1.00 0.00 ATOM 79 C ALA A 11 2.831 12.844 2.666 1.00 0.00 ATOM 80 N LYS A 12 3.520 12.584 1.559 1.00 0.00 ATOM 81 CA LYS A 12 4.909 13.020 1.417 1.00 0.00 ATOM 82 CB LYS A 12 5.513 12.410 0.140 1.00 0.00 ATOM 83 CG LYS A 12 5.713 10.919 0.214 1.00 0.00 ATOM 84 CD LYS A 12 6.240 10.373 -1.105 1.00 0.00 ATOM 85 CE LYS A 12 6.431 8.868 -1.045 1.00 0.00 ATOM 86 NZ LYS A 12 7.370 8.493 0.058 1.00 0.00 ATOM 87 O LYS A 12 5.879 15.126 2.032 1.00 0.00 ATOM 88 C LYS A 12 4.998 14.538 1.403 1.00 0.00 ATOM 89 N SER A 13 4.083 15.158 0.652 1.00 0.00 ATOM 90 CA SER A 13 4.068 16.618 0.561 1.00 0.00 ATOM 91 CB SER A 13 3.041 17.078 -0.473 1.00 0.00 ATOM 92 OG SER A 13 3.419 16.682 -1.780 1.00 0.00 ATOM 93 O SER A 13 4.351 18.153 2.412 1.00 0.00 ATOM 94 C SER A 13 3.698 17.219 1.919 1.00 0.00 ATOM 95 N PRO A 14 2.652 16.700 2.577 1.00 0.00 ATOM 96 CA PRO A 14 2.246 17.186 3.875 1.00 0.00 ATOM 97 CB PRO A 14 0.771 16.861 3.992 1.00 0.00 ATOM 98 CG PRO A 14 0.515 15.863 2.892 1.00 0.00 ATOM 99 CD PRO A 14 1.418 16.335 1.796 1.00 0.00 ATOM 100 O PRO A 14 3.220 17.459 6.057 1.00 0.00 ATOM 101 C PRO A 14 3.383 17.160 4.877 1.00 0.00 ATOM 102 N ILE A 15 4.652 16.732 4.470 1.00 0.00 ATOM 103 CA ILE A 15 5.758 16.676 5.410 1.00 0.00 ATOM 104 CB ILE A 15 7.082 16.312 4.606 1.00 0.00 ATOM 105 CG1 ILE A 15 7.038 14.851 4.157 1.00 0.00 ATOM 106 CG2 ILE A 15 8.316 16.564 5.453 1.00 0.00 ATOM 107 CD1 ILE A 15 8.246 14.418 3.337 1.00 0.00 ATOM 108 O ILE A 15 6.313 17.933 7.407 1.00 0.00 ATOM 109 C ILE A 15 6.008 17.967 6.196 1.00 0.00 ATOM 110 N LYS A 16 5.868 19.107 5.527 1.00 0.00 ATOM 111 CA LYS A 16 6.102 20.393 6.182 1.00 0.00 ATOM 112 CB LYS A 16 6.019 21.570 5.219 1.00 0.00 ATOM 113 CG LYS A 16 7.142 21.574 4.194 1.00 0.00 ATOM 114 CD LYS A 16 8.516 21.856 4.761 1.00 0.00 ATOM 115 CE LYS A 16 8.710 23.292 5.217 1.00 0.00 ATOM 116 NZ LYS A 16 10.039 23.515 5.882 1.00 0.00 ATOM 117 O LYS A 16 5.409 20.923 8.420 1.00 0.00 ATOM 118 C LYS A 16 5.076 20.530 7.277 1.00 0.00 ATOM 119 N PRO A 17 3.795 20.187 7.046 1.00 0.00 ATOM 120 CA PRO A 17 2.834 20.319 8.127 1.00 0.00 ATOM 121 CB PRO A 17 1.441 20.053 7.462 1.00 0.00 ATOM 122 CG PRO A 17 1.664 20.547 6.033 1.00 0.00 ATOM 123 CD PRO A 17 3.176 20.380 5.716 1.00 0.00 ATOM 124 O PRO A 17 2.949 19.740 10.421 1.00 0.00 ATOM 125 C PRO A 17 3.181 19.394 9.262 1.00 0.00 ATOM 126 N LEU A 18 3.740 18.225 8.936 1.00 0.00 ATOM 127 CA LEU A 18 4.147 17.242 9.945 1.00 0.00 ATOM 128 CB LEU A 18 4.536 15.931 9.370 1.00 0.00 ATOM 129 CG LEU A 18 4.714 14.908 10.500 1.00 0.00 ATOM 130 CD1 LEU A 18 3.369 14.311 10.838 1.00 0.00 ATOM 131 CD2 LEU A 18 5.698 13.839 10.076 1.00 0.00 ATOM 132 O LEU A 18 5.368 17.685 11.959 1.00 0.00 ATOM 133 C LEU A 18 5.331 17.794 10.736 1.00 0.00 ATOM 134 N GLN A 19 6.307 18.405 10.044 1.00 0.00 ATOM 135 CA GLN A 19 7.461 18.976 10.726 1.00 0.00 ATOM 136 CB GLN A 19 8.452 19.586 9.708 1.00 0.00 ATOM 137 CG GLN A 19 9.054 18.534 8.754 1.00 0.00 ATOM 138 CD GLN A 19 9.832 19.178 7.667 1.00 0.00 ATOM 139 OE1 GLN A 19 9.261 19.754 6.716 1.00 0.00 ATOM 140 NE2 GLN A 19 11.178 19.075 7.753 1.00 0.00 ATOM 141 O GLN A 19 7.421 20.100 12.884 1.00 0.00 ATOM 142 C GLN A 19 6.964 20.051 11.722 1.00 0.00 ATOM 143 N GLU A 20 6.061 20.946 11.276 1.00 0.00 ATOM 144 CA GLU A 20 5.535 21.963 12.180 1.00 0.00 ATOM 145 CB GLU A 20 4.540 22.872 11.398 1.00 0.00 ATOM 146 CG GLU A 20 4.091 24.093 12.189 1.00 0.00 ATOM 147 CD GLU A 20 2.987 24.871 11.504 1.00 0.00 ATOM 148 OE1 GLU A 20 3.164 25.257 10.328 1.00 0.00 ATOM 149 OE2 GLU A 20 1.942 25.104 12.146 1.00 0.00 ATOM 150 O GLU A 20 5.043 21.830 14.532 1.00 0.00 ATOM 151 C GLU A 20 4.833 21.375 13.405 1.00 0.00 ATOM 152 N HIS A 21 4.053 20.353 13.163 1.00 0.00 ATOM 153 CA HIS A 21 3.357 19.698 14.263 1.00 0.00 ATOM 154 CB HIS A 21 2.508 18.550 13.713 1.00 0.00 ATOM 155 CG HIS A 21 1.611 17.921 14.731 1.00 0.00 ATOM 156 CD2 HIS A 21 1.257 18.200 16.118 1.00 0.00 ATOM 157 ND1 HIS A 21 0.856 16.798 14.468 1.00 0.00 ATOM 158 CE1 HIS A 21 0.157 16.472 15.570 1.00 0.00 ATOM 159 NE2 HIS A 21 0.390 17.309 16.562 1.00 0.00 ATOM 160 O HIS A 21 4.180 19.076 16.420 1.00 0.00 ATOM 161 C HIS A 21 4.364 19.044 15.218 1.00 0.00 ATOM 162 N MET A 22 5.442 18.456 14.695 1.00 0.00 ATOM 163 CA MET A 22 6.443 17.804 15.527 1.00 0.00 ATOM 164 CB MET A 22 7.386 16.964 14.680 1.00 0.00 ATOM 165 CG MET A 22 6.710 15.819 13.935 1.00 0.00 ATOM 166 SD MET A 22 5.784 14.714 15.015 1.00 0.00 ATOM 167 CE MET A 22 4.373 14.328 13.896 1.00 0.00 ATOM 168 O MET A 22 7.477 18.647 17.526 1.00 0.00 ATOM 169 C MET A 22 7.202 18.847 16.341 1.00 0.00 ATOM 170 N ASP A 23 7.556 19.955 15.678 1.00 0.00 ATOM 171 CA ASP A 23 8.258 21.062 16.346 1.00 0.00 ATOM 172 CB ASP A 23 8.632 22.164 15.354 1.00 0.00 ATOM 173 CG ASP A 23 9.784 21.771 14.453 1.00 0.00 ATOM 174 OD1 ASP A 23 10.445 20.750 14.743 1.00 0.00 ATOM 175 OD2 ASP A 23 10.030 22.483 13.456 1.00 0.00 ATOM 176 O ASP A 23 7.853 21.928 18.545 1.00 0.00 ATOM 177 C ASP A 23 7.385 21.621 17.457 1.00 0.00 ATOM 178 N LYS A 24 6.102 21.776 17.199 1.00 0.00 ATOM 179 CA LYS A 24 5.164 22.209 18.288 1.00 0.00 ATOM 180 CB LYS A 24 3.724 22.211 17.758 1.00 0.00 ATOM 181 CG LYS A 24 2.750 22.839 18.746 1.00 0.00 ATOM 182 CD LYS A 24 1.376 23.059 18.138 1.00 0.00 ATOM 183 CE LYS A 24 0.487 23.841 19.091 1.00 0.00 ATOM 184 NZ LYS A 24 -0.884 24.039 18.546 1.00 0.00 ATOM 185 O LYS A 24 5.249 21.782 20.655 1.00 0.00 ATOM 186 C LYS A 24 5.208 21.298 19.524 1.00 0.00 ATOM 187 N VAL A 25 5.178 19.994 19.264 1.00 0.00 ATOM 188 CA VAL A 25 5.287 19.023 20.366 1.00 0.00 ATOM 189 CB VAL A 25 5.170 17.591 19.816 1.00 0.00 ATOM 190 CG1 VAL A 25 5.403 16.577 20.925 1.00 0.00 ATOM 191 CG2 VAL A 25 3.786 17.355 19.232 1.00 0.00 ATOM 192 O VAL A 25 6.631 19.175 22.342 1.00 0.00 ATOM 193 C VAL A 25 6.611 19.162 21.119 1.00 0.00 ATOM 194 N TYR A 26 7.694 19.323 20.363 1.00 0.00 ATOM 195 CA TYR A 26 9.012 19.465 20.947 1.00 0.00 ATOM 196 CB TYR A 26 9.792 20.352 19.761 1.00 0.00 ATOM 197 CG TYR A 26 11.261 20.234 19.421 1.00 0.00 ATOM 198 CD1 TYR A 26 11.683 19.479 18.328 1.00 0.00 ATOM 199 CD2 TYR A 26 12.214 20.976 20.116 1.00 0.00 ATOM 200 CE1 TYR A 26 13.019 19.481 17.927 1.00 0.00 ATOM 201 CE2 TYR A 26 13.550 20.984 19.727 1.00 0.00 ATOM 202 CZ TYR A 26 13.942 20.235 18.629 1.00 0.00 ATOM 203 OH TYR A 26 15.258 20.262 18.227 1.00 0.00 ATOM 204 O TYR A 26 9.669 20.457 22.990 1.00 0.00 ATOM 205 C TYR A 26 9.063 20.609 21.943 1.00 0.00 ATOM 206 N ASP A 27 8.411 21.726 21.627 1.00 0.00 ATOM 207 CA ASP A 27 8.343 22.850 22.544 1.00 0.00 ATOM 208 CB ASP A 27 7.645 24.041 21.882 1.00 0.00 ATOM 209 CG ASP A 27 8.509 24.707 20.826 1.00 0.00 ATOM 210 OD1 ASP A 27 9.721 24.408 20.776 1.00 0.00 ATOM 211 OD2 ASP A 27 7.970 25.522 20.048 1.00 0.00 ATOM 212 O ASP A 27 8.047 22.821 24.913 1.00 0.00 ATOM 213 C ASP A 27 7.592 22.481 23.831 1.00 0.00 ATOM 214 N CYS A 28 6.455 21.789 23.723 1.00 0.00 ATOM 215 CA CYS A 28 5.775 21.286 24.914 1.00 0.00 ATOM 216 CB CYS A 28 4.549 20.521 24.514 1.00 0.00 ATOM 217 SG CYS A 28 3.506 20.025 25.896 1.00 0.00 ATOM 218 O CYS A 28 6.785 20.489 26.941 1.00 0.00 ATOM 219 C CYS A 28 6.745 20.422 25.710 1.00 0.00 ATOM 220 N ALA A 29 7.554 19.614 24.975 1.00 0.00 ATOM 221 CA ALA A 29 8.529 18.735 25.615 1.00 0.00 ATOM 222 CB ALA A 29 9.267 17.882 24.623 1.00 0.00 ATOM 223 O ALA A 29 9.832 19.218 27.583 1.00 0.00 ATOM 224 C ALA A 29 9.549 19.527 26.431 1.00 0.00 ATOM 225 N SER A 30 10.137 20.542 25.786 1.00 0.00 ATOM 226 CA SER A 30 11.126 21.420 26.423 1.00 0.00 ATOM 227 CB SER A 30 11.630 22.496 25.470 1.00 0.00 ATOM 228 OG SER A 30 12.390 21.893 24.425 1.00 0.00 ATOM 229 O SER A 30 11.117 22.239 28.700 1.00 0.00 ATOM 230 C SER A 30 10.461 22.051 27.665 1.00 0.00 ATOM 231 N LEU A 31 9.145 22.341 27.547 1.00 0.00 ATOM 232 CA LEU A 31 8.417 22.922 28.667 1.00 0.00 ATOM 233 CB LEU A 31 6.979 23.196 28.216 1.00 0.00 ATOM 234 CG LEU A 31 6.781 24.386 27.275 1.00 0.00 ATOM 235 CD1 LEU A 31 5.350 24.427 26.758 1.00 0.00 ATOM 236 CD2 LEU A 31 7.065 25.694 27.995 1.00 0.00 ATOM 237 O LEU A 31 8.705 22.387 30.967 1.00 0.00 ATOM 238 C LEU A 31 8.385 21.962 29.859 1.00 0.00 ATOM 239 N LEU A 32 8.026 20.688 29.690 1.00 0.00 ATOM 240 CA LEU A 32 8.010 19.723 30.788 1.00 0.00 ATOM 241 CB LEU A 32 7.318 18.417 30.395 1.00 0.00 ATOM 242 CG LEU A 32 5.816 18.499 30.126 1.00 0.00 ATOM 243 CD1 LEU A 32 5.289 17.174 29.600 1.00 0.00 ATOM 244 CD2 LEU A 32 5.060 18.837 31.402 1.00 0.00 ATOM 245 O LEU A 32 9.634 19.203 32.501 1.00 0.00 ATOM 246 C LEU A 32 9.439 19.462 31.298 1.00 0.00 ATOM 247 N VAL A 33 10.397 19.469 30.382 1.00 0.00 ATOM 248 CA VAL A 33 11.775 19.258 30.797 1.00 0.00 ATOM 249 CB VAL A 33 12.738 19.397 29.601 1.00 0.00 ATOM 250 CG1 VAL A 33 14.183 19.372 30.076 1.00 0.00 ATOM 251 CG2 VAL A 33 12.535 18.256 28.618 1.00 0.00 ATOM 252 O VAL A 33 12.504 20.036 32.941 1.00 0.00 ATOM 253 C VAL A 33 12.067 20.349 31.820 1.00 0.00 ATOM 254 N PRO A 34 11.761 21.627 31.537 1.00 0.00 ATOM 255 CA PRO A 34 11.885 22.647 32.570 1.00 0.00 ATOM 256 CB PRO A 34 11.453 23.917 31.908 1.00 0.00 ATOM 257 CG PRO A 34 11.867 23.766 30.535 1.00 0.00 ATOM 258 CD PRO A 34 11.539 22.292 30.192 1.00 0.00 ATOM 259 O PRO A 34 11.415 22.730 34.899 1.00 0.00 ATOM 260 C PRO A 34 10.986 22.442 33.785 1.00 0.00 ATOM 261 N PHE A 35 9.748 21.943 33.615 1.00 0.00 ATOM 262 CA PHE A 35 8.884 21.726 34.772 1.00 0.00 ATOM 263 CB PHE A 35 7.565 21.130 34.281 1.00 0.00 ATOM 264 CG PHE A 35 6.694 22.107 33.544 1.00 0.00 ATOM 265 CD1 PHE A 35 6.959 23.465 33.594 1.00 0.00 ATOM 266 CD2 PHE A 35 5.615 21.669 32.800 1.00 0.00 ATOM 267 CE1 PHE A 35 6.159 24.366 32.914 1.00 0.00 ATOM 268 CE2 PHE A 35 4.815 22.569 32.118 1.00 0.00 ATOM 269 CZ PHE A 35 5.083 23.912 32.174 1.00 0.00 ATOM 270 O PHE A 35 9.381 20.934 36.946 1.00 0.00 ATOM 271 C PHE A 35 9.463 20.733 35.752 1.00 0.00 ATOM 272 N PHE A 36 10.026 19.665 35.230 1.00 0.00 ATOM 273 CA PHE A 36 10.628 18.611 36.050 1.00 0.00 ATOM 274 CB PHE A 36 11.138 17.455 35.181 1.00 0.00 ATOM 275 CG PHE A 36 10.066 16.485 34.754 1.00 0.00 ATOM 276 CD1 PHE A 36 10.416 15.282 34.149 1.00 0.00 ATOM 277 CD2 PHE A 36 8.717 16.770 34.947 1.00 0.00 ATOM 278 CE1 PHE A 36 9.440 14.377 33.742 1.00 0.00 ATOM 279 CE2 PHE A 36 7.731 15.871 34.538 1.00 0.00 ATOM 280 CZ PHE A 36 8.097 14.672 33.937 1.00 0.00 ATOM 281 O PHE A 36 12.052 18.946 37.954 1.00 0.00 ATOM 282 C PHE A 36 11.838 19.218 36.777 1.00 0.00 ATOM 283 N GLU A 37 12.615 20.033 36.069 1.00 0.00 ATOM 284 CA GLU A 37 13.764 20.667 36.702 1.00 0.00 ATOM 285 CB GLU A 37 14.644 21.441 35.754 1.00 0.00 ATOM 286 CG GLU A 37 15.322 20.560 34.707 1.00 0.00 ATOM 287 CD GLU A 37 16.336 19.555 35.272 1.00 0.00 ATOM 288 OE1 GLU A 37 16.806 19.741 36.435 1.00 0.00 ATOM 289 OE2 GLU A 37 16.621 18.551 34.561 1.00 0.00 ATOM 290 O GLU A 37 13.898 21.611 38.913 1.00 0.00 ATOM 291 C GLU A 37 13.306 21.590 37.833 1.00 0.00 ATOM 292 N ALA A 38 12.220 22.329 37.587 1.00 0.00 ATOM 293 CA ALA A 38 11.684 23.242 38.593 1.00 0.00 ATOM 294 CB ALA A 38 10.619 24.124 37.961 1.00 0.00 ATOM 295 O ALA A 38 11.230 23.004 40.935 1.00 0.00 ATOM 296 C ALA A 38 11.089 22.539 39.805 1.00 0.00 ATOM 297 N THR A 39 10.419 21.397 39.600 1.00 0.00 ATOM 298 CA THR A 39 9.812 20.644 40.690 1.00 0.00 ATOM 299 CB THR A 39 9.144 19.393 40.189 1.00 0.00 ATOM 300 CG2 THR A 39 8.336 18.732 41.272 1.00 0.00 ATOM 301 OG1 THR A 39 8.201 19.736 39.158 1.00 0.00 ATOM 302 O THR A 39 10.777 20.202 42.854 1.00 0.00 ATOM 303 C THR A 39 10.867 20.099 41.620 1.00 0.00 ATOM 304 N ILE A 40 11.912 19.486 41.084 1.00 0.00 ATOM 305 CA ILE A 40 13.018 18.992 41.887 1.00 0.00 ATOM 306 CB ILE A 40 13.940 18.116 41.022 1.00 0.00 ATOM 307 CG1 ILE A 40 13.167 16.873 40.568 1.00 0.00 ATOM 308 CG2 ILE A 40 15.168 17.715 41.797 1.00 0.00 ATOM 309 CD1 ILE A 40 13.851 16.090 39.461 1.00 0.00 ATOM 310 O ILE A 40 14.178 20.004 43.732 1.00 0.00 ATOM 311 C ILE A 40 13.754 20.138 42.586 1.00 0.00 ATOM 312 N THR A 41 13.892 21.319 41.916 1.00 0.00 ATOM 313 CA THR A 41 14.563 22.471 42.508 1.00 0.00 ATOM 314 CB THR A 41 14.785 23.652 41.620 1.00 0.00 ATOM 315 CG2 THR A 41 15.725 23.275 40.492 1.00 0.00 ATOM 316 OG1 THR A 41 13.578 24.055 40.978 1.00 0.00 ATOM 317 O THR A 41 14.302 23.390 44.723 1.00 0.00 ATOM 318 C THR A 41 13.751 23.007 43.683 1.00 0.00 ATOM 319 N GLY A 42 12.417 22.979 43.561 1.00 0.00 ATOM 320 CA GLY A 42 11.547 23.444 44.645 1.00 0.00 ATOM 321 O GLY A 42 11.596 22.971 47.004 1.00 0.00 ATOM 322 C GLY A 42 11.770 22.541 45.854 1.00 0.00 ATOM 323 N ASN A 43 12.173 21.231 45.578 1.00 0.00 ATOM 324 CA ASN A 43 12.441 20.307 46.661 1.00 0.00 ATOM 325 CB ASN A 43 12.588 18.892 46.098 1.00 0.00 ATOM 326 CG ASN A 43 11.254 18.274 45.718 1.00 0.00 ATOM 327 ND2 ASN A 43 11.295 17.270 44.851 1.00 0.00 ATOM 328 OD1 ASN A 43 10.206 18.700 46.197 1.00 0.00 ATOM 329 O ASN A 43 13.814 20.792 48.570 1.00 0.00 ATOM 330 C ASN A 43 13.750 20.679 47.345 1.00 0.00 ATOM 331 N TRP A 44 14.804 20.827 46.548 1.00 0.00 ATOM 332 CA TRP A 44 16.146 20.996 47.106 1.00 0.00 ATOM 333 CB TRP A 44 17.201 20.639 46.052 1.00 0.00 ATOM 334 CG TRP A 44 18.594 20.648 46.625 1.00 0.00 ATOM 335 CD1 TRP A 44 19.578 21.550 46.388 1.00 0.00 ATOM 336 CD2 TRP A 44 19.140 19.680 47.529 1.00 0.00 ATOM 337 CE2 TRP A 44 20.445 20.072 47.822 1.00 0.00 ATOM 338 CE3 TRP A 44 18.639 18.546 48.135 1.00 0.00 ATOM 339 NE1 TRP A 44 20.686 21.221 47.117 1.00 0.00 ATOM 340 CZ2 TRP A 44 21.264 19.361 48.672 1.00 0.00 ATOM 341 CZ3 TRP A 44 19.447 17.826 48.985 1.00 0.00 ATOM 342 CH2 TRP A 44 20.755 18.221 49.231 1.00 0.00 ATOM 343 O TRP A 44 16.588 22.473 48.949 1.00 0.00 ATOM 344 C TRP A 44 16.192 22.368 47.786 1.00 0.00 ATOM 345 N ASP A 45 15.790 23.413 47.082 1.00 0.00 ATOM 346 CA ASP A 45 15.810 24.764 47.640 1.00 0.00 ATOM 347 CB ASP A 45 15.752 25.764 46.481 1.00 0.00 ATOM 348 CG ASP A 45 17.016 25.754 45.640 1.00 0.00 ATOM 349 OD1 ASP A 45 18.032 25.198 46.102 1.00 0.00 ATOM 350 OD2 ASP A 45 16.985 26.307 44.522 1.00 0.00 ATOM 351 O ASP A 45 14.611 26.177 49.143 1.00 0.00 ATOM 352 C ASP A 45 14.662 25.086 48.595 1.00 0.00 ATOM 353 N ASP A 46 13.723 24.051 48.684 1.00 0.00 ATOM 354 CA ASP A 46 12.532 24.261 49.508 1.00 0.00 ATOM 355 CB ASP A 46 12.985 24.406 50.992 1.00 0.00 ATOM 356 CG ASP A 46 13.931 23.273 51.464 1.00 0.00 ATOM 357 OD1 ASP A 46 14.403 22.511 50.597 1.00 0.00 ATOM 358 OD2 ASP A 46 14.272 23.069 52.652 1.00 0.00 ATOM 359 O ASP A 46 10.783 25.870 49.852 1.00 0.00 ATOM 360 C ASP A 46 11.596 25.382 49.071 1.00 0.00 ATOM 361 N ALA A 47 11.730 25.822 47.859 1.00 0.00 ATOM 362 CA ALA A 47 10.902 26.926 47.374 1.00 0.00 ATOM 363 CB ALA A 47 11.593 27.323 46.078 1.00 0.00 ATOM 364 O ALA A 47 9.061 25.843 46.292 1.00 0.00 ATOM 365 C ALA A 47 9.417 26.620 47.179 1.00 0.00 ATOM 366 N VAL A 48 8.567 27.257 48.010 1.00 0.00 ATOM 367 CA VAL A 48 7.136 26.986 47.941 1.00 0.00 ATOM 368 CB VAL A 48 6.432 27.449 49.219 1.00 0.00 ATOM 369 CG1 VAL A 48 4.932 27.345 49.032 1.00 0.00 ATOM 370 CG2 VAL A 48 6.903 26.666 50.422 1.00 0.00 ATOM 371 O VAL A 48 5.763 26.943 45.986 1.00 0.00 ATOM 372 C VAL A 48 6.582 27.574 46.646 1.00 0.00 ATOM 373 N GLN A 49 7.033 28.745 46.254 1.00 0.00 ATOM 374 CA GLN A 49 6.525 29.353 45.023 1.00 0.00 ATOM 375 CB GLN A 49 7.820 30.547 44.915 1.00 0.00 ATOM 376 CG GLN A 49 7.601 31.944 45.352 1.00 0.00 ATOM 377 CD GLN A 49 7.953 32.271 46.781 1.00 0.00 ATOM 378 OE1 GLN A 49 7.715 31.407 47.645 1.00 0.00 ATOM 379 NE2 GLN A 49 8.837 33.304 47.011 1.00 0.00 ATOM 380 O GLN A 49 5.997 28.411 42.890 1.00 0.00 ATOM 381 C GLN A 49 6.841 28.546 43.772 1.00 0.00 ATOM 382 N ILE A 50 8.061 28.017 43.680 1.00 0.00 ATOM 383 CA ILE A 50 8.438 27.236 42.508 1.00 0.00 ATOM 384 CB ILE A 50 9.923 26.835 42.605 1.00 0.00 ATOM 385 CG1 ILE A 50 10.817 28.070 42.489 1.00 0.00 ATOM 386 CG2 ILE A 50 10.287 25.869 41.489 1.00 0.00 ATOM 387 CD1 ILE A 50 12.266 27.807 42.836 1.00 0.00 ATOM 388 O ILE A 50 7.009 25.703 41.347 1.00 0.00 ATOM 389 C ILE A 50 7.542 26.004 42.412 1.00 0.00 ATOM 390 N ARG A 51 7.336 25.311 43.537 1.00 0.00 ATOM 391 CA ARG A 51 6.484 24.129 43.546 1.00 0.00 ATOM 392 CB ARG A 51 6.407 23.548 44.958 1.00 0.00 ATOM 393 CG ARG A 51 7.694 22.888 45.428 1.00 0.00 ATOM 394 CD ARG A 51 7.573 22.403 46.863 1.00 0.00 ATOM 395 NE ARG A 51 8.804 21.770 47.332 1.00 0.00 ATOM 396 CZ ARG A 51 8.993 21.331 48.573 1.00 0.00 ATOM 397 NH1 ARG A 51 10.145 20.767 48.907 1.00 0.00 ATOM 398 NH2 ARG A 51 8.027 21.456 49.474 1.00 0.00 ATOM 399 O ARG A 51 4.436 23.712 42.395 1.00 0.00 ATOM 400 C ARG A 51 5.070 24.480 43.099 1.00 0.00 ATOM 401 N LYS A 52 4.579 25.644 43.520 1.00 0.00 ATOM 402 CA LYS A 52 3.248 26.101 43.130 1.00 0.00 ATOM 403 CB LYS A 52 2.870 27.371 43.894 1.00 0.00 ATOM 404 CG LYS A 52 2.595 27.145 45.373 1.00 0.00 ATOM 405 CD LYS A 52 2.229 28.446 46.071 1.00 0.00 ATOM 406 CE LYS A 52 1.956 28.220 47.550 1.00 0.00 ATOM 407 NZ LYS A 52 1.626 29.489 48.253 1.00 0.00 ATOM 408 O LYS A 52 2.185 26.123 40.989 1.00 0.00 ATOM 409 C LYS A 52 3.191 26.404 41.624 1.00 0.00 ATOM 410 N GLN A 53 4.269 26.954 41.071 1.00 0.00 ATOM 411 CA GLN A 53 4.371 27.199 39.626 1.00 0.00 ATOM 412 CB GLN A 53 5.713 27.853 39.289 1.00 0.00 ATOM 413 CG GLN A 53 5.843 29.289 39.777 1.00 0.00 ATOM 414 CD GLN A 53 7.221 29.866 39.524 1.00 0.00 ATOM 415 OE1 GLN A 53 8.123 29.167 39.061 1.00 0.00 ATOM 416 NE2 GLN A 53 7.390 31.147 39.828 1.00 0.00 ATOM 417 O GLN A 53 3.581 25.830 37.794 1.00 0.00 ATOM 418 C GLN A 53 4.244 25.882 38.835 1.00 0.00 ATOM 419 N ILE A 54 4.880 24.821 39.336 1.00 0.00 ATOM 420 CA ILE A 54 4.840 23.520 38.667 1.00 0.00 ATOM 421 CB ILE A 54 5.778 22.507 39.350 1.00 0.00 ATOM 422 CG1 ILE A 54 7.229 22.982 39.264 1.00 0.00 ATOM 423 CG2 ILE A 54 5.675 21.146 38.677 1.00 0.00 ATOM 424 CD1 ILE A 54 7.737 23.145 37.848 1.00 0.00 ATOM 425 O ILE A 54 2.937 22.434 37.702 1.00 0.00 ATOM 426 C ILE A 54 3.417 22.966 38.694 1.00 0.00 ATOM 427 N SER A 55 2.741 23.110 39.829 1.00 0.00 ATOM 428 CA SER A 55 1.349 22.664 39.965 1.00 0.00 ATOM 429 CB SER A 55 0.822 22.898 41.358 1.00 0.00 ATOM 430 OG SER A 55 -0.489 22.373 41.482 1.00 0.00 ATOM 431 O SER A 55 -0.340 22.826 38.248 1.00 0.00 ATOM 432 C SER A 55 0.471 23.413 38.947 1.00 0.00 ATOM 433 N LEU A 56 0.635 24.744 38.875 1.00 0.00 ATOM 434 CA LEU A 56 -0.084 25.548 37.891 1.00 0.00 ATOM 435 CB LEU A 56 0.296 27.041 38.051 1.00 0.00 ATOM 436 CG LEU A 56 -0.430 27.810 39.157 1.00 0.00 ATOM 437 CD1 LEU A 56 0.258 29.155 39.394 1.00 0.00 ATOM 438 CD2 LEU A 56 -1.893 28.000 38.761 1.00 0.00 ATOM 439 O LEU A 56 -0.672 24.939 35.634 1.00 0.00 ATOM 440 C LEU A 56 0.243 25.119 36.449 1.00 0.00 ATOM 441 N ALA A 57 1.532 24.907 36.171 1.00 0.00 ATOM 442 CA ALA A 57 2.041 24.561 34.832 1.00 0.00 ATOM 443 CB ALA A 57 3.558 24.453 34.853 1.00 0.00 ATOM 444 O ALA A 57 1.534 22.987 33.082 1.00 0.00 ATOM 445 C ALA A 57 1.509 23.233 34.294 1.00 0.00 ATOM 446 N GLU A 58 1.063 22.370 35.196 1.00 0.00 ATOM 447 CA GLU A 58 0.459 21.108 34.816 1.00 0.00 ATOM 448 CB GLU A 58 -0.195 20.367 35.870 1.00 0.00 ATOM 449 CG GLU A 58 -1.408 20.972 36.529 1.00 0.00 ATOM 450 CD GLU A 58 -1.892 20.119 37.683 1.00 0.00 ATOM 451 OE1 GLU A 58 -1.840 18.875 37.553 1.00 0.00 ATOM 452 OE2 GLU A 58 -2.323 20.678 38.711 1.00 0.00 ATOM 453 O GLU A 58 -0.969 20.730 32.931 1.00 0.00 ATOM 454 C GLU A 58 -0.767 21.390 33.942 1.00 0.00 ATOM 455 N LYS A 59 -1.540 22.408 34.305 1.00 0.00 ATOM 456 CA LYS A 59 -2.732 22.776 33.534 1.00 0.00 ATOM 457 CB LYS A 59 -3.556 23.822 34.287 1.00 0.00 ATOM 458 CG LYS A 59 -4.252 23.288 35.526 1.00 0.00 ATOM 459 CD LYS A 59 -5.047 24.378 36.227 1.00 0.00 ATOM 460 CE LYS A 59 -5.743 23.843 37.470 1.00 0.00 ATOM 461 NZ LYS A 59 -6.500 24.908 38.182 1.00 0.00 ATOM 462 O LYS A 59 -3.067 23.081 31.177 1.00 0.00 ATOM 463 C LYS A 59 -2.342 23.291 32.156 1.00 0.00 ATOM 464 N GLN A 60 -1.173 23.994 32.081 1.00 0.00 ATOM 465 CA GLN A 60 -0.680 24.511 30.803 1.00 0.00 ATOM 466 CB GLN A 60 0.566 25.342 30.964 1.00 0.00 ATOM 467 CG GLN A 60 0.271 26.690 31.607 1.00 0.00 ATOM 468 CD GLN A 60 1.540 27.394 32.056 1.00 0.00 ATOM 469 OE1 GLN A 60 2.464 26.851 32.656 1.00 0.00 ATOM 470 NE2 GLN A 60 1.570 28.663 31.732 1.00 0.00 ATOM 471 O GLN A 60 -0.737 23.330 28.717 1.00 0.00 ATOM 472 C GLN A 60 -0.421 23.302 29.902 1.00 0.00 ATOM 473 N GLY A 61 0.162 22.257 30.454 1.00 0.00 ATOM 474 CA GLY A 61 0.448 21.055 29.696 1.00 0.00 ATOM 475 O GLY A 61 -0.807 19.785 28.174 1.00 0.00 ATOM 476 C GLY A 61 -0.806 20.321 29.270 1.00 0.00 ATOM 477 N ASP A 62 -1.842 20.254 30.126 1.00 0.00 ATOM 478 CA ASP A 62 -3.137 19.738 29.688 1.00 0.00 ATOM 479 CB ASP A 62 -4.190 19.919 30.782 1.00 0.00 ATOM 480 CG ASP A 62 -3.984 18.979 31.953 1.00 0.00 ATOM 481 OD1 ASP A 62 -3.180 18.031 31.817 1.00 0.00 ATOM 482 OD2 ASP A 62 -4.624 19.187 33.003 1.00 0.00 ATOM 483 O ASP A 62 -3.989 19.735 27.438 1.00 0.00 ATOM 484 C ASP A 62 -3.562 20.423 28.385 1.00 0.00 ATOM 485 N SER A 63 -3.434 21.735 28.385 1.00 0.00 ATOM 486 CA SER A 63 -3.827 22.586 27.232 1.00 0.00 ATOM 487 CB SER A 63 -3.599 24.076 27.491 1.00 0.00 ATOM 488 OG SER A 63 -4.507 24.570 28.460 1.00 0.00 ATOM 489 O SER A 63 -3.486 22.165 24.906 1.00 0.00 ATOM 490 C SER A 63 -2.977 22.247 26.012 1.00 0.00 ATOM 491 N LEU A 64 -1.664 22.087 26.208 1.00 0.00 ATOM 492 CA LEU A 64 -0.743 21.750 25.119 1.00 0.00 ATOM 493 CB LEU A 64 0.712 21.674 25.650 1.00 0.00 ATOM 494 CG LEU A 64 1.314 23.031 26.052 1.00 0.00 ATOM 495 CD1 LEU A 64 2.682 22.826 26.700 1.00 0.00 ATOM 496 CD2 LEU A 64 1.505 23.949 24.821 1.00 0.00 ATOM 497 O LEU A 64 -1.112 20.277 23.277 1.00 0.00 ATOM 498 C LEU A 64 -1.147 20.411 24.487 1.00 0.00 ATOM 499 N LYS A 65 -1.517 19.437 25.306 1.00 0.00 ATOM 500 CA LYS A 65 -2.015 18.166 24.801 1.00 0.00 ATOM 501 CB LYS A 65 -2.397 17.242 25.958 1.00 0.00 ATOM 502 CG LYS A 65 -2.893 15.873 25.522 1.00 0.00 ATOM 503 CD LYS A 65 -3.178 14.981 26.719 1.00 0.00 ATOM 504 CE LYS A 65 -3.703 13.625 26.283 1.00 0.00 ATOM 505 NZ LYS A 65 -4.000 12.744 27.447 1.00 0.00 ATOM 506 O LYS A 65 -3.345 17.799 22.844 1.00 0.00 ATOM 507 C LYS A 65 -3.251 18.374 23.922 1.00 0.00 ATOM 508 N ARG A 66 -4.189 19.197 24.381 1.00 0.00 ATOM 509 CA ARG A 66 -5.401 19.481 23.620 1.00 0.00 ATOM 510 CB ARG A 66 -5.983 20.883 24.296 1.00 0.00 ATOM 511 CG ARG A 66 -7.493 21.265 24.188 1.00 0.00 ATOM 512 CD ARG A 66 -7.767 22.595 24.872 1.00 0.00 ATOM 513 NE ARG A 66 -7.399 22.448 26.330 1.00 0.00 ATOM 514 CZ ARG A 66 -7.529 23.548 27.078 1.00 0.00 ATOM 515 NH1 ARG A 66 -7.959 24.706 26.628 1.00 0.00 ATOM 516 NH2 ARG A 66 -7.103 23.434 28.369 1.00 0.00 ATOM 517 O ARG A 66 -5.645 19.785 21.265 1.00 0.00 ATOM 518 C ARG A 66 -5.068 20.131 22.281 1.00 0.00 ATOM 519 N GLU A 67 -4.134 21.075 22.288 1.00 0.00 ATOM 520 CA GLU A 67 -3.718 21.782 21.068 1.00 0.00 ATOM 521 CB GLU A 67 -2.730 22.900 21.404 1.00 0.00 ATOM 522 CG GLU A 67 -3.351 24.074 22.143 1.00 0.00 ATOM 523 CD GLU A 67 -2.325 25.104 22.570 1.00 0.00 ATOM 524 OE1 GLU A 67 -1.118 24.866 22.349 1.00 0.00 ATOM 525 OE2 GLU A 67 -2.727 26.151 23.122 1.00 0.00 ATOM 526 O GLU A 67 -3.307 20.907 18.874 1.00 0.00 ATOM 527 C GLU A 67 -3.033 20.830 20.075 1.00 0.00 ATOM 528 N ILE A 68 -2.146 19.960 20.578 1.00 0.00 ATOM 529 CA ILE A 68 -1.431 18.991 19.748 1.00 0.00 ATOM 530 CB ILE A 68 -0.469 18.129 20.588 1.00 0.00 ATOM 531 CG1 ILE A 68 0.677 18.984 21.133 1.00 0.00 ATOM 532 CG2 ILE A 68 0.122 17.012 19.742 1.00 0.00 ATOM 533 CD1 ILE A 68 1.513 18.287 22.182 1.00 0.00 ATOM 534 O ILE A 68 -2.416 17.831 17.877 1.00 0.00 ATOM 535 C ILE A 68 -2.458 18.065 19.090 1.00 0.00 ATOM 536 N ARG A 69 -3.424 17.559 19.872 1.00 0.00 ATOM 537 CA ARG A 69 -4.462 16.686 19.322 1.00 0.00 ATOM 538 CB ARG A 69 -5.587 16.798 20.599 1.00 0.00 ATOM 539 CG ARG A 69 -6.462 15.627 20.964 1.00 0.00 ATOM 540 CD ARG A 69 -7.387 15.966 22.135 1.00 0.00 ATOM 541 NE ARG A 69 -8.350 17.004 21.785 1.00 0.00 ATOM 542 CZ ARG A 69 -9.456 16.786 21.083 1.00 0.00 ATOM 543 NH1 ARG A 69 -9.749 15.558 20.662 1.00 0.00 ATOM 544 NH2 ARG A 69 -10.232 17.807 20.754 1.00 0.00 ATOM 545 O ARG A 69 -5.607 16.854 17.213 1.00 0.00 ATOM 546 C ARG A 69 -5.274 17.420 18.255 1.00 0.00 ATOM 547 N LEU A 70 -5.623 18.685 18.524 1.00 0.00 ATOM 548 CA LEU A 70 -6.395 19.478 17.570 1.00 0.00 ATOM 549 CB LEU A 70 -6.598 20.889 18.130 1.00 0.00 ATOM 550 CG LEU A 70 -7.328 21.880 17.221 1.00 0.00 ATOM 551 CD1 LEU A 70 -8.739 21.400 16.923 1.00 0.00 ATOM 552 CD2 LEU A 70 -7.420 23.247 17.882 1.00 0.00 ATOM 553 O LEU A 70 -6.214 19.463 15.178 1.00 0.00 ATOM 554 C LEU A 70 -5.643 19.637 16.259 1.00 0.00 ATOM 555 N THR A 71 -4.331 19.923 16.343 1.00 0.00 ATOM 556 CA THR A 71 -3.503 20.111 15.157 1.00 0.00 ATOM 557 CB THR A 71 -2.101 20.629 15.526 1.00 0.00 ATOM 558 CG2 THR A 71 -1.257 20.817 14.275 1.00 0.00 ATOM 559 OG1 THR A 71 -2.214 21.890 16.201 1.00 0.00 ATOM 560 O THR A 71 -3.379 18.896 13.101 1.00 0.00 ATOM 561 C THR A 71 -3.343 18.846 14.327 1.00 0.00 ATOM 562 N LEU A 72 -3.155 17.748 15.026 1.00 0.00 ATOM 563 CA LEU A 72 -3.016 16.462 14.359 1.00 0.00 ATOM 564 CB LEU A 72 -2.830 15.347 15.388 1.00 0.00 ATOM 565 CG LEU A 72 -2.655 13.933 14.830 1.00 0.00 ATOM 566 CD1 LEU A 72 -1.404 13.848 13.966 1.00 0.00 ATOM 567 CD2 LEU A 72 -2.523 12.921 15.958 1.00 0.00 ATOM 568 O LEU A 72 -4.171 15.822 12.365 1.00 0.00 ATOM 569 C LEU A 72 -4.266 16.196 13.532 1.00 0.00 ATOM 570 N PRO A 73 -5.437 16.428 14.119 1.00 0.00 ATOM 571 CA PRO A 73 -6.698 16.204 13.391 1.00 0.00 ATOM 572 CB PRO A 73 -7.797 16.549 14.350 1.00 0.00 ATOM 573 CG PRO A 73 -7.252 16.157 15.669 1.00 0.00 ATOM 574 CD PRO A 73 -5.786 16.583 15.617 1.00 0.00 ATOM 575 O PRO A 73 -7.196 16.678 11.093 1.00 0.00 ATOM 576 C PRO A 73 -6.793 17.114 12.161 1.00 0.00 ATOM 577 N SER A 74 -6.422 18.387 12.329 1.00 0.00 ATOM 578 CA SER A 74 -6.448 19.304 11.232 1.00 0.00 ATOM 579 CB SER A 74 -6.240 20.759 11.662 1.00 0.00 ATOM 580 OG SER A 74 -4.900 20.894 12.069 1.00 0.00 ATOM 581 O SER A 74 -5.491 19.408 9.046 1.00 0.00 ATOM 582 C SER A 74 -5.430 18.927 10.193 1.00 0.00 ATOM 583 N GLY A 75 -4.469 18.093 10.603 1.00 0.00 ATOM 584 CA GLY A 75 -3.446 17.685 9.657 1.00 0.00 ATOM 585 O GLY A 75 -2.690 15.669 8.582 1.00 0.00 ATOM 586 C GLY A 75 -3.677 16.311 8.997 1.00 0.00 ATOM 587 N LEU A 76 -4.970 15.831 9.022 1.00 0.00 ATOM 588 CA LEU A 76 -5.316 14.578 8.395 1.00 0.00 ATOM 589 CB LEU A 76 -6.647 13.914 8.785 1.00 0.00 ATOM 590 CG LEU A 76 -6.567 13.435 10.191 1.00 0.00 ATOM 591 CD1 LEU A 76 -8.000 13.187 10.683 1.00 0.00 ATOM 592 CD2 LEU A 76 -5.670 12.182 10.256 1.00 0.00 ATOM 593 O LEU A 76 -6.359 15.071 6.287 1.00 0.00 ATOM 594 C LEU A 76 -5.321 14.772 6.879 1.00 0.00 ATOM 595 N PHE A 77 -4.111 14.769 6.295 1.00 0.00 ATOM 596 CA PHE A 77 -3.923 14.969 4.853 1.00 0.00 ATOM 597 CB PHE A 77 -2.504 15.538 4.551 1.00 0.00 ATOM 598 CG PHE A 77 -1.929 16.375 5.654 1.00 0.00 ATOM 599 CD1 PHE A 77 -0.773 16.008 6.280 1.00 0.00 ATOM 600 CD2 PHE A 77 -2.564 17.513 6.065 1.00 0.00 ATOM 601 CE1 PHE A 77 -0.257 16.772 7.281 1.00 0.00 ATOM 602 CE2 PHE A 77 -2.048 18.265 7.069 1.00 0.00 ATOM 603 CZ PHE A 77 -0.890 17.884 7.677 1.00 0.00 ATOM 604 O PHE A 77 -3.449 13.152 3.346 1.00 0.00 ATOM 605 C PHE A 77 -3.889 13.503 4.446 1.00 0.00 ATOM 606 N MET A 78 -4.444 12.696 5.450 1.00 0.00 ATOM 607 CA MET A 78 -4.532 11.254 5.244 1.00 0.00 ATOM 608 CB MET A 78 -6.054 11.137 4.533 1.00 0.00 ATOM 609 CG MET A 78 -7.008 12.273 4.872 1.00 0.00 ATOM 610 SD MET A 78 -8.463 12.284 3.819 1.00 0.00 ATOM 611 CE MET A 78 -7.746 12.871 2.260 1.00 0.00 ATOM 612 O MET A 78 -2.944 9.912 4.020 1.00 0.00 ATOM 613 C MET A 78 -3.143 10.636 5.000 1.00 0.00 ATOM 614 N PRO A 79 -2.170 10.923 5.866 1.00 0.00 ATOM 615 CA PRO A 79 -0.779 10.570 5.559 1.00 0.00 ATOM 616 CB PRO A 79 0.029 11.299 6.634 1.00 0.00 ATOM 617 CG PRO A 79 -0.900 11.398 7.798 1.00 0.00 ATOM 618 CD PRO A 79 -2.272 11.600 7.217 1.00 0.00 ATOM 619 O PRO A 79 -1.132 8.303 6.321 1.00 0.00 ATOM 620 C PRO A 79 -0.429 9.085 5.659 1.00 0.00 ATOM 621 N VAL A 80 0.673 8.709 4.946 1.00 0.00 ATOM 622 CA VAL A 80 1.129 7.323 4.958 1.00 0.00 ATOM 623 CB VAL A 80 0.963 6.616 3.599 1.00 0.00 ATOM 624 CG1 VAL A 80 -0.507 6.499 3.236 1.00 0.00 ATOM 625 CG2 VAL A 80 1.670 7.396 2.503 1.00 0.00 ATOM 626 O VAL A 80 3.265 8.388 5.275 1.00 0.00 ATOM 627 C VAL A 80 2.617 7.342 5.309 1.00 0.00 ATOM 628 N GLU A 81 3.146 6.188 5.680 1.00 0.00 ATOM 629 CA GLU A 81 4.566 6.052 5.936 1.00 0.00 ATOM 630 CB GLU A 81 5.374 6.464 4.701 1.00 0.00 ATOM 631 CG GLU A 81 5.145 5.582 3.487 1.00 0.00 ATOM 632 CD GLU A 81 5.872 6.085 2.256 1.00 0.00 ATOM 633 OE1 GLU A 81 6.625 7.074 2.375 1.00 0.00 ATOM 634 OE2 GLU A 81 5.687 5.493 1.172 1.00 0.00 ATOM 635 O GLU A 81 4.515 6.820 8.193 1.00 0.00 ATOM 636 C GLU A 81 5.066 6.889 7.093 1.00 0.00 ATOM 637 N ARG A 82 6.132 7.650 6.854 1.00 0.00 ATOM 638 CA ARG A 82 6.835 8.355 7.917 1.00 0.00 ATOM 639 CB ARG A 82 8.044 9.083 7.310 1.00 0.00 ATOM 640 CG ARG A 82 8.595 10.226 8.133 1.00 0.00 ATOM 641 CD ARG A 82 10.052 10.497 7.779 1.00 0.00 ATOM 642 NE ARG A 82 10.291 11.256 6.548 1.00 0.00 ATOM 643 CZ ARG A 82 10.007 12.546 6.379 1.00 0.00 ATOM 644 NH1 ARG A 82 9.438 13.251 7.349 1.00 0.00 ATOM 645 NH2 ARG A 82 10.381 13.165 5.263 1.00 0.00 ATOM 646 O ARG A 82 5.720 9.384 9.781 1.00 0.00 ATOM 647 C ARG A 82 5.906 9.383 8.565 1.00 0.00 ATOM 648 N THR A 83 5.342 10.274 7.749 1.00 0.00 ATOM 649 CA THR A 83 4.449 11.313 8.258 1.00 0.00 ATOM 650 CB THR A 83 3.846 12.146 7.110 1.00 0.00 ATOM 651 CG2 THR A 83 2.842 13.152 7.652 1.00 0.00 ATOM 652 OG1 THR A 83 4.891 12.852 6.429 1.00 0.00 ATOM 653 O THR A 83 3.002 11.288 10.175 1.00 0.00 ATOM 654 C THR A 83 3.304 10.751 9.111 1.00 0.00 ATOM 655 N ASP A 84 2.694 9.624 8.669 1.00 0.00 ATOM 656 CA ASP A 84 1.605 8.984 9.413 1.00 0.00 ATOM 657 CB ASP A 84 0.973 7.857 8.570 1.00 0.00 ATOM 658 CG ASP A 84 -0.300 7.314 9.188 1.00 0.00 ATOM 659 OD1 ASP A 84 -1.321 8.015 9.173 1.00 0.00 ATOM 660 OD2 ASP A 84 -0.295 6.182 9.686 1.00 0.00 ATOM 661 O ASP A 84 1.377 8.570 11.786 1.00 0.00 ATOM 662 C ASP A 84 2.089 8.461 10.779 1.00 0.00 ATOM 663 N LEU A 85 3.284 7.875 10.806 1.00 0.00 ATOM 664 CA LEU A 85 3.885 7.432 12.052 1.00 0.00 ATOM 665 CB LEU A 85 5.215 6.708 11.763 1.00 0.00 ATOM 666 CG LEU A 85 5.105 5.309 11.143 1.00 0.00 ATOM 667 CD1 LEU A 85 6.497 4.735 10.929 1.00 0.00 ATOM 668 CD2 LEU A 85 4.299 4.405 12.068 1.00 0.00 ATOM 669 O LEU A 85 3.857 8.326 14.134 1.00 0.00 ATOM 670 C LEU A 85 4.123 8.621 12.976 1.00 0.00 ATOM 671 N LEU A 86 2.214 9.884 13.275 1.00 0.00 ATOM 672 CA LEU A 86 0.941 9.707 13.977 1.00 0.00 ATOM 673 CB LEU A 86 -0.016 8.869 13.214 1.00 0.00 ATOM 674 CG LEU A 86 -1.386 8.657 13.870 1.00 0.00 ATOM 675 CD1 LEU A 86 -2.074 9.984 14.116 1.00 0.00 ATOM 676 CD2 LEU A 86 -2.227 7.734 13.000 1.00 0.00 ATOM 677 O LEU A 86 0.768 9.443 16.388 1.00 0.00 ATOM 678 C LEU A 86 1.184 8.967 15.311 1.00 0.00 ATOM 679 N GLU A 87 1.977 7.902 15.253 1.00 0.00 ATOM 680 CA GLU A 87 2.261 7.092 16.440 1.00 0.00 ATOM 681 CB GLU A 87 3.137 5.949 16.171 1.00 0.00 ATOM 682 CG GLU A 87 2.624 5.178 14.956 1.00 0.00 ATOM 683 CD GLU A 87 1.751 4.000 15.299 1.00 0.00 ATOM 684 OE1 GLU A 87 0.491 4.114 15.310 1.00 0.00 ATOM 685 OE2 GLU A 87 2.349 2.941 15.563 1.00 0.00 ATOM 686 O GLU A 87 2.865 7.797 18.682 1.00 0.00 ATOM 687 C GLU A 87 3.132 7.841 17.467 1.00 0.00 ATOM 688 N LEU A 88 4.149 8.518 16.975 1.00 0.00 ATOM 689 CA LEU A 88 5.042 9.273 17.856 1.00 0.00 ATOM 690 CB LEU A 88 6.211 9.840 17.090 1.00 0.00 ATOM 691 CG LEU A 88 7.235 8.806 16.635 1.00 0.00 ATOM 692 CD1 LEU A 88 8.199 9.420 15.604 1.00 0.00 ATOM 693 CD2 LEU A 88 8.012 8.205 17.825 1.00 0.00 ATOM 694 O LEU A 88 4.672 10.729 19.697 1.00 0.00 ATOM 695 C LEU A 88 4.324 10.407 18.570 1.00 0.00 ATOM 696 N LEU A 89 3.329 11.023 17.911 1.00 0.00 ATOM 697 CA LEU A 89 2.568 12.102 18.543 1.00 0.00 ATOM 698 CB LEU A 89 1.623 12.729 17.546 1.00 0.00 ATOM 699 CG LEU A 89 2.324 13.354 16.340 1.00 0.00 ATOM 700 CD1 LEU A 89 1.292 13.715 15.284 1.00 0.00 ATOM 701 CD2 LEU A 89 3.127 14.579 16.784 1.00 0.00 ATOM 702 O LEU A 89 1.823 12.266 20.807 1.00 0.00 ATOM 703 C LEU A 89 1.809 11.592 19.790 1.00 0.00 ATOM 704 N THR A 90 1.165 10.427 19.691 1.00 0.00 ATOM 705 CA THR A 90 0.483 9.849 20.846 1.00 0.00 ATOM 706 CB THR A 90 -0.232 8.534 20.479 1.00 0.00 ATOM 707 CG2 THR A 90 -0.909 7.937 21.703 1.00 0.00 ATOM 708 OG1 THR A 90 -1.225 8.790 19.479 1.00 0.00 ATOM 709 O THR A 90 1.153 9.750 23.122 1.00 0.00 ATOM 710 C THR A 90 1.459 9.562 21.970 1.00 0.00 ATOM 711 N GLN A 91 2.723 9.196 21.584 1.00 0.00 ATOM 712 CA GLN A 91 3.764 8.898 22.555 1.00 0.00 ATOM 713 CB GLN A 91 5.021 8.395 21.841 1.00 0.00 ATOM 714 CG GLN A 91 4.868 7.026 21.203 1.00 0.00 ATOM 715 CD GLN A 91 4.563 5.941 22.218 1.00 0.00 ATOM 716 OE1 GLN A 91 5.188 5.874 23.276 1.00 0.00 ATOM 717 NE2 GLN A 91 3.598 5.085 21.899 1.00 0.00 ATOM 718 O GLN A 91 4.264 10.192 24.501 1.00 0.00 ATOM 719 C GLN A 91 4.081 10.193 23.288 1.00 0.00 ATOM 720 N GLN A 92 4.128 11.315 22.550 1.00 0.00 ATOM 721 CA GLN A 92 4.393 12.608 23.169 1.00 0.00 ATOM 722 CB GLN A 92 4.525 13.685 22.117 1.00 0.00 ATOM 723 CG GLN A 92 5.798 13.581 21.282 1.00 0.00 ATOM 724 CD GLN A 92 7.036 13.706 22.145 1.00 0.00 ATOM 725 OE1 GLN A 92 7.881 12.811 22.177 1.00 0.00 ATOM 726 NE2 GLN A 92 7.140 14.808 22.865 1.00 0.00 ATOM 727 O GLN A 92 3.550 13.543 25.205 1.00 0.00 ATOM 728 C GLN A 92 3.289 13.034 24.122 1.00 0.00 ATOM 729 N ASP A 93 2.058 12.813 23.719 1.00 0.00 ATOM 730 CA ASP A 93 0.938 13.169 24.582 1.00 0.00 ATOM 731 CB ASP A 93 -0.391 12.899 23.874 1.00 0.00 ATOM 732 CG ASP A 93 -0.660 13.870 22.742 1.00 0.00 ATOM 733 OD1 ASP A 93 0.057 14.892 22.655 1.00 0.00 ATOM 734 OD2 ASP A 93 -1.583 13.612 21.941 1.00 0.00 ATOM 735 O ASP A 93 0.884 12.942 26.961 1.00 0.00 ATOM 736 C ASP A 93 0.989 12.368 25.884 1.00 0.00 ATOM 737 N LYS A 94 1.291 11.074 25.767 1.00 0.00 ATOM 738 CA LYS A 94 1.391 10.213 26.957 1.00 0.00 ATOM 739 CB LYS A 94 1.633 8.760 26.547 1.00 0.00 ATOM 740 CG LYS A 94 0.433 8.092 25.895 1.00 0.00 ATOM 741 CD LYS A 94 0.740 6.650 25.518 1.00 0.00 ATOM 742 CE LYS A 94 -0.453 5.992 24.844 1.00 0.00 ATOM 743 NZ LYS A 94 -0.154 4.590 24.437 1.00 0.00 ATOM 744 O LYS A 94 2.362 10.686 29.115 1.00 0.00 ATOM 745 C LYS A 94 2.510 10.668 27.893 1.00 0.00 ATOM 746 N ILE A 95 3.654 11.125 27.401 1.00 0.00 ATOM 747 CA ILE A 95 4.696 11.688 28.245 1.00 0.00 ATOM 748 CB ILE A 95 5.821 12.249 27.411 1.00 0.00 ATOM 749 CG1 ILE A 95 6.669 11.059 26.942 1.00 0.00 ATOM 750 CG2 ILE A 95 6.660 13.266 28.249 1.00 0.00 ATOM 751 CD1 ILE A 95 7.677 11.411 25.846 1.00 0.00 ATOM 752 O ILE A 95 4.412 13.046 30.203 1.00 0.00 ATOM 753 C ILE A 95 4.137 12.879 29.018 1.00 0.00 ATOM 754 N ALA A 96 3.342 13.695 28.345 1.00 0.00 ATOM 755 CA ALA A 96 2.744 14.836 29.028 1.00 0.00 ATOM 756 CB ALA A 96 1.948 15.679 28.044 1.00 0.00 ATOM 757 O ALA A 96 1.771 14.960 31.220 1.00 0.00 ATOM 758 C ALA A 96 1.836 14.341 30.160 1.00 0.00 ATOM 759 N ASN A 97 1.051 13.276 29.919 1.00 0.00 ATOM 760 CA ASN A 97 0.174 12.735 30.953 1.00 0.00 ATOM 761 CB ASN A 97 -0.635 11.567 30.457 1.00 0.00 ATOM 762 CG ASN A 97 -1.724 12.001 29.479 1.00 0.00 ATOM 763 ND2 ASN A 97 -2.244 11.042 28.708 1.00 0.00 ATOM 764 OD1 ASN A 97 -2.128 13.192 29.439 1.00 0.00 ATOM 765 O ASN A 97 0.614 12.645 33.313 1.00 0.00 ATOM 766 C ASN A 97 0.996 12.351 32.178 1.00 0.00 ATOM 767 N LYS A 98 2.117 11.697 31.934 1.00 0.00 ATOM 768 CA LYS A 98 2.997 11.279 33.020 1.00 0.00 ATOM 769 CB LYS A 98 4.140 10.404 32.496 1.00 0.00 ATOM 770 CG LYS A 98 3.700 9.044 31.989 1.00 0.00 ATOM 771 CD LYS A 98 4.882 8.229 31.489 1.00 0.00 ATOM 772 CE LYS A 98 4.436 6.881 30.950 1.00 0.00 ATOM 773 NZ LYS A 98 5.581 6.082 30.435 1.00 0.00 ATOM 774 O LYS A 98 3.637 12.453 34.997 1.00 0.00 ATOM 775 C LYS A 98 3.547 12.481 33.777 1.00 0.00 ATOM 776 N ALA A 99 3.912 13.534 33.046 1.00 0.00 ATOM 777 CA ALA A 99 4.437 14.742 33.680 1.00 0.00 ATOM 778 CB ALA A 99 4.862 15.755 32.627 1.00 0.00 ATOM 779 O ALA A 99 3.621 15.788 35.660 1.00 0.00 ATOM 780 C ALA A 99 3.354 15.380 34.547 1.00 0.00 ATOM 781 N LYS A 100 2.200 15.371 34.071 1.00 0.00 ATOM 782 CA LYS A 100 1.026 15.795 34.823 1.00 0.00 ATOM 783 CB LYS A 100 -0.246 15.565 34.004 1.00 0.00 ATOM 784 CG LYS A 100 -1.521 16.016 34.696 1.00 0.00 ATOM 785 CD LYS A 100 -2.735 15.816 33.801 1.00 0.00 ATOM 786 CE LYS A 100 -4.017 16.222 34.511 1.00 0.00 ATOM 787 NZ LYS A 100 -5.212 16.053 33.640 1.00 0.00 ATOM 788 O LYS A 100 0.689 15.584 37.209 1.00 0.00 ATOM 789 C LYS A 100 0.877 15.002 36.129 1.00 0.00 ATOM 790 N ASP A 101 1.094 13.690 36.051 1.00 0.00 ATOM 791 CA ASP A 101 0.995 12.854 37.252 1.00 0.00 ATOM 792 CB ASP A 101 1.079 11.380 36.868 1.00 0.00 ATOM 793 CG ASP A 101 -0.142 10.914 36.102 1.00 0.00 ATOM 794 OD1 ASP A 101 -1.101 10.439 36.748 1.00 0.00 ATOM 795 OD2 ASP A 101 -0.142 11.034 34.856 1.00 0.00 ATOM 796 O ASP A 101 1.927 13.076 39.458 1.00 0.00 ATOM 797 C ASP A 101 2.135 13.135 38.238 1.00 0.00 ATOM 798 N ILE A 102 3.356 13.427 37.728 1.00 0.00 ATOM 799 CA ILE A 102 4.474 13.744 38.608 1.00 0.00 ATOM 800 CB ILE A 102 5.733 14.077 37.860 1.00 0.00 ATOM 801 CG1 ILE A 102 6.288 12.738 37.334 1.00 0.00 ATOM 802 CG2 ILE A 102 6.721 14.868 38.738 1.00 0.00 ATOM 803 CD1 ILE A 102 7.384 12.900 36.291 1.00 0.00 ATOM 804 O ILE A 102 4.418 15.111 40.633 1.00 0.00 ATOM 805 C ILE A 102 4.125 15.010 39.417 1.00 0.00 ATOM 806 N SER A 103 3.551 16.030 38.726 1.00 0.00 ATOM 807 CA SER A 103 3.202 17.314 39.364 1.00 0.00 ATOM 808 CB SER A 103 2.686 18.243 38.253 1.00 0.00 ATOM 809 OG SER A 103 2.272 19.431 38.835 1.00 0.00 ATOM 810 O SER A 103 2.321 17.666 41.591 1.00 0.00 ATOM 811 C SER A 103 2.200 17.077 40.517 1.00 0.00 ATOM 812 N GLY A 104 1.175 16.248 40.279 1.00 0.00 ATOM 813 CA GLY A 104 0.189 15.977 41.311 1.00 0.00 ATOM 814 O GLY A 104 0.543 15.751 43.653 1.00 0.00 ATOM 815 C GLY A 104 0.864 15.377 42.544 1.00 0.00 ATOM 816 N ARG A 105 1.827 14.497 42.251 1.00 0.00 ATOM 817 CA ARG A 105 2.605 13.916 43.361 1.00 0.00 ATOM 818 CB ARG A 105 3.478 12.773 42.769 1.00 0.00 ATOM 819 CG ARG A 105 2.691 11.659 42.068 1.00 0.00 ATOM 820 CD ARG A 105 1.817 10.863 43.034 1.00 0.00 ATOM 821 NE ARG A 105 0.547 11.512 43.365 1.00 0.00 ATOM 822 CZ ARG A 105 -0.501 11.586 42.551 1.00 0.00 ATOM 823 NH1 ARG A 105 -0.442 11.058 41.334 1.00 0.00 ATOM 824 NH2 ARG A 105 -1.623 12.167 42.956 1.00 0.00 ATOM 825 O ARG A 105 3.642 14.890 45.325 1.00 0.00 ATOM 826 C ARG A 105 3.469 14.942 44.080 1.00 0.00 ATOM 827 N VAL A 106 4.023 15.905 43.374 1.00 0.00 ATOM 828 CA VAL A 106 4.856 16.966 43.954 1.00 0.00 ATOM 829 CB VAL A 106 5.480 17.784 42.838 1.00 0.00 ATOM 830 CG1 VAL A 106 6.080 19.076 43.376 1.00 0.00 ATOM 831 CG2 VAL A 106 6.546 16.928 42.146 1.00 0.00 ATOM 832 O VAL A 106 4.462 18.144 46.013 1.00 0.00 ATOM 833 C VAL A 106 4.013 17.797 44.919 1.00 0.00 ATOM 834 N ILE A 107 2.758 18.112 44.539 1.00 0.00 ATOM 835 CA ILE A 107 1.902 18.912 45.409 1.00 0.00 ATOM 836 CB ILE A 107 0.552 19.235 44.800 1.00 0.00 ATOM 837 CG1 ILE A 107 0.758 20.250 43.666 1.00 0.00 ATOM 838 CG2 ILE A 107 -0.401 19.787 45.859 1.00 0.00 ATOM 839 CD1 ILE A 107 1.424 21.555 44.097 1.00 0.00 ATOM 840 O ILE A 107 1.675 18.731 47.809 1.00 0.00 ATOM 841 C ILE A 107 1.627 18.157 46.723 1.00 0.00 ATOM 842 N GLY A 108 1.331 16.863 46.600 1.00 0.00 ATOM 843 CA GLY A 108 1.092 16.009 47.760 1.00 0.00 ATOM 844 O GLY A 108 2.242 15.910 49.858 1.00 0.00 ATOM 845 C GLY A 108 2.334 15.861 48.630 1.00 0.00 ATOM 846 N ARG A 109 3.525 15.677 48.012 1.00 0.00 ATOM 847 CA ARG A 109 4.777 15.611 48.770 1.00 0.00 ATOM 848 CB ARG A 109 5.844 15.093 47.744 1.00 0.00 ATOM 849 CG ARG A 109 7.262 15.051 48.252 1.00 0.00 ATOM 850 CD ARG A 109 8.117 14.533 47.126 1.00 0.00 ATOM 851 NE ARG A 109 9.535 14.523 47.421 1.00 0.00 ATOM 852 CZ ARG A 109 10.238 15.578 47.800 1.00 0.00 ATOM 853 NH1 ARG A 109 9.658 16.765 47.960 1.00 0.00 ATOM 854 NH2 ARG A 109 11.554 15.462 47.940 1.00 0.00 ATOM 855 O ARG A 109 5.715 16.869 50.593 1.00 0.00 ATOM 856 C ARG A 109 5.092 16.903 49.530 1.00 0.00 ATOM 857 N GLN A 110 4.677 18.022 49.009 1.00 0.00 ATOM 858 CA GLN A 110 4.891 19.308 49.682 1.00 0.00 ATOM 859 CB GLN A 110 4.613 20.409 48.607 1.00 0.00 ATOM 860 CG GLN A 110 4.718 21.854 49.164 1.00 0.00 ATOM 861 CD GLN A 110 3.395 22.326 49.713 1.00 0.00 ATOM 862 OE1 GLN A 110 2.308 21.962 49.179 1.00 0.00 ATOM 863 NE2 GLN A 110 3.446 23.142 50.767 1.00 0.00 ATOM 864 O GLN A 110 4.546 20.175 51.903 1.00 0.00 ATOM 865 C GLN A 110 4.144 19.409 51.022 1.00 0.00 ATOM 866 N LEU A 111 3.056 18.641 51.192 1.00 0.00 ATOM 867 CA LEU A 111 2.259 18.649 52.422 1.00 0.00 ATOM 868 CB LEU A 111 1.109 17.648 52.305 1.00 0.00 ATOM 869 CG LEU A 111 0.037 17.963 51.259 1.00 0.00 ATOM 870 CD1 LEU A 111 -0.976 16.833 51.170 1.00 0.00 ATOM 871 CD2 LEU A 111 -0.705 19.240 51.619 1.00 0.00 ATOM 872 O LEU A 111 2.669 17.900 54.667 1.00 0.00 ATOM 873 C LEU A 111 3.055 17.921 53.498 1.00 0.00 ATOM 874 N LEU A 112 4.191 17.308 52.964 1.00 0.00 ATOM 875 CA LEU A 112 5.071 16.564 53.863 1.00 0.00 ATOM 876 CB LEU A 112 4.655 15.071 53.798 1.00 0.00 ATOM 877 CG LEU A 112 3.252 14.607 54.172 1.00 0.00 ATOM 878 CD1 LEU A 112 3.095 13.141 53.793 1.00 0.00 ATOM 879 CD2 LEU A 112 3.026 14.802 55.665 1.00 0.00 ATOM 880 O LEU A 112 6.843 17.538 52.577 1.00 0.00 ATOM 881 C LEU A 112 6.524 16.918 53.597 1.00 0.00 ATOM 882 N ILE A 113 7.411 16.544 54.521 1.00 0.00 ATOM 883 CA ILE A 113 8.825 16.870 54.390 1.00 0.00 ATOM 884 CB ILE A 113 9.312 17.719 55.579 1.00 0.00 ATOM 885 CG1 ILE A 113 8.461 18.991 55.701 1.00 0.00 ATOM 886 CG2 ILE A 113 10.782 18.077 55.400 1.00 0.00 ATOM 887 CD1 ILE A 113 8.471 19.881 54.471 1.00 0.00 ATOM 888 O ILE A 113 9.615 14.899 55.519 1.00 0.00 ATOM 889 C ILE A 113 9.639 15.570 54.492 1.00 0.00 ATOM 890 N PRO A 114 10.298 15.166 53.404 1.00 0.00 ATOM 891 CA PRO A 114 11.179 13.988 53.432 1.00 0.00 ATOM 892 CB PRO A 114 11.832 14.069 52.019 1.00 0.00 ATOM 893 CG PRO A 114 10.806 14.784 51.193 1.00 0.00 ATOM 894 CD PRO A 114 10.340 15.869 52.139 1.00 0.00 ATOM 895 O PRO A 114 12.521 12.953 55.108 1.00 0.00 ATOM 896 C PRO A 114 12.252 14.010 54.519 1.00 0.00 ATOM 897 N GLN A 115 12.836 15.169 54.797 1.00 0.00 ATOM 898 CA GLN A 115 13.857 15.275 55.829 1.00 0.00 ATOM 899 CB GLN A 115 14.448 16.685 55.856 1.00 0.00 ATOM 900 CG GLN A 115 15.337 17.007 54.665 1.00 0.00 ATOM 901 CD GLN A 115 15.799 18.452 54.659 1.00 0.00 ATOM 902 OE1 GLN A 115 15.391 19.249 55.503 1.00 0.00 ATOM 903 NE2 GLN A 115 16.652 18.794 53.700 1.00 0.00 ATOM 904 O GLN A 115 13.810 14.171 57.932 1.00 0.00 ATOM 905 C GLN A 115 13.271 14.985 57.210 1.00 0.00 ATOM 906 N ALA A 116 12.118 15.566 57.529 1.00 0.00 ATOM 907 CA ALA A 116 11.468 15.320 58.804 1.00 0.00 ATOM 908 CB ALA A 116 10.260 16.204 58.978 1.00 0.00 ATOM 909 O ALA A 116 11.218 13.271 60.060 1.00 0.00 ATOM 910 C ALA A 116 11.116 13.854 58.955 1.00 0.00 ATOM 911 N LEU A 117 10.691 13.268 57.882 1.00 0.00 ATOM 912 CA LEU A 117 10.307 11.844 57.894 1.00 0.00 ATOM 913 CB LEU A 117 9.162 11.624 56.905 1.00 0.00 ATOM 914 CG LEU A 117 7.883 12.292 57.401 1.00 0.00 ATOM 915 CD1 LEU A 117 6.757 12.080 56.398 1.00 0.00 ATOM 916 CD2 LEU A 117 7.492 11.736 58.771 1.00 0.00 ATOM 917 O LEU A 117 11.308 9.770 57.360 1.00 0.00 ATOM 918 C LEU A 117 11.485 10.968 57.531 1.00 0.00 ATOM 919 N GLN A 118 12.668 11.526 57.364 1.00 0.00 ATOM 920 CA GLN A 118 13.873 10.775 56.967 1.00 0.00 ATOM 921 CB GLN A 118 14.563 10.124 58.338 1.00 0.00 ATOM 922 CG GLN A 118 14.014 10.666 59.655 1.00 0.00 ATOM 923 CD GLN A 118 14.760 11.886 60.170 1.00 0.00 ATOM 924 OE1 GLN A 118 14.204 12.696 60.936 1.00 0.00 ATOM 925 NE2 GLN A 118 16.023 12.017 59.781 1.00 0.00 ATOM 926 O GLN A 118 14.235 8.797 55.609 1.00 0.00 ATOM 927 C GLN A 118 13.762 9.947 55.690 1.00 0.00 ATOM 928 N VAL A 119 13.160 10.486 54.614 1.00 0.00 ATOM 929 CA VAL A 119 13.057 9.765 53.375 1.00 0.00 ATOM 930 CB VAL A 119 11.719 10.082 52.679 1.00 0.00 ATOM 931 CG1 VAL A 119 11.712 9.445 51.291 1.00 0.00 ATOM 932 CG2 VAL A 119 10.554 9.606 53.564 1.00 0.00 ATOM 933 O VAL A 119 14.392 11.447 52.343 1.00 0.00 ATOM 934 C VAL A 119 14.200 10.244 52.479 1.00 0.00 ATOM 935 N PRO A 120 14.999 9.331 51.935 1.00 0.00 ATOM 936 CA PRO A 120 16.147 9.743 51.111 1.00 0.00 ATOM 937 CB PRO A 120 16.931 8.422 50.967 1.00 0.00 ATOM 938 CG PRO A 120 15.890 7.424 50.845 1.00 0.00 ATOM 939 CD PRO A 120 14.754 7.915 51.687 1.00 0.00 ATOM 940 O PRO A 120 14.836 10.011 49.094 1.00 0.00 ATOM 941 C PRO A 120 15.752 10.452 49.808 1.00 0.00 ATOM 942 N PHE A 121 16.438 11.523 49.488 1.00 0.00 ATOM 943 CA PHE A 121 16.139 12.260 48.267 1.00 0.00 ATOM 944 CB PHE A 121 15.670 13.661 48.656 1.00 0.00 ATOM 945 CG PHE A 121 15.509 14.587 47.454 1.00 0.00 ATOM 946 CD1 PHE A 121 14.669 14.275 46.390 1.00 0.00 ATOM 947 CD2 PHE A 121 16.220 15.786 47.399 1.00 0.00 ATOM 948 CE1 PHE A 121 14.538 15.124 45.314 1.00 0.00 ATOM 949 CE2 PHE A 121 16.072 16.655 46.333 1.00 0.00 ATOM 950 CZ PHE A 121 15.229 16.334 45.297 1.00 0.00 ATOM 951 O PHE A 121 18.522 12.305 47.960 1.00 0.00 ATOM 952 C PHE A 121 17.402 12.615 47.490 1.00 0.00 ATOM 953 N ILE A 122 17.502 13.033 46.166 1.00 0.00 ATOM 954 CA ILE A 122 18.624 13.150 45.239 1.00 0.00 ATOM 955 CB ILE A 122 19.941 12.790 45.835 1.00 0.00 ATOM 956 CG1 ILE A 122 20.425 13.861 46.810 1.00 0.00 ATOM 957 CG2 ILE A 122 20.948 12.519 44.731 1.00 0.00 ATOM 958 CD1 ILE A 122 20.608 15.238 46.190 1.00 0.00 ATOM 959 O ILE A 122 18.673 12.546 42.911 1.00 0.00 ATOM 960 C ILE A 122 18.433 12.187 44.055 1.00 0.00 ATOM 961 N ALA A 123 18.030 10.955 44.348 1.00 0.00 ATOM 962 CA ALA A 123 17.891 9.945 43.307 1.00 0.00 ATOM 963 CB ALA A 123 17.538 8.595 43.986 1.00 0.00 ATOM 964 O ALA A 123 17.034 10.123 41.075 1.00 0.00 ATOM 965 C ALA A 123 16.827 10.312 42.268 1.00 0.00 ATOM 966 N TYR A 124 15.671 10.831 42.714 1.00 0.00 ATOM 967 CA TYR A 124 14.590 11.212 41.817 1.00 0.00 ATOM 968 CB TYR A 124 13.409 11.678 42.691 1.00 0.00 ATOM 969 CG TYR A 124 12.367 12.371 41.875 1.00 0.00 ATOM 970 CD1 TYR A 124 11.414 11.617 41.219 1.00 0.00 ATOM 971 CD2 TYR A 124 12.384 13.738 41.707 1.00 0.00 ATOM 972 CE1 TYR A 124 10.430 12.199 40.425 1.00 0.00 ATOM 973 CE2 TYR A 124 11.460 14.317 40.817 1.00 0.00 ATOM 974 CZ TYR A 124 10.469 13.556 40.243 1.00 0.00 ATOM 975 OH TYR A 124 9.537 14.156 39.430 1.00 0.00 ATOM 976 O TYR A 124 14.773 12.215 39.641 1.00 0.00 ATOM 977 C TYR A 124 15.022 12.304 40.844 1.00 0.00 ATOM 978 N LEU A 125 15.620 13.384 41.354 1.00 0.00 ATOM 979 CA LEU A 125 16.151 14.439 40.475 1.00 0.00 ATOM 980 CB LEU A 125 16.983 15.452 41.240 1.00 0.00 ATOM 981 CG LEU A 125 17.746 16.428 40.343 1.00 0.00 ATOM 982 CD1 LEU A 125 16.778 17.414 39.702 1.00 0.00 ATOM 983 CD2 LEU A 125 18.782 17.172 41.138 1.00 0.00 ATOM 984 O LEU A 125 17.202 14.196 38.315 1.00 0.00 ATOM 985 C LEU A 125 17.143 13.807 39.477 1.00 0.00 ATOM 986 N GLN A 126 18.001 12.899 39.964 1.00 0.00 ATOM 987 CA GLN A 126 18.970 12.243 39.086 1.00 0.00 ATOM 988 CB GLN A 126 19.868 11.305 39.881 1.00 0.00 ATOM 989 CG GLN A 126 20.740 12.029 40.907 1.00 0.00 ATOM 990 CD GLN A 126 21.682 11.105 41.654 1.00 0.00 ATOM 991 OE1 GLN A 126 21.358 9.944 41.916 1.00 0.00 ATOM 992 NE2 GLN A 126 22.849 11.626 42.027 1.00 0.00 ATOM 993 O GLN A 126 18.671 11.470 36.867 1.00 0.00 ATOM 994 C GLN A 126 18.281 11.428 38.024 1.00 0.00 ATOM 995 N ARG A 127 17.241 10.673 38.408 1.00 0.00 ATOM 996 CA ARG A 127 16.490 9.897 37.424 1.00 0.00 ATOM 997 CB ARG A 127 15.439 9.062 38.111 1.00 0.00 ATOM 998 CG ARG A 127 14.780 8.027 37.212 1.00 0.00 ATOM 999 CD ARG A 127 13.964 7.042 38.039 1.00 0.00 ATOM 1000 NE ARG A 127 13.132 6.163 37.221 1.00 0.00 ATOM 1001 CZ ARG A 127 13.559 5.074 36.591 1.00 0.00 ATOM 1002 NH1 ARG A 127 14.830 4.698 36.675 1.00 0.00 ATOM 1003 NH2 ARG A 127 12.711 4.356 35.869 1.00 0.00 ATOM 1004 O ARG A 127 15.852 10.562 35.228 1.00 0.00 ATOM 1005 C ARG A 127 15.822 10.831 36.418 1.00 0.00 ATOM 1006 N CYS A 128 15.274 11.943 36.929 1.00 0.00 ATOM 1007 CA CYS A 128 14.671 12.890 35.983 1.00 0.00 ATOM 1008 CB CYS A 128 13.949 14.000 36.712 1.00 0.00 ATOM 1009 SG CYS A 128 12.406 13.482 37.518 1.00 0.00 ATOM 1010 O CYS A 128 15.346 13.743 33.853 1.00 0.00 ATOM 1011 C CYS A 128 15.669 13.513 35.017 1.00 0.00 ATOM 1012 N ILE A 129 16.854 13.772 35.524 1.00 0.00 ATOM 1013 CA ILE A 129 17.899 14.350 34.681 1.00 0.00 ATOM 1014 CB ILE A 129 19.160 14.703 35.543 1.00 0.00 ATOM 1015 CG1 ILE A 129 18.827 15.892 36.460 1.00 0.00 ATOM 1016 CG2 ILE A 129 20.357 15.001 34.646 1.00 0.00 ATOM 1017 CD1 ILE A 129 19.929 16.169 37.497 1.00 0.00 ATOM 1018 O ILE A 129 18.413 13.892 32.373 1.00 0.00 ATOM 1019 C ILE A 129 18.327 13.448 33.519 1.00 0.00 ATOM 1020 N ASP A 130 18.571 12.180 33.799 1.00 0.00 ATOM 1021 CA ASP A 130 18.799 11.191 32.759 1.00 0.00 ATOM 1022 CB ASP A 130 18.985 9.827 33.278 1.00 0.00 ATOM 1023 CG ASP A 130 20.366 9.628 33.906 1.00 0.00 ATOM 1024 OD1 ASP A 130 21.329 10.290 33.465 1.00 0.00 ATOM 1025 OD2 ASP A 130 20.552 8.803 34.842 1.00 0.00 ATOM 1026 O ASP A 130 17.817 11.059 30.590 1.00 0.00 ATOM 1027 C ASP A 130 17.617 11.076 31.807 1.00 0.00 ATOM 1028 N ALA A 131 16.399 11.008 32.350 1.00 0.00 ATOM 1029 CA ALA A 131 15.195 10.898 31.531 1.00 0.00 ATOM 1030 CB ALA A 131 13.955 10.596 32.364 1.00 0.00 ATOM 1031 O ALA A 131 14.528 11.996 29.509 1.00 0.00 ATOM 1032 C ALA A 131 14.956 12.121 30.657 1.00 0.00 ATOM 1033 N VAL A 132 15.216 13.324 31.197 1.00 0.00 ATOM 1034 CA VAL A 132 15.030 14.546 30.425 1.00 0.00 ATOM 1035 CB VAL A 132 15.194 15.781 31.352 1.00 0.00 ATOM 1036 CG1 VAL A 132 15.255 17.063 30.525 1.00 0.00 ATOM 1037 CG2 VAL A 132 14.029 15.834 32.334 1.00 0.00 ATOM 1038 O VAL A 132 15.720 14.978 28.137 1.00 0.00 ATOM 1039 C VAL A 132 16.024 14.590 29.284 1.00 0.00 ATOM 1040 N GLY A 133 17.249 14.129 29.533 1.00 0.00 ATOM 1041 CA GLY A 133 18.232 14.115 28.494 1.00 0.00 ATOM 1042 O GLY A 133 18.087 13.298 26.243 1.00 0.00 ATOM 1043 C GLY A 133 17.870 13.083 27.436 1.00 0.00 ATOM 1044 N LEU A 134 17.366 11.930 27.862 1.00 0.00 ATOM 1045 CA LEU A 134 16.936 10.919 26.897 1.00 0.00 ATOM 1046 CB LEU A 134 16.494 9.681 27.706 1.00 0.00 ATOM 1047 CG LEU A 134 16.000 8.493 26.873 1.00 0.00 ATOM 1048 CD1 LEU A 134 17.126 7.937 25.962 1.00 0.00 ATOM 1049 CD2 LEU A 134 15.606 7.429 27.909 1.00 0.00 ATOM 1050 O LEU A 134 15.783 11.235 24.826 1.00 0.00 ATOM 1051 C LEU A 134 15.809 11.485 26.027 1.00 0.00 ATOM 1052 N ALA A 135 14.869 12.210 26.656 1.00 0.00 ATOM 1053 CA ALA A 135 13.773 12.826 25.911 1.00 0.00 ATOM 1054 CB ALA A 135 12.831 13.563 26.814 1.00 0.00 ATOM 1055 O ALA A 135 13.835 13.850 23.739 1.00 0.00 ATOM 1056 C ALA A 135 14.298 13.812 24.873 1.00 0.00 ATOM 1057 N GLN A 136 15.265 14.636 25.296 1.00 0.00 ATOM 1058 CA GLN A 136 15.846 15.633 24.413 1.00 0.00 ATOM 1059 CB GLN A 136 16.851 16.530 25.142 1.00 0.00 ATOM 1060 CG GLN A 136 16.221 17.476 26.151 1.00 0.00 ATOM 1061 CD GLN A 136 17.254 18.264 26.933 1.00 0.00 ATOM 1062 OE1 GLN A 136 18.456 18.043 26.792 1.00 0.00 ATOM 1063 NE2 GLN A 136 16.785 19.187 27.764 1.00 0.00 ATOM 1064 O GLN A 136 16.419 15.449 22.096 1.00 0.00 ATOM 1065 C GLN A 136 16.522 14.969 23.220 1.00 0.00 ATOM 1066 N GLN A 137 17.271 13.899 23.483 1.00 0.00 ATOM 1067 CA GLN A 137 17.998 13.195 22.435 1.00 0.00 ATOM 1068 CB GLN A 137 18.865 12.072 23.010 1.00 0.00 ATOM 1069 CG GLN A 137 20.109 12.560 23.737 1.00 0.00 ATOM 1070 CD GLN A 137 20.884 11.432 24.386 1.00 0.00 ATOM 1071 OE1 GLN A 137 20.449 10.279 24.377 1.00 0.00 ATOM 1072 NE2 GLN A 137 22.037 11.760 24.959 1.00 0.00 ATOM 1073 O GLN A 137 17.289 12.608 20.234 1.00 0.00 ATOM 1074 C GLN A 137 17.064 12.528 21.437 1.00 0.00 ATOM 1075 N VAL A 138 16.017 11.846 21.890 1.00 0.00 ATOM 1076 CA VAL A 138 14.990 11.323 20.986 1.00 0.00 ATOM 1077 CB VAL A 138 13.852 10.461 21.696 1.00 0.00 ATOM 1078 CG1 VAL A 138 14.462 9.225 22.368 1.00 0.00 ATOM 1079 CG2 VAL A 138 13.016 11.257 22.670 1.00 0.00 ATOM 1080 O VAL A 138 14.115 12.203 18.930 1.00 0.00 ATOM 1081 C VAL A 138 14.344 12.405 20.123 1.00 0.00 ATOM 1082 N ILE A 139 14.073 13.598 20.707 1.00 0.00 ATOM 1083 CA ILE A 139 13.473 14.699 19.954 1.00 0.00 ATOM 1084 CB ILE A 139 13.252 15.904 20.877 1.00 0.00 ATOM 1085 CG1 ILE A 139 12.139 15.569 21.886 1.00 0.00 ATOM 1086 CG2 ILE A 139 12.954 17.165 20.054 1.00 0.00 ATOM 1087 CD1 ILE A 139 10.747 15.448 21.257 1.00 0.00 ATOM 1088 O ILE A 139 13.971 15.246 17.669 1.00 0.00 ATOM 1089 C ILE A 139 14.402 15.096 18.813 1.00 0.00 ATOM 1090 N ASN A 140 15.741 15.285 19.102 1.00 0.00 ATOM 1091 CA ASN A 140 16.738 15.670 18.108 1.00 0.00 ATOM 1092 CB ASN A 140 18.138 15.735 18.726 1.00 0.00 ATOM 1093 CG ASN A 140 18.334 16.960 19.593 1.00 0.00 ATOM 1094 ND2 ASN A 140 19.332 16.908 20.469 1.00 0.00 ATOM 1095 OD1 ASN A 140 17.598 17.939 19.477 1.00 0.00 ATOM 1096 O ASN A 140 16.956 15.029 15.801 1.00 0.00 ATOM 1097 C ASN A 140 16.847 14.651 16.970 1.00 0.00 ATOM 1098 N GLU A 141 16.885 13.394 17.330 1.00 0.00 ATOM 1099 CA GLU A 141 16.977 12.358 16.304 1.00 0.00 ATOM 1100 CB GLU A 141 17.010 10.988 16.990 1.00 0.00 ATOM 1101 CG GLU A 141 18.298 10.702 17.741 1.00 0.00 ATOM 1102 CD GLU A 141 18.242 9.402 18.519 1.00 0.00 ATOM 1103 OE1 GLU A 141 17.167 8.766 18.537 1.00 0.00 ATOM 1104 OE2 GLU A 141 19.272 9.019 19.111 1.00 0.00 ATOM 1105 O GLU A 141 15.885 12.403 14.122 1.00 0.00 ATOM 1106 C GLU A 141 15.759 12.425 15.355 1.00 0.00 ATOM 1107 N LEU A 142 14.567 12.513 15.928 1.00 0.00 ATOM 1108 CA LEU A 142 13.394 12.580 15.091 1.00 0.00 ATOM 1109 CB LEU A 142 12.108 12.526 16.000 1.00 0.00 ATOM 1110 CG LEU A 142 10.768 12.739 15.272 1.00 0.00 ATOM 1111 CD1 LEU A 142 10.581 11.678 14.191 1.00 0.00 ATOM 1112 CD2 LEU A 142 9.617 12.690 16.270 1.00 0.00 ATOM 1113 O LEU A 142 12.935 13.767 13.062 1.00 0.00 ATOM 1114 C LEU A 142 13.405 13.812 14.199 1.00 0.00 ATOM 1115 N ASP A 143 13.883 14.903 14.755 1.00 0.00 ATOM 1116 CA ASP A 143 13.971 16.147 14.006 1.00 0.00 ATOM 1117 CB ASP A 143 14.582 17.282 14.767 1.00 0.00 ATOM 1118 CG ASP A 143 14.386 18.612 14.055 1.00 0.00 ATOM 1119 OD1 ASP A 143 13.233 18.867 13.635 1.00 0.00 ATOM 1120 OD2 ASP A 143 15.364 19.393 13.913 1.00 0.00 ATOM 1121 O ASP A 143 14.566 16.432 11.691 1.00 0.00 ATOM 1122 C ASP A 143 14.868 15.933 12.787 1.00 0.00 ATOM 1123 N ASP A 144 15.979 15.197 12.940 1.00 0.00 ATOM 1124 CA ASP A 144 16.794 14.872 11.770 1.00 0.00 ATOM 1125 CB ASP A 144 17.991 14.067 12.250 1.00 0.00 ATOM 1126 CG ASP A 144 18.912 13.599 11.126 1.00 0.00 ATOM 1127 OD1 ASP A 144 19.559 14.444 10.483 1.00 0.00 ATOM 1128 OD2 ASP A 144 18.929 12.377 10.884 1.00 0.00 ATOM 1129 O ASP A 144 16.034 14.414 9.555 1.00 0.00 ATOM 1130 C ASP A 144 15.989 14.087 10.736 1.00 0.00 ATOM 1131 N LEU A 145 15.211 13.119 11.207 1.00 0.00 ATOM 1132 CA LEU A 145 14.379 12.334 10.290 1.00 0.00 ATOM 1133 CB LEU A 145 13.550 11.298 11.072 1.00 0.00 ATOM 1134 CG LEU A 145 14.379 10.217 11.785 1.00 0.00 ATOM 1135 CD1 LEU A 145 13.460 9.205 12.450 1.00 0.00 ATOM 1136 CD2 LEU A 145 15.280 9.516 10.778 1.00 0.00 ATOM 1137 O LEU A 145 13.226 13.000 8.302 1.00 0.00 ATOM 1138 C LEU A 145 13.379 13.167 9.503 1.00 0.00 ATOM 1139 N LEU A 146 12.722 14.097 10.182 1.00 0.00 ATOM 1140 CA LEU A 146 11.729 14.972 9.545 1.00 0.00 ATOM 1141 CB LEU A 146 10.916 15.730 10.597 1.00 0.00 ATOM 1142 CG LEU A 146 10.171 14.871 11.623 1.00 0.00 ATOM 1143 CD1 LEU A 146 9.478 15.750 12.656 1.00 0.00 ATOM 1144 CD2 LEU A 146 9.113 14.014 10.947 1.00 0.00 ATOM 1145 O LEU A 146 11.527 16.487 7.705 1.00 0.00 ATOM 1146 C LEU A 146 12.279 15.982 8.547 1.00 0.00 ATOM 1147 N GLU A 147 13.573 16.297 8.611 1.00 0.00 ATOM 1148 CA GLU A 147 14.192 17.238 7.686 1.00 0.00 ATOM 1149 CB GLU A 147 15.692 17.360 7.967 1.00 0.00 ATOM 1150 CG GLU A 147 16.400 18.399 7.114 1.00 0.00 ATOM 1151 CD GLU A 147 17.871 18.526 7.454 1.00 0.00 ATOM 1152 OE1 GLU A 147 18.329 17.824 8.379 1.00 0.00 ATOM 1153 OE2 GLU A 147 18.566 19.330 6.799 1.00 0.00 ATOM 1154 O GLU A 147 14.461 15.733 5.841 1.00 0.00 ATOM 1155 C GLU A 147 14.074 16.832 6.211 1.00 0.00 ATOM 1156 N ALA A 148 13.487 17.669 5.412 1.00 0.00 ATOM 1157 CA ALA A 148 13.287 17.352 3.997 1.00 0.00 ATOM 1158 CB ALA A 148 12.537 18.458 3.268 1.00 0.00 ATOM 1159 O ALA A 148 14.791 16.200 2.515 1.00 0.00 ATOM 1160 C ALA A 148 14.635 17.128 3.314 1.00 0.00 ATOM 1161 N GLY A 149 15.611 17.951 3.633 1.00 0.00 ATOM 1162 CA GLY A 149 16.921 17.841 3.015 1.00 0.00 ATOM 1163 O GLY A 149 19.126 17.540 3.888 1.00 0.00 ATOM 1164 C GLY A 149 17.959 17.143 3.872 1.00 0.00 ATOM 1165 N PHE A 150 17.510 16.116 4.567 1.00 0.00 ATOM 1166 CA PHE A 150 18.402 15.358 5.438 1.00 0.00 ATOM 1167 CB PHE A 150 17.652 14.397 6.367 1.00 0.00 ATOM 1168 CG PHE A 150 16.949 13.207 5.724 1.00 0.00 ATOM 1169 CD1 PHE A 150 17.585 12.006 5.463 1.00 0.00 ATOM 1170 CD2 PHE A 150 15.604 13.317 5.375 1.00 0.00 ATOM 1171 CE1 PHE A 150 16.942 10.945 4.863 1.00 0.00 ATOM 1172 CE2 PHE A 150 14.928 12.261 4.777 1.00 0.00 ATOM 1173 CZ PHE A 150 15.602 11.078 4.518 1.00 0.00 ATOM 1174 O PHE A 150 19.200 14.329 3.381 1.00 0.00 ATOM 1175 C PHE A 150 19.464 14.720 4.551 1.00 0.00 ATOM 1176 N ARG A 151 20.682 14.574 5.096 1.00 0.00 ATOM 1177 CA ARG A 151 21.755 13.935 4.334 1.00 0.00 ATOM 1178 CB ARG A 151 23.075 14.703 4.500 1.00 0.00 ATOM 1179 CG ARG A 151 24.187 14.202 3.590 1.00 0.00 ATOM 1180 CD ARG A 151 25.469 15.002 3.777 1.00 0.00 ATOM 1181 NE ARG A 151 25.274 16.432 3.549 1.00 0.00 ATOM 1182 CZ ARG A 151 24.950 16.971 2.379 1.00 0.00 ATOM 1183 NH1 ARG A 151 24.783 16.204 1.311 1.00 0.00 ATOM 1184 NH2 ARG A 151 24.794 18.286 2.276 1.00 0.00 ATOM 1185 O ARG A 151 21.744 12.187 5.973 1.00 0.00 ATOM 1186 C ARG A 151 22.069 12.528 4.838 1.00 0.00 ATOM 1187 N GLY A 152 22.666 11.713 3.896 1.00 0.00 ATOM 1188 CA GLY A 152 22.981 10.340 4.256 1.00 0.00 ATOM 1189 O GLY A 152 23.732 9.437 6.352 1.00 0.00 ATOM 1190 C GLY A 152 23.862 10.320 5.497 1.00 0.00 ATOM 1191 N ARG A 153 24.751 11.286 5.539 1.00 0.00 ATOM 1192 CA ARG A 153 25.658 11.414 6.674 1.00 0.00 ATOM 1193 CB ARG A 153 26.661 12.598 6.326 1.00 0.00 ATOM 1194 CG ARG A 153 27.667 12.908 7.443 1.00 0.00 ATOM 1195 CD ARG A 153 28.675 13.973 7.002 1.00 0.00 ATOM 1196 NE ARG A 153 28.076 15.295 6.852 1.00 0.00 ATOM 1197 CZ ARG A 153 28.299 16.109 5.823 1.00 0.00 ATOM 1198 NH1 ARG A 153 29.099 15.731 4.838 1.00 0.00 ATOM 1199 NH2 ARG A 153 27.746 17.320 5.797 1.00 0.00 ATOM 1200 O ARG A 153 25.352 11.111 9.028 1.00 0.00 ATOM 1201 C ARG A 153 24.916 11.604 7.989 1.00 0.00 ATOM 1202 N GLU A 154 23.796 12.313 7.945 1.00 0.00 ATOM 1203 CA GLU A 154 23.019 12.551 9.157 1.00 0.00 ATOM 1204 CB GLU A 154 21.885 13.539 8.882 1.00 0.00 ATOM 1205 CG GLU A 154 22.392 14.979 8.805 1.00 0.00 ATOM 1206 CD GLU A 154 21.294 15.951 8.377 1.00 0.00 ATOM 1207 OE1 GLU A 154 20.608 15.722 7.355 1.00 0.00 ATOM 1208 OE2 GLU A 154 21.072 16.951 9.098 1.00 0.00 ATOM 1209 O GLU A 154 22.466 10.950 10.855 1.00 0.00 ATOM 1210 C GLU A 154 22.443 11.230 9.669 1.00 0.00 ATOM 1211 N VAL A 155 21.971 10.386 8.740 1.00 0.00 ATOM 1212 CA VAL A 155 21.440 9.107 9.137 1.00 0.00 ATOM 1213 CB VAL A 155 20.621 8.479 7.957 1.00 0.00 ATOM 1214 CG1 VAL A 155 20.240 7.048 8.281 1.00 0.00 ATOM 1215 CG2 VAL A 155 19.367 9.305 7.707 1.00 0.00 ATOM 1216 O VAL A 155 22.301 7.487 10.675 1.00 0.00 ATOM 1217 C VAL A 155 22.539 8.180 9.689 1.00 0.00 ATOM 1218 N ASP A 156 23.738 8.238 9.104 1.00 0.00 ATOM 1219 CA ASP A 156 24.858 7.470 9.693 1.00 0.00 ATOM 1220 CB ASP A 156 26.156 7.685 8.978 1.00 0.00 ATOM 1221 CG ASP A 156 26.159 7.036 7.603 1.00 0.00 ATOM 1222 OD1 ASP A 156 25.483 6.000 7.433 1.00 0.00 ATOM 1223 OD2 ASP A 156 26.852 7.549 6.698 1.00 0.00 ATOM 1224 O ASP A 156 25.147 7.091 12.049 1.00 0.00 ATOM 1225 C ASP A 156 25.066 7.917 11.139 1.00 0.00 ATOM 1226 N PHE A 157 25.139 9.212 11.385 1.00 0.00 ATOM 1227 CA PHE A 157 25.363 9.767 12.703 1.00 0.00 ATOM 1228 CB PHE A 157 24.782 11.335 12.633 1.00 0.00 ATOM 1229 CG PHE A 157 25.296 12.346 13.622 1.00 0.00 ATOM 1230 CD1 PHE A 157 26.490 13.012 13.392 1.00 0.00 ATOM 1231 CD2 PHE A 157 24.610 12.584 14.811 1.00 0.00 ATOM 1232 CE1 PHE A 157 26.999 13.910 14.335 1.00 0.00 ATOM 1233 CE2 PHE A 157 25.113 13.477 15.758 1.00 0.00 ATOM 1234 CZ PHE A 157 26.309 14.138 15.515 1.00 0.00 ATOM 1235 O PHE A 157 24.449 8.946 14.769 1.00 0.00 ATOM 1236 C PHE A 157 24.222 9.341 13.622 1.00 0.00 ATOM 1237 N VAL A 158 22.957 9.365 13.111 1.00 0.00 ATOM 1238 CA VAL A 158 21.794 8.950 13.894 1.00 0.00 ATOM 1239 CB VAL A 158 20.484 9.254 13.128 1.00 0.00 ATOM 1240 CG1 VAL A 158 19.288 8.659 13.874 1.00 0.00 ATOM 1241 CG2 VAL A 158 20.314 10.760 12.986 1.00 0.00 ATOM 1242 O VAL A 158 21.489 7.047 15.326 1.00 0.00 ATOM 1243 C VAL A 158 21.874 7.466 14.235 1.00 0.00 ATOM 1244 N ALA A 159 22.381 6.711 13.291 1.00 0.00 ATOM 1245 CA ALA A 159 22.513 5.271 13.475 1.00 0.00 ATOM 1246 CB ALA A 159 23.010 4.594 12.207 1.00 0.00 ATOM 1247 O ALA A 159 23.271 4.003 15.370 1.00 0.00 ATOM 1248 C ALA A 159 23.480 4.949 14.607 1.00 0.00 ATOM 1249 N LYS A 160 24.537 5.733 14.714 1.00 0.00 ATOM 1250 CA LYS A 160 25.507 5.508 15.772 1.00 0.00 ATOM 1251 CB LYS A 160 26.697 6.465 15.669 1.00 0.00 ATOM 1252 CG LYS A 160 27.643 6.158 14.521 1.00 0.00 ATOM 1253 CD LYS A 160 28.800 7.140 14.481 1.00 0.00 ATOM 1254 CE LYS A 160 29.734 6.847 13.315 1.00 0.00 ATOM 1255 NZ LYS A 160 30.854 7.824 13.243 1.00 0.00 ATOM 1256 O LYS A 160 25.474 5.587 18.164 1.00 0.00 ATOM 1257 C LYS A 160 24.950 5.955 17.120 1.00 0.00 ATOM 1258 N MET A 161 23.920 6.744 17.050 1.00 0.00 ATOM 1259 CA MET A 161 23.288 7.274 18.269 1.00 0.00 ATOM 1260 CB MET A 161 22.981 8.813 17.988 1.00 0.00 ATOM 1261 CG MET A 161 22.515 9.585 19.218 1.00 0.00 ATOM 1262 SD MET A 161 23.925 9.869 20.338 1.00 0.00 ATOM 1263 CE MET A 161 23.464 11.345 21.136 1.00 0.00 ATOM 1264 O MET A 161 21.747 6.556 19.977 1.00 0.00 ATOM 1265 C MET A 161 22.038 6.577 18.768 1.00 0.00 ATOM 1266 N ILE A 162 21.208 6.088 17.866 1.00 0.00 ATOM 1267 CA ILE A 162 19.932 5.488 18.215 1.00 0.00 ATOM 1268 CB ILE A 162 18.961 5.058 17.079 1.00 0.00 ATOM 1269 CG1 ILE A 162 18.841 6.171 16.034 1.00 0.00 ATOM 1270 CG2 ILE A 162 17.596 4.715 17.668 1.00 0.00 ATOM 1271 CD1 ILE A 162 18.067 5.767 14.769 1.00 0.00 ATOM 1272 O ILE A 162 19.350 4.609 20.370 1.00 0.00 ATOM 1273 C ILE A 162 19.950 4.429 19.314 1.00 0.00 ATOM 1274 N ASN A 163 20.655 3.327 19.073 1.00 0.00 ATOM 1275 CA ASN A 163 20.712 2.260 20.066 1.00 0.00 ATOM 1276 CB ASN A 163 21.362 1.005 19.480 1.00 0.00 ATOM 1277 CG ASN A 163 20.487 0.343 18.430 1.00 0.00 ATOM 1278 ND2 ASN A 163 21.115 -0.290 17.443 1.00 0.00 ATOM 1279 OD1 ASN A 163 19.256 0.392 18.514 1.00 0.00 ATOM 1280 O ASN A 163 21.226 1.990 22.379 1.00 0.00 ATOM 1281 C ASN A 163 21.455 2.594 21.332 1.00 0.00 ATOM 1282 N GLU A 164 22.404 3.576 21.230 1.00 0.00 ATOM 1283 CA GLU A 164 23.117 4.022 22.422 1.00 0.00 ATOM 1284 CB GLU A 164 24.208 5.039 22.070 1.00 0.00 ATOM 1285 CG GLU A 164 25.323 4.466 21.283 1.00 0.00 ATOM 1286 CD GLU A 164 26.049 3.358 22.040 1.00 0.00 ATOM 1287 OE1 GLU A 164 26.119 3.429 23.302 1.00 0.00 ATOM 1288 OE2 GLU A 164 26.556 2.425 21.380 1.00 0.00 ATOM 1289 O GLU A 164 22.181 4.442 24.631 1.00 0.00 ATOM 1290 C GLU A 164 21.980 4.438 23.406 1.00 0.00 ATOM 1291 N LEU A 165 20.746 4.805 22.876 1.00 0.00 ATOM 1292 CA LEU A 165 19.650 5.185 23.756 1.00 0.00 ATOM 1293 CB LEU A 165 18.445 5.531 22.944 1.00 0.00 ATOM 1294 CG LEU A 165 18.541 6.897 22.241 1.00 0.00 ATOM 1295 CD1 LEU A 165 17.344 7.041 21.277 1.00 0.00 ATOM 1296 CD2 LEU A 165 18.547 8.040 23.226 1.00 0.00 ATOM 1297 O LEU A 165 19.095 4.134 25.860 1.00 0.00 ATOM 1298 C LEU A 165 19.385 3.971 24.671 1.00 0.00 ATOM 1299 N ASP A 166 19.514 2.750 24.085 1.00 0.00 ATOM 1300 CA ASP A 166 19.266 1.526 24.856 1.00 0.00 ATOM 1301 CB ASP A 166 19.468 0.312 23.944 1.00 0.00 ATOM 1302 CG ASP A 166 18.373 0.175 22.906 1.00 0.00 ATOM 1303 OD1 ASP A 166 17.342 0.870 23.033 1.00 0.00 ATOM 1304 OD2 ASP A 166 18.544 -0.623 21.960 1.00 0.00 ATOM 1305 O ASP A 166 19.823 1.076 27.154 1.00 0.00 ATOM 1306 C ASP A 166 20.223 1.437 26.019 1.00 0.00 ATOM 1307 N ILE A 167 21.507 1.715 25.799 1.00 0.00 ATOM 1308 CA ILE A 167 22.468 1.606 26.904 1.00 0.00 ATOM 1309 CB ILE A 167 23.941 1.801 26.339 1.00 0.00 ATOM 1310 CG1 ILE A 167 24.339 0.653 25.404 1.00 0.00 ATOM 1311 CG2 ILE A 167 24.931 1.920 27.491 1.00 0.00 ATOM 1312 CD1 ILE A 167 24.448 -0.690 26.084 1.00 0.00 ATOM 1313 O ILE A 167 22.314 2.416 29.160 1.00 0.00 ATOM 1314 C ILE A 167 22.145 2.661 27.961 1.00 0.00 ATOM 1315 N ILE A 168 21.737 3.845 27.505 1.00 0.00 ATOM 1316 CA ILE A 168 21.380 4.935 28.410 1.00 0.00 ATOM 1317 CB ILE A 168 20.946 6.193 27.635 1.00 0.00 ATOM 1318 CG1 ILE A 168 22.132 6.784 26.871 1.00 0.00 ATOM 1319 CG2 ILE A 168 20.413 7.250 28.590 1.00 0.00 ATOM 1320 CD1 ILE A 168 21.742 7.859 25.876 1.00 0.00 ATOM 1321 O ILE A 168 20.276 4.775 30.544 1.00 0.00 ATOM 1322 C ILE A 168 20.237 4.520 29.334 1.00 0.00 ATOM 1323 N GLU A 169 19.288 3.769 28.791 1.00 0.00 ATOM 1324 CA GLU A 169 18.152 3.331 29.568 1.00 0.00 ATOM 1325 CB GLU A 169 17.130 2.626 28.672 1.00 0.00 ATOM 1326 CG GLU A 169 15.858 2.210 29.391 1.00 0.00 ATOM 1327 CD GLU A 169 15.046 3.397 29.875 1.00 0.00 ATOM 1328 OE1 GLU A 169 15.379 4.539 29.495 1.00 0.00 ATOM 1329 OE2 GLU A 169 14.081 3.185 30.636 1.00 0.00 ATOM 1330 O GLU A 169 17.931 2.164 31.608 1.00 0.00 ATOM 1331 C GLU A 169 18.571 2.298 30.574 1.00 0.00 ATOM 1332 N GLU A 170 19.522 1.425 30.189 1.00 0.00 ATOM 1333 CA GLU A 170 19.990 0.397 31.114 1.00 0.00 ATOM 1334 CB GLU A 170 21.506 0.009 30.494 1.00 0.00 ATOM 1335 CG GLU A 170 21.918 -1.395 30.121 1.00 0.00 ATOM 1336 CD GLU A 170 21.621 -1.725 28.670 1.00 0.00 ATOM 1337 OE1 GLU A 170 21.331 -0.796 27.889 1.00 0.00 ATOM 1338 OE2 GLU A 170 21.679 -2.918 28.308 1.00 0.00 ATOM 1339 O GLU A 170 20.221 0.680 33.506 1.00 0.00 ATOM 1340 C GLU A 170 20.455 1.143 32.378 1.00 0.00 ATOM 1341 N ASP A 171 21.059 2.296 32.148 1.00 0.00 ATOM 1342 CA ASP A 171 21.474 3.138 33.286 1.00 0.00 ATOM 1343 CB ASP A 171 22.224 4.366 32.766 1.00 0.00 ATOM 1344 CG ASP A 171 23.599 4.024 32.227 1.00 0.00 ATOM 1345 OD1 ASP A 171 24.069 2.895 32.475 1.00 0.00 ATOM 1346 OD2 ASP A 171 24.205 4.885 31.556 1.00 0.00 ATOM 1347 O ASP A 171 20.266 3.486 35.324 1.00 0.00 ATOM 1348 C ASP A 171 20.255 3.553 34.098 1.00 0.00 ATOM 1349 N THR A 172 19.179 3.919 33.401 1.00 0.00 ATOM 1350 CA THR A 172 17.980 4.328 34.095 1.00 0.00 ATOM 1351 CB THR A 172 16.920 4.851 33.109 1.00 0.00 ATOM 1352 CG2 THR A 172 15.628 5.183 33.845 1.00 0.00 ATOM 1353 OG1 THR A 172 17.403 6.036 32.468 1.00 0.00 ATOM 1354 O THR A 172 16.940 3.291 35.992 1.00 0.00 ATOM 1355 C THR A 172 17.375 3.151 34.847 1.00 0.00 ATOM 1356 N ASP A 173 17.387 1.925 34.245 1.00 0.00 ATOM 1357 CA ASP A 173 16.819 0.748 34.878 1.00 0.00 ATOM 1358 CB ASP A 173 16.930 -0.471 33.960 1.00 0.00 ATOM 1359 CG ASP A 173 15.936 -0.437 32.817 1.00 0.00 ATOM 1360 OD1 ASP A 173 15.007 0.400 32.863 1.00 0.00 ATOM 1361 OD2 ASP A 173 16.084 -1.242 31.876 1.00 0.00 ATOM 1362 O ASP A 173 16.990 0.196 37.199 1.00 0.00 ATOM 1363 C ASP A 173 17.596 0.427 36.151 1.00 0.00 ATOM 1364 N ASP A 174 18.848 0.388 36.055 1.00 0.00 ATOM 1365 CA ASP A 174 19.683 0.053 37.211 1.00 0.00 ATOM 1366 CB ASP A 174 21.161 0.035 36.809 1.00 0.00 ATOM 1367 CG ASP A 174 21.526 -1.187 35.989 1.00 0.00 ATOM 1368 OD1 ASP A 174 20.709 -2.130 35.928 1.00 0.00 ATOM 1369 OD2 ASP A 174 22.631 -1.201 35.404 1.00 0.00 ATOM 1370 O ASP A 174 19.472 0.665 39.508 1.00 0.00 ATOM 1371 C ASP A 174 19.543 1.059 38.342 1.00 0.00 ATOM 1372 N LEU A 175 19.457 2.340 38.001 1.00 0.00 ATOM 1373 CA LEU A 175 19.222 3.398 38.982 1.00 0.00 ATOM 1374 CB LEU A 175 19.326 4.756 38.326 1.00 0.00 ATOM 1375 CG LEU A 175 20.708 5.089 37.748 1.00 0.00 ATOM 1376 CD1 LEU A 175 20.620 6.370 36.981 1.00 0.00 ATOM 1377 CD2 LEU A 175 21.764 5.168 38.865 1.00 0.00 ATOM 1378 O LEU A 175 17.742 3.548 40.853 1.00 0.00 ATOM 1379 C LEU A 175 17.862 3.278 39.655 1.00 0.00 ATOM 1380 N GLN A 176 16.838 2.945 38.860 1.00 0.00 ATOM 1381 CA GLN A 176 15.493 2.764 39.367 1.00 0.00 ATOM 1382 CB GLN A 176 14.544 2.372 38.233 1.00 0.00 ATOM 1383 CG GLN A 176 13.100 2.185 38.668 1.00 0.00 ATOM 1384 CD GLN A 176 12.186 1.814 37.515 1.00 0.00 ATOM 1385 OE1 GLN A 176 12.642 1.611 36.391 1.00 0.00 ATOM 1386 NE2 GLN A 176 10.891 1.725 37.795 1.00 0.00 ATOM 1387 O GLN A 176 14.773 1.754 41.418 1.00 0.00 ATOM 1388 C GLN A 176 15.419 1.620 40.383 1.00 0.00 ATOM 1389 N ILE A 177 16.117 0.506 40.100 1.00 0.00 ATOM 1390 CA ILE A 177 16.133 -0.627 41.021 1.00 0.00 ATOM 1391 CB ILE A 177 16.906 -1.831 40.508 1.00 0.00 ATOM 1392 CG1 ILE A 177 16.129 -2.457 39.340 1.00 0.00 ATOM 1393 CG2 ILE A 177 17.174 -2.838 41.621 1.00 0.00 ATOM 1394 CD1 ILE A 177 14.626 -2.595 39.543 1.00 0.00 ATOM 1395 O ILE A 177 16.308 -0.522 43.411 1.00 0.00 ATOM 1396 C ILE A 177 16.778 -0.172 42.338 1.00 0.00 ATOM 1397 N GLN A 178 17.889 0.554 42.235 1.00 0.00 ATOM 1398 CA GLN A 178 18.592 1.049 43.443 1.00 0.00 ATOM 1399 CB GLN A 178 19.846 1.840 43.084 1.00 0.00 ATOM 1400 CG GLN A 178 20.948 1.027 42.449 1.00 0.00 ATOM 1401 CD GLN A 178 21.615 0.005 43.343 1.00 0.00 ATOM 1402 OE1 GLN A 178 22.531 -0.690 42.878 1.00 0.00 ATOM 1403 NE2 GLN A 178 21.187 -0.099 44.593 1.00 0.00 ATOM 1404 O GLN A 178 17.662 1.878 45.483 1.00 0.00 ATOM 1405 C GLN A 178 17.727 1.996 44.263 1.00 0.00 ATOM 1406 N LEU A 179 17.076 2.942 43.591 1.00 0.00 ATOM 1407 CA LEU A 179 16.223 3.886 44.302 1.00 0.00 ATOM 1408 CB LEU A 179 15.719 4.974 43.326 1.00 0.00 ATOM 1409 CG LEU A 179 16.775 5.555 42.372 1.00 0.00 ATOM 1410 CD1 LEU A 179 16.306 6.876 41.791 1.00 0.00 ATOM 1411 CD2 LEU A 179 18.107 5.736 43.082 1.00 0.00 ATOM 1412 O LEU A 179 14.634 3.546 46.070 1.00 0.00 ATOM 1413 C LEU A 179 15.023 3.204 44.952 1.00 0.00 ATOM 1414 N ARG A 180 14.458 2.210 44.263 1.00 0.00 ATOM 1415 CA ARG A 180 13.310 1.459 44.764 1.00 0.00 ATOM 1416 CB ARG A 180 12.912 0.368 43.783 1.00 0.00 ATOM 1417 CG ARG A 180 11.700 -0.391 44.316 1.00 0.00 ATOM 1418 CD ARG A 180 11.589 -1.854 43.938 1.00 0.00 ATOM 1419 NE ARG A 180 12.205 -2.725 44.933 1.00 0.00 ATOM 1420 CZ ARG A 180 13.289 -3.458 44.685 1.00 0.00 ATOM 1421 NH1 ARG A 180 13.842 -3.418 43.479 1.00 0.00 ATOM 1422 NH2 ARG A 180 8.791 -4.048 44.122 1.00 0.00 ATOM 1423 O ARG A 180 12.964 0.832 47.061 1.00 0.00 ATOM 1424 C ARG A 180 13.696 0.775 46.072 1.00 0.00 ATOM 1425 N ARG A 181 14.843 0.093 46.070 1.00 0.00 ATOM 1426 CA ARG A 181 15.319 -0.624 47.247 1.00 0.00 ATOM 1427 CB ARG A 181 16.592 -1.409 46.918 1.00 0.00 ATOM 1428 CG ARG A 181 16.369 -2.594 45.991 1.00 0.00 ATOM 1429 CD ARG A 181 17.681 -3.278 45.641 1.00 0.00 ATOM 1430 NE ARG A 181 17.484 -4.416 44.747 1.00 0.00 ATOM 1431 CZ ARG A 181 18.471 -5.136 44.230 1.00 0.00 ATOM 1432 NH1 ARG A 181 18.197 -6.156 43.424 1.00 0.00 ATOM 1433 NH2 ARG A 181 19.732 -4.838 44.517 1.00 0.00 ATOM 1434 O ARG A 181 15.241 0.039 49.552 1.00 0.00 ATOM 1435 C ARG A 181 15.607 0.318 48.411 1.00 0.00 ATOM 1436 N GLN A 182 16.248 1.471 48.119 1.00 0.00 ATOM 1437 CA GLN A 182 16.589 2.447 49.142 1.00 0.00 ATOM 1438 CB GLN A 182 17.431 3.594 48.619 1.00 0.00 ATOM 1439 CG GLN A 182 18.879 3.212 48.329 1.00 0.00 ATOM 1440 CD GLN A 182 19.606 2.632 49.540 1.00 0.00 ATOM 1441 OE1 GLN A 182 19.401 3.083 50.667 1.00 0.00 ATOM 1442 NE2 GLN A 182 20.421 1.605 49.313 1.00 0.00 ATOM 1443 O GLN A 182 15.237 3.126 51.011 1.00 0.00 ATOM 1444 C GLN A 182 15.340 3.064 49.786 1.00 0.00 ATOM 1445 N LEU A 183 14.350 3.452 48.945 1.00 0.00 ATOM 1446 CA LEU A 183 13.118 4.051 49.433 1.00 0.00 ATOM 1447 CB LEU A 183 12.347 4.681 48.166 1.00 0.00 ATOM 1448 CG LEU A 183 11.022 5.393 48.502 1.00 0.00 ATOM 1449 CD1 LEU A 183 11.309 6.627 49.377 1.00 0.00 ATOM 1450 CD2 LEU A 183 10.300 5.866 47.256 1.00 0.00 ATOM 1451 O LEU A 183 11.749 3.449 51.302 1.00 0.00 ATOM 1452 C LEU A 183 12.328 3.060 50.275 1.00 0.00 ATOM 1453 N PHE A 184 12.308 1.781 49.861 1.00 0.00 ATOM 1454 CA PHE A 184 11.612 0.751 50.634 1.00 0.00 ATOM 1455 CB PHE A 184 11.767 -0.620 49.973 1.00 0.00 ATOM 1456 CG PHE A 184 11.115 -1.737 50.734 1.00 0.00 ATOM 1457 CD1 PHE A 184 9.749 -1.943 50.652 1.00 0.00 ATOM 1458 CD2 PHE A 184 11.866 -2.581 51.534 1.00 0.00 ATOM 1459 CE1 PHE A 184 9.148 -2.974 51.351 1.00 0.00 ATOM 1460 CE2 PHE A 184 11.265 -3.610 52.235 1.00 0.00 ATOM 1461 CZ PHE A 184 9.910 -3.806 52.147 1.00 0.00 ATOM 1462 O PHE A 184 11.475 0.583 53.023 1.00 0.00 ATOM 1463 C PHE A 184 12.209 0.664 52.035 1.00 0.00 ATOM 1464 N ALA A 185 13.541 0.682 52.124 1.00 0.00 ATOM 1465 CA ALA A 185 14.193 0.603 53.424 1.00 0.00 ATOM 1466 CB ALA A 185 15.714 0.549 53.217 1.00 0.00 ATOM 1467 O ALA A 185 13.375 1.526 55.456 1.00 0.00 ATOM 1468 C ALA A 185 13.702 1.750 54.303 1.00 0.00 ATOM 1469 N LEU A 186 13.569 2.937 53.727 1.00 0.00 ATOM 1470 CA LEU A 186 13.152 4.133 54.449 1.00 0.00 ATOM 1471 CB LEU A 186 13.781 5.389 53.715 1.00 0.00 ATOM 1472 CG LEU A 186 15.283 5.650 53.872 1.00 0.00 ATOM 1473 CD1 LEU A 186 15.619 5.836 55.349 1.00 0.00 ATOM 1474 CD2 LEU A 186 16.083 4.503 53.284 1.00 0.00 ATOM 1475 O LEU A 186 11.276 4.957 55.689 1.00 0.00 ATOM 1476 C LEU A 186 11.667 4.206 54.797 1.00 0.00 ATOM 1477 N GLU A 187 10.866 3.399 54.060 1.00 0.00 ATOM 1478 CA GLU A 187 9.430 3.496 54.269 1.00 0.00 ATOM 1479 CB GLU A 187 8.737 2.653 53.152 1.00 0.00 ATOM 1480 CG GLU A 187 7.246 2.565 53.251 1.00 0.00 ATOM 1481 CD GLU A 187 6.630 1.687 52.173 1.00 0.00 ATOM 1482 OE1 GLU A 187 7.330 1.182 51.262 1.00 0.00 ATOM 1483 OE2 GLU A 187 5.401 1.495 52.227 1.00 0.00 ATOM 1484 O GLU A 187 8.070 3.592 56.250 1.00 0.00 ATOM 1485 C GLU A 187 8.985 3.007 55.637 1.00 0.00 ATOM 1486 N SER A 188 9.557 1.886 56.107 1.00 0.00 ATOM 1487 CA SER A 188 9.242 1.337 57.429 1.00 0.00 ATOM 1488 CB SER A 188 10.001 0.035 57.698 1.00 0.00 ATOM 1489 OG SER A 188 11.388 0.277 57.864 1.00 0.00 ATOM 1490 O SER A 188 8.867 2.263 59.636 1.00 0.00 ATOM 1491 C SER A 188 9.524 2.317 58.584 1.00 0.00 ATOM 1492 N GLU A 189 10.417 3.265 58.353 1.00 0.00 ATOM 1493 CA GLU A 189 10.774 4.255 59.349 1.00 0.00 ATOM 1494 CB GLU A 189 12.232 4.479 59.409 1.00 0.00 ATOM 1495 CG GLU A 189 12.834 3.803 60.627 1.00 0.00 ATOM 1496 CD GLU A 189 12.395 2.359 60.784 1.00 0.00 ATOM 1497 OE1 GLU A 189 12.695 1.540 59.890 1.00 0.00 ATOM 1498 OE2 GLU A 189 11.749 2.046 61.807 1.00 0.00 ATOM 1499 O GLU A 189 10.246 6.507 59.826 1.00 0.00 ATOM 1500 C GLU A 189 10.037 5.567 59.047 1.00 0.00 ATOM 1501 N LEU A 190 9.271 5.739 57.990 1.00 0.00 ATOM 1502 CA LEU A 190 8.561 6.965 57.720 1.00 0.00 ATOM 1503 CB LEU A 190 8.868 7.389 56.238 1.00 0.00 ATOM 1504 CG LEU A 190 10.354 7.540 55.906 1.00 0.00 ATOM 1505 CD1 LEU A 190 10.540 7.837 54.458 1.00 0.00 ATOM 1506 CD2 LEU A 190 11.021 8.528 56.774 1.00 0.00 ATOM 1507 O LEU A 190 6.541 5.690 57.745 1.00 0.00 ATOM 1508 C LEU A 190 7.051 6.788 57.895 1.00 0.00 ATOM 1509 N ASN A 191 6.369 7.885 58.207 1.00 0.00 ATOM 1510 CA ASN A 191 4.906 7.826 58.186 1.00 0.00 ATOM 1511 CB ASN A 191 4.277 9.182 58.280 1.00 0.00 ATOM 1512 CG ASN A 191 4.399 9.659 59.710 1.00 0.00 ATOM 1513 ND2 ASN A 191 4.705 10.916 59.796 1.00 0.00 ATOM 1514 OD1 ASN A 191 4.241 8.883 60.668 1.00 0.00 ATOM 1515 O ASN A 191 5.407 7.492 55.814 1.00 0.00 ATOM 1516 C ASN A 191 4.596 7.363 56.731 1.00 0.00 ATOM 1517 N PRO A 192 3.516 6.839 56.467 1.00 0.00 ATOM 1518 CA PRO A 192 3.197 6.247 55.151 1.00 0.00 ATOM 1519 CB PRO A 192 2.053 5.211 55.685 1.00 0.00 ATOM 1520 CG PRO A 192 1.304 6.151 56.598 1.00 0.00 ATOM 1521 CD PRO A 192 2.425 6.795 57.391 1.00 0.00 ATOM 1522 O PRO A 192 2.443 6.181 52.906 1.00 0.00 ATOM 1523 C PRO A 192 2.798 6.903 53.837 1.00 0.00 ATOM 1524 N VAL A 193 2.839 8.292 53.771 1.00 0.00 ATOM 1525 CA VAL A 193 2.434 9.028 52.582 1.00 0.00 ATOM 1526 CB VAL A 193 1.523 10.259 53.070 1.00 0.00 ATOM 1527 CG1 VAL A 193 1.235 11.207 51.915 1.00 0.00 ATOM 1528 CG2 VAL A 193 0.211 9.745 53.645 1.00 0.00 ATOM 1529 O VAL A 193 3.418 9.438 50.416 1.00 0.00 ATOM 1530 C VAL A 193 3.525 9.581 51.647 1.00 0.00 ATOM 1531 N ASP A 194 4.526 10.255 52.207 1.00 0.00 ATOM 1532 CA ASP A 194 5.582 10.856 51.393 1.00 0.00 ATOM 1533 CB ASP A 194 6.434 11.747 52.327 1.00 0.00 ATOM 1534 CG ASP A 194 7.249 12.737 51.566 1.00 0.00 ATOM 1535 OD1 ASP A 194 6.656 13.742 51.114 1.00 0.00 ATOM 1536 OD2 ASP A 194 8.448 12.559 51.337 1.00 0.00 ATOM 1537 O ASP A 194 6.752 9.978 49.497 1.00 0.00 ATOM 1538 C ASP A 194 6.411 9.795 50.666 1.00 0.00 ATOM 1539 N VAL A 195 6.703 8.692 51.321 1.00 0.00 ATOM 1540 CA VAL A 195 7.393 7.590 50.654 1.00 0.00 ATOM 1541 CB VAL A 195 7.675 6.466 51.697 1.00 0.00 ATOM 1542 CG1 VAL A 195 7.994 5.096 51.036 1.00 0.00 ATOM 1543 CG2 VAL A 195 8.784 6.850 52.702 1.00 0.00 ATOM 1544 O VAL A 195 7.143 6.851 48.392 1.00 0.00 ATOM 1545 C VAL A 195 6.587 7.069 49.462 1.00 0.00 ATOM 1546 N MET A 196 5.295 6.876 49.655 1.00 0.00 ATOM 1547 CA MET A 196 4.411 6.402 48.582 1.00 0.00 ATOM 1548 CB MET A 196 2.997 6.190 49.123 1.00 0.00 ATOM 1549 CG MET A 196 2.925 5.166 50.241 1.00 0.00 ATOM 1550 SD MET A 196 3.683 3.604 49.766 1.00 0.00 ATOM 1551 CE MET A 196 2.407 2.969 48.740 1.00 0.00 ATOM 1552 O MET A 196 4.424 7.028 46.263 1.00 0.00 ATOM 1553 C MET A 196 4.326 7.405 47.450 1.00 0.00 ATOM 1554 N PHE A 197 4.189 8.680 47.754 1.00 0.00 ATOM 1555 CA PHE A 197 4.149 9.672 46.681 1.00 0.00 ATOM 1556 CB PHE A 197 3.858 11.109 47.299 1.00 0.00 ATOM 1557 CG PHE A 197 2.431 11.374 47.710 1.00 0.00 ATOM 1558 CD1 PHE A 197 1.376 10.621 47.217 1.00 0.00 ATOM 1559 CD2 PHE A 197 2.144 12.418 48.581 1.00 0.00 ATOM 1560 CE1 PHE A 197 0.058 10.908 47.594 1.00 0.00 ATOM 1561 CE2 PHE A 197 0.832 12.710 48.956 1.00 0.00 ATOM 1562 CZ PHE A 197 -0.214 11.956 48.464 1.00 0.00 ATOM 1563 O PHE A 197 5.414 9.842 44.653 1.00 0.00 ATOM 1564 C PHE A 197 5.452 9.741 45.888 1.00 0.00 ATOM 1565 N LEU A 198 6.585 9.660 46.583 1.00 0.00 ATOM 1566 CA LEU A 198 7.890 9.584 45.936 1.00 0.00 ATOM 1567 CB LEU A 198 9.010 9.601 46.979 1.00 0.00 ATOM 1568 CG LEU A 198 10.440 9.563 46.437 1.00 0.00 ATOM 1569 CD1 LEU A 198 10.714 10.770 45.555 1.00 0.00 ATOM 1570 CD2 LEU A 198 11.448 9.570 47.578 1.00 0.00 ATOM 1571 O LEU A 198 8.544 8.406 43.975 1.00 0.00 ATOM 1572 C LEU A 198 8.055 8.335 45.091 1.00 0.00 ATOM 1573 N TYR A 199 7.611 7.183 45.568 1.00 0.00 ATOM 1574 CA TYR A 199 7.749 5.957 44.799 1.00 0.00 ATOM 1575 CB TYR A 199 7.274 4.756 45.621 1.00 0.00 ATOM 1576 CG TYR A 199 7.438 3.429 44.917 1.00 0.00 ATOM 1577 CD1 TYR A 199 8.681 2.816 44.833 1.00 0.00 ATOM 1578 CD2 TYR A 199 6.348 2.792 44.340 1.00 0.00 ATOM 1579 CE1 TYR A 199 8.840 1.601 44.191 1.00 0.00 ATOM 1580 CE2 TYR A 199 6.487 1.578 43.695 1.00 0.00 ATOM 1581 CZ TYR A 199 7.746 0.987 43.624 1.00 0.00 ATOM 1582 OH TYR A 199 7.901 -0.223 42.984 1.00 0.00 ATOM 1583 O TYR A 199 7.358 5.576 42.465 1.00 0.00 ATOM 1584 C TYR A 199 6.922 6.001 43.533 1.00 0.00 ATOM 1585 N LYS A 200 5.706 6.549 43.614 1.00 0.00 ATOM 1586 CA LYS A 200 4.895 6.688 42.408 1.00 0.00 ATOM 1587 CB LYS A 200 3.519 7.253 42.844 1.00 0.00 ATOM 1588 CG LYS A 200 2.693 6.353 43.746 1.00 0.00 ATOM 1589 CD LYS A 200 1.439 7.082 44.220 1.00 0.00 ATOM 1590 CE LYS A 200 0.659 6.255 45.229 1.00 0.00 ATOM 1591 NZ LYS A 200 -0.541 6.983 45.735 1.00 0.00 ATOM 1592 O LYS A 200 5.650 7.275 40.201 1.00 0.00 ATOM 1593 C LYS A 200 5.602 7.579 41.394 1.00 0.00 ATOM 1594 N THR A 201 6.171 8.690 41.893 1.00 0.00 ATOM 1595 CA THR A 201 6.872 9.630 41.029 1.00 0.00 ATOM 1596 CB THR A 201 7.447 10.876 41.740 1.00 0.00 ATOM 1597 CG2 THR A 201 6.289 11.741 42.266 1.00 0.00 ATOM 1598 OG1 THR A 201 8.321 10.531 42.833 1.00 0.00 ATOM 1599 O THR A 201 8.248 9.162 39.123 1.00 0.00 ATOM 1600 C THR A 201 8.017 8.929 40.307 1.00 0.00 ATOM 1601 N ILE A 202 8.762 8.062 41.023 1.00 0.00 ATOM 1602 CA ILE A 202 9.872 7.320 40.424 1.00 0.00 ATOM 1603 CB ILE A 202 10.643 6.502 41.505 1.00 0.00 ATOM 1604 CG1 ILE A 202 11.271 7.432 42.541 1.00 0.00 ATOM 1605 CG2 ILE A 202 11.749 5.684 40.877 1.00 0.00 ATOM 1606 CD1 ILE A 202 11.932 6.661 43.675 1.00 0.00 ATOM 1607 O ILE A 202 9.880 6.362 38.219 1.00 0.00 ATOM 1608 C ILE A 202 9.314 6.433 39.311 1.00 0.00 ATOM 1609 N GLU A 203 8.165 5.772 39.573 1.00 0.00 ATOM 1610 CA GLU A 203 7.568 4.842 38.628 1.00 0.00 ATOM 1611 CB GLU A 203 6.311 4.242 39.259 1.00 0.00 ATOM 1612 CG GLU A 203 5.569 3.268 38.358 1.00 0.00 ATOM 1613 CD GLU A 203 4.361 2.649 39.034 1.00 0.00 ATOM 1614 OE1 GLU A 203 4.116 2.970 40.217 1.00 0.00 ATOM 1615 OE2 GLU A 203 3.662 1.846 38.383 1.00 0.00 ATOM 1616 O GLU A 203 7.322 5.061 36.234 1.00 0.00 ATOM 1617 C GLU A 203 7.125 5.559 37.350 1.00 0.00 ATOM 1618 N TRP A 204 6.574 6.746 37.519 1.00 0.00 ATOM 1619 CA TRP A 204 6.208 7.601 36.377 1.00 0.00 ATOM 1620 CB TRP A 204 5.526 8.882 36.867 1.00 0.00 ATOM 1621 CG TRP A 204 4.126 8.670 37.353 1.00 0.00 ATOM 1622 CD1 TRP A 204 3.689 8.732 38.643 1.00 0.00 ATOM 1623 CD2 TRP A 204 2.978 8.360 36.552 1.00 0.00 ATOM 1624 CE2 TRP A 204 1.880 8.251 37.428 1.00 0.00 ATOM 1625 CE3 TRP A 204 2.770 8.167 35.183 1.00 0.00 ATOM 1626 NE1 TRP A 204 2.340 8.479 38.700 1.00 0.00 ATOM 1627 CZ2 TRP A 204 0.593 7.952 36.978 1.00 0.00 ATOM 1628 CZ3 TRP A 204 1.493 7.873 34.743 1.00 0.00 ATOM 1629 CH2 TRP A 204 0.421 7.769 35.636 1.00 0.00 ATOM 1630 O TRP A 204 7.433 7.878 34.346 1.00 0.00 ATOM 1631 C TRP A 204 7.453 7.952 35.563 1.00 0.00 ATOM 1632 N VAL A 205 8.591 8.344 36.215 1.00 0.00 ATOM 1633 CA VAL A 205 9.822 8.658 35.484 1.00 0.00 ATOM 1634 CB VAL A 205 10.924 9.189 36.498 1.00 0.00 ATOM 1635 CG1 VAL A 205 12.254 9.462 35.761 1.00 0.00 ATOM 1636 CG2 VAL A 205 10.438 10.452 37.190 1.00 0.00 ATOM 1637 O VAL A 205 10.704 7.527 33.561 1.00 0.00 ATOM 1638 C VAL A 205 10.281 7.423 34.713 1.00 0.00 ATOM 1639 N GLY A 206 10.226 6.232 35.354 1.00 0.00 ATOM 1640 CA GLY A 206 10.625 5.009 34.683 1.00 0.00 ATOM 1641 O GLY A 206 10.305 4.414 32.337 1.00 0.00 ATOM 1642 C GLY A 206 9.779 4.767 33.410 1.00 0.00 ATOM 1643 N GLY A 207 8.484 4.997 33.516 1.00 0.00 ATOM 1644 CA GLY A 207 7.613 4.827 32.357 1.00 0.00 ATOM 1645 O GLY A 207 7.964 5.555 30.083 1.00 0.00 ATOM 1646 C GLY A 207 7.914 5.881 31.263 1.00 0.00 ATOM 1647 N LEU A 208 8.154 7.112 31.671 1.00 0.00 ATOM 1648 CA LEU A 208 8.509 8.171 30.729 1.00 0.00 ATOM 1649 CB LEU A 208 8.683 9.468 31.497 1.00 0.00 ATOM 1650 CG LEU A 208 9.292 10.628 30.722 1.00 0.00 ATOM 1651 CD1 LEU A 208 8.455 11.009 29.537 1.00 0.00 ATOM 1652 CD2 LEU A 208 9.461 11.827 31.674 1.00 0.00 ATOM 1653 O LEU A 208 9.853 7.966 28.773 1.00 0.00 ATOM 1654 C LEU A 208 9.775 7.779 29.968 1.00 0.00 ATOM 1655 N ALA A 209 10.750 7.211 30.670 1.00 0.00 ATOM 1656 CA ALA A 209 11.961 6.743 30.017 1.00 0.00 ATOM 1657 CB ALA A 209 12.937 6.185 31.041 1.00 0.00 ATOM 1658 O ALA A 209 12.214 5.593 27.894 1.00 0.00 ATOM 1659 C ALA A 209 11.610 5.654 29.001 1.00 0.00 ATOM 1660 N ASP A 210 10.700 4.733 29.364 1.00 0.00 ATOM 1661 CA ASP A 210 10.265 3.677 28.415 1.00 0.00 ATOM 1662 CB ASP A 210 9.196 2.789 29.056 1.00 0.00 ATOM 1663 CG ASP A 210 9.770 1.839 30.088 1.00 0.00 ATOM 1664 OD1 ASP A 210 11.009 1.698 30.143 1.00 0.00 ATOM 1665 OD2 ASP A 210 8.979 1.236 30.846 1.00 0.00 ATOM 1666 O ASP A 210 9.902 3.856 26.043 1.00 0.00 ATOM 1667 C ASP A 210 9.651 4.305 27.160 1.00 0.00 ATOM 1668 N LEU A 211 8.862 5.358 27.348 1.00 0.00 ATOM 1669 CA LEU A 211 8.268 6.079 26.222 1.00 0.00 ATOM 1670 CB LEU A 211 7.349 7.186 26.691 1.00 0.00 ATOM 1671 CG LEU A 211 6.065 6.717 27.379 1.00 0.00 ATOM 1672 CD1 LEU A 211 5.216 7.928 27.707 1.00 0.00 ATOM 1673 CD2 LEU A 211 5.298 5.770 26.481 1.00 0.00 ATOM 1674 O LEU A 211 9.204 6.710 24.104 1.00 0.00 ATOM 1675 C LEU A 211 9.340 6.695 25.330 1.00 0.00 ATOM 1676 N ALA A 212 10.427 7.207 25.944 1.00 0.00 ATOM 1677 CA ALA A 212 11.527 7.806 25.196 1.00 0.00 ATOM 1678 CB ALA A 212 12.557 8.425 26.093 1.00 0.00 ATOM 1679 O ALA A 212 12.481 6.993 23.153 1.00 0.00 ATOM 1680 C ALA A 212 12.187 6.746 24.328 1.00 0.00 ATOM 1681 N GLU A 213 12.400 5.541 24.882 1.00 0.00 ATOM 1682 CA GLU A 213 12.900 4.423 24.086 1.00 0.00 ATOM 1683 CB GLU A 213 13.067 3.177 24.960 1.00 0.00 ATOM 1684 CG GLU A 213 13.630 1.973 24.223 1.00 0.00 ATOM 1685 CD GLU A 213 13.833 0.780 25.133 1.00 0.00 ATOM 1686 OE1 GLU A 213 13.552 0.898 26.345 1.00 0.00 ATOM 1687 OE2 GLU A 213 14.278 -0.277 24.635 1.00 0.00 ATOM 1688 O GLU A 213 12.390 3.747 21.842 1.00 0.00 ATOM 1689 C GLU A 213 11.951 4.060 22.945 1.00 0.00 ATOM 1690 N ARG A 214 10.613 4.094 23.193 1.00 0.00 ATOM 1691 CA ARG A 214 9.632 3.781 22.159 1.00 0.00 ATOM 1692 CB ARG A 214 8.216 3.790 22.735 1.00 0.00 ATOM 1693 CG ARG A 214 7.911 2.616 23.651 1.00 0.00 ATOM 1694 CD ARG A 214 6.519 2.726 24.248 1.00 0.00 ATOM 1695 NE ARG A 214 6.212 1.605 25.133 1.00 0.00 ATOM 1696 CZ ARG A 214 5.094 1.498 25.844 1.00 0.00 ATOM 1697 NH1 ARG A 214 4.901 0.442 26.622 1.00 0.00 ATOM 1698 NH2 ARG A 214 4.172 2.446 25.775 1.00 0.00 ATOM 1699 O ARG A 214 9.540 4.466 19.857 1.00 0.00 ATOM 1700 C ARG A 214 9.701 4.818 21.014 1.00 0.00 ATOM 1701 N VAL A 215 9.903 6.096 21.355 1.00 0.00 ATOM 1702 CA VAL A 215 10.102 7.143 20.352 1.00 0.00 ATOM 1703 CB VAL A 215 10.204 8.541 21.031 1.00 0.00 ATOM 1704 CG1 VAL A 215 10.560 9.601 20.002 1.00 0.00 ATOM 1705 CG2 VAL A 215 8.908 8.910 21.739 1.00 0.00 ATOM 1706 O VAL A 215 11.228 6.944 18.264 1.00 0.00 ATOM 1707 C VAL A 215 11.307 6.817 19.478 1.00 0.00 ATOM 1708 N GLY A 216 12.395 6.328 20.070 1.00 0.00 ATOM 1709 CA GLY A 216 13.595 6.025 19.288 1.00 0.00 ATOM 1710 O GLY A 216 13.706 4.961 17.143 1.00 0.00 ATOM 1711 C GLY A 216 13.325 4.877 18.303 1.00 0.00 ATOM 1712 N SER A 217 12.781 3.767 18.778 1.00 0.00 ATOM 1713 CA SER A 217 12.476 2.651 17.892 1.00 0.00 ATOM 1714 CB SER A 217 11.809 1.515 18.674 1.00 0.00 ATOM 1715 OG SER A 217 12.708 0.948 19.611 1.00 0.00 ATOM 1716 O SER A 217 11.761 2.786 15.582 1.00 0.00 ATOM 1717 C SER A 217 11.522 3.073 16.758 1.00 0.00 ATOM 1718 N ARG A 218 10.467 3.805 17.114 1.00 0.00 ATOM 1719 CA ARG A 218 9.494 4.261 16.126 1.00 0.00 ATOM 1720 CB ARG A 218 8.317 4.957 16.813 1.00 0.00 ATOM 1721 CG ARG A 218 7.431 4.024 17.623 1.00 0.00 ATOM 1722 CD ARG A 218 6.263 4.774 18.245 1.00 0.00 ATOM 1723 NE ARG A 218 5.440 3.906 19.081 1.00 0.00 ATOM 1724 CZ ARG A 218 4.515 3.076 18.615 1.00 0.00 ATOM 1725 NH1 ARG A 218 3.814 2.323 19.453 1.00 0.00 ATOM 1726 NH2 ARG A 218 4.292 2.997 17.309 1.00 0.00 ATOM 1727 O ARG A 218 9.829 5.223 13.961 1.00 0.00 ATOM 1728 C ARG A 218 10.133 5.250 15.143 1.00 0.00 ATOM 1729 N LEU A 219 11.025 6.103 15.632 1.00 0.00 ATOM 1730 CA LEU A 219 11.728 7.053 14.773 1.00 0.00 ATOM 1731 CB LEU A 219 12.701 7.929 15.523 1.00 0.00 ATOM 1732 CG LEU A 219 12.125 8.775 16.656 1.00 0.00 ATOM 1733 CD1 LEU A 219 13.180 9.803 17.089 1.00 0.00 ATOM 1734 CD2 LEU A 219 10.865 9.533 16.267 1.00 0.00 ATOM 1735 O LEU A 219 12.571 6.701 12.584 1.00 0.00 ATOM 1736 C LEU A 219 12.577 6.323 13.752 1.00 0.00 ATOM 1737 N GLU A 220 13.272 5.272 14.196 1.00 0.00 ATOM 1738 CA GLU A 220 14.091 4.499 13.266 1.00 0.00 ATOM 1739 CB GLU A 220 14.885 3.397 14.016 1.00 0.00 ATOM 1740 CG GLU A 220 15.597 2.375 13.111 1.00 0.00 ATOM 1741 CD GLU A 220 16.775 2.962 12.309 1.00 0.00 ATOM 1742 OE1 GLU A 220 17.293 2.261 11.419 1.00 0.00 ATOM 1743 OE2 GLU A 220 17.185 4.109 12.562 1.00 0.00 ATOM 1744 O GLU A 220 13.596 3.966 10.979 1.00 0.00 ATOM 1745 C GLU A 220 13.217 3.934 12.147 1.00 0.00 ATOM 1746 N LEU A 221 12.053 3.435 12.522 1.00 0.00 ATOM 1747 CA LEU A 221 11.113 2.870 11.554 1.00 0.00 ATOM 1748 CB LEU A 221 9.904 2.248 12.257 1.00 0.00 ATOM 1749 CG LEU A 221 10.180 1.001 13.102 1.00 0.00 ATOM 1750 CD1 LEU A 221 8.937 0.596 13.881 1.00 0.00 ATOM 1751 CD2 LEU A 221 10.585 -0.166 12.217 1.00 0.00 ATOM 1752 O LEU A 221 10.513 3.634 9.367 1.00 0.00 ATOM 1753 C LEU A 221 10.636 3.921 10.559 1.00 0.00 ATOM 1754 N MET A 222 10.307 5.090 10.970 1.00 0.00 ATOM 1755 CA MET A 222 9.862 6.193 10.122 1.00 0.00 ATOM 1756 CB MET A 222 9.504 7.411 10.977 1.00 0.00 ATOM 1757 CG MET A 222 8.268 7.220 11.841 1.00 0.00 ATOM 1758 SD MET A 222 7.937 8.637 12.905 1.00 0.00 ATOM 1759 CE MET A 222 7.456 9.866 11.693 1.00 0.00 ATOM 1760 O MET A 222 10.727 6.763 7.946 1.00 0.00 ATOM 1761 C MET A 222 10.976 6.547 9.137 1.00 0.00 ATOM 1762 N LEU A 223 12.215 6.558 9.619 1.00 0.00 ATOM 1763 CA LEU A 223 13.349 6.887 8.764 1.00 0.00 ATOM 1764 CB LEU A 223 14.644 6.996 9.585 1.00 0.00 ATOM 1765 CG LEU A 223 15.936 7.170 8.765 1.00 0.00 ATOM 1766 CD1 LEU A 223 15.949 8.532 7.990 1.00 0.00 ATOM 1767 CD2 LEU A 223 17.099 7.115 9.701 1.00 0.00 ATOM 1768 O LEU A 223 13.805 6.244 6.488 1.00 0.00 ATOM 1769 C LEU A 223 13.510 5.872 7.629 1.00 0.00 ATOM 1770 N ALA A 224 13.358 4.608 7.972 1.00 0.00 ATOM 1771 CA ALA A 224 13.483 3.517 7.004 1.00 0.00 ATOM 1772 CB ALA A 224 13.373 2.163 7.689 1.00 0.00 ATOM 1773 O ALA A 224 12.642 3.443 4.750 1.00 0.00 ATOM 1774 C ALA A 224 12.384 3.575 5.953 1.00 0.00 ATOM 1775 N ARG A 225 11.164 3.782 6.412 1.00 0.00 ATOM 1776 CA ARG A 225 10.029 3.784 5.494 1.00 0.00 ATOM 1777 CB ARG A 225 8.717 3.658 6.348 1.00 0.00 ATOM 1778 CG ARG A 225 8.419 2.306 6.886 1.00 0.00 ATOM 1779 CD ARG A 225 7.076 2.251 7.546 1.00 0.00 ATOM 1780 NE ARG A 225 5.975 2.294 6.584 1.00 0.00 ATOM 1781 CZ ARG A 225 4.724 2.581 6.923 1.00 0.00 ATOM 1782 NH1 ARG A 225 4.440 2.856 8.191 1.00 0.00 ATOM 1783 NH2 ARG A 225 3.754 2.587 6.016 1.00 0.00 ATOM 1784 O ARG A 225 9.800 4.839 3.343 1.00 0.00 ATOM 1785 C ARG A 225 10.094 4.968 4.532 1.00 0.00 ATOM 1786 N VAL A 226 10.509 6.118 5.045 1.00 0.00 ATOM 1787 CA VAL A 226 10.641 7.339 4.261 1.00 0.00 ATOM 1788 CB VAL A 226 9.607 8.413 4.650 1.00 0.00 ATOM 1789 CG1 VAL A 226 9.722 9.629 3.745 1.00 0.00 ATOM 1790 CG2 VAL A 226 8.204 7.819 4.593 1.00 0.00 ATOM 1791 O VAL A 226 12.556 7.994 5.541 1.00 0.00 ATOM 1792 C VAL A 226 12.092 7.765 4.423 1.00 0.00 ENDMDL EXPDTA 2iiuA MODEL 2 REMARK 44 REMARK 44 model 2 is called 2iiuA ATOM 1 N SER 13 10.068 20.701 6.159 1.00 0.00 ATOM 2 CA SER 13 9.907 19.224 6.206 1.00 0.00 ATOM 3 CB SER 13 11.079 18.560 6.948 1.00 0.00 ATOM 4 O SER 13 8.182 19.696 7.767 1.00 0.00 ATOM 5 C SER 13 8.612 18.910 6.931 1.00 0.00 ATOM 6 N PRO 14 7.961 17.784 6.575 1.00 0.00 ATOM 7 CA PRO 14 6.736 17.313 7.269 1.00 0.00 ATOM 8 CB PRO 14 6.346 16.020 6.542 1.00 0.00 ATOM 9 CG PRO 14 7.432 15.748 5.516 1.00 0.00 ATOM 10 CD PRO 14 8.343 16.942 5.421 1.00 0.00 ATOM 11 O PRO 14 6.082 16.827 9.502 1.00 0.00 ATOM 12 C PRO 14 7.002 16.947 8.715 1.00 0.00 ATOM 13 N ILE 15 8.261 16.712 9.041 1.00 0.00 ATOM 14 CA ILE 15 8.624 16.376 10.391 1.00 0.00 ATOM 15 CB ILE 15 9.945 15.524 10.408 1.00 0.00 ATOM 16 CG1 ILE 15 10.140 14.790 11.735 1.00 0.00 ATOM 17 CG2 ILE 15 11.131 16.365 10.143 1.00 0.00 ATOM 18 O ILE 15 8.641 17.537 12.490 1.00 0.00 ATOM 19 C ILE 15 8.728 17.648 11.281 1.00 0.00 ATOM 20 N LYS 16 8.838 18.846 10.691 1.00 0.00 ATOM 21 CA LYS 16 9.041 20.076 11.500 1.00 0.00 ATOM 22 CB LYS 16 9.237 21.332 10.636 1.00 0.00 ATOM 23 O LYS 16 8.335 20.637 13.685 1.00 0.00 ATOM 24 C LYS 16 7.985 20.330 12.582 1.00 0.00 ATOM 25 N PRO 17 6.685 20.238 12.252 1.00 0.00 ATOM 26 CA PRO 17 5.664 20.355 13.301 1.00 0.00 ATOM 27 CB PRO 17 4.355 20.070 12.554 1.00 0.00 ATOM 28 CG PRO 17 4.641 20.436 11.132 1.00 0.00 ATOM 29 CD PRO 17 6.097 20.075 10.910 1.00 0.00 ATOM 30 O PRO 17 5.600 19.618 15.622 1.00 0.00 ATOM 31 C PRO 17 5.851 19.317 14.447 1.00 0.00 ATOM 32 N LEU 18 6.309 18.121 14.105 1.00 0.00 ATOM 33 CA LEU 18 6.578 17.074 15.099 1.00 0.00 ATOM 34 CB LEU 18 6.716 15.701 14.415 1.00 0.00 ATOM 35 CG LEU 18 5.257 15.322 14.179 1.00 0.00 ATOM 36 CD1 LEU 18 4.890 15.020 12.777 1.00 0.00 ATOM 37 CD2 LEU 18 4.816 14.272 15.168 1.00 0.00 ATOM 38 O LEU 18 7.737 17.139 17.178 1.00 0.00 ATOM 39 C LEU 18 7.767 17.384 15.958 1.00 0.00 ATOM 40 N GLN 19 8.784 17.983 15.350 1.00 0.00 ATOM 41 CA GLN 19 9.964 18.380 16.095 1.00 0.00 ATOM 42 CB GLN 19 11.045 18.869 15.179 1.00 0.00 ATOM 43 CG GLN 19 11.434 17.861 14.125 1.00 0.00 ATOM 44 CD GLN 19 12.399 18.411 13.067 1.00 0.00 ATOM 45 OE1 GLN 19 12.928 17.648 12.265 1.00 0.00 ATOM 46 NE2 GLN 19 12.655 19.717 13.092 1.00 0.00 ATOM 47 O GLN 19 10.049 19.371 18.253 1.00 0.00 ATOM 48 C GLN 19 9.608 19.459 17.111 1.00 0.00 ATOM 49 N GLU 20 8.795 20.434 16.690 1.00 0.00 ATOM 50 CA GLU 20 8.320 21.521 17.552 1.00 0.00 ATOM 51 CB GLU 20 7.444 22.463 16.735 1.00 0.00 ATOM 52 CG GLU 20 7.217 23.834 17.322 1.00 0.00 ATOM 53 O GLU 20 7.707 21.343 19.880 1.00 0.00 ATOM 54 C GLU 20 7.521 20.956 18.727 1.00 0.00 ATOM 55 N HIS 21 6.608 20.046 18.449 1.00 0.00 ATOM 56 CA HIS 21 5.852 19.402 19.538 1.00 0.00 ATOM 57 CB HIS 21 4.846 18.419 18.940 1.00 0.00 ATOM 58 CG HIS 21 4.005 17.709 19.956 1.00 0.00 ATOM 59 CD2 HIS 21 2.919 18.127 20.645 1.00 0.00 ATOM 60 ND1 HIS 21 4.266 16.424 20.388 1.00 0.00 ATOM 61 CE1 HIS 21 3.386 16.096 21.313 1.00 0.00 ATOM 62 NE2 HIS 21 2.548 17.111 21.481 1.00 0.00 ATOM 63 O HIS 21 6.733 18.766 21.723 1.00 0.00 ATOM 64 C HIS 21 6.807 18.651 20.508 1.00 0.00 ATOM 65 N MET 22 7.746 17.904 19.968 1.00 0.00 ATOM 66 CA MET 22 8.682 17.167 20.786 1.00 0.00 ATOM 67 CB MET 22 9.556 16.268 19.903 1.00 0.00 ATOM 68 CG MET 22 10.528 15.293 20.642 1.00 0.00 ATOM 69 SD MET 22 9.693 13.944 21.746 1.00 0.00 ATOM 70 CE MET 22 10.206 14.534 23.424 1.00 0.00 ATOM 71 O MET 22 9.790 17.831 22.822 1.00 0.00 ATOM 72 C MET 22 9.531 18.121 21.633 1.00 0.00 ATOM 73 N ASP 23 9.939 19.251 21.058 1.00 0.00 ATOM 74 CA ASP 23 10.684 20.244 21.830 1.00 0.00 ATOM 75 CB ASP 23 11.142 21.421 20.977 1.00 0.00 ATOM 76 CG ASP 23 12.197 21.037 19.929 1.00 0.00 ATOM 77 OD1 ASP 23 12.830 19.965 20.037 1.00 0.00 ATOM 78 OD2 ASP 23 12.376 21.819 18.968 1.00 0.00 ATOM 79 O ASP 23 10.361 20.847 24.114 1.00 0.00 ATOM 80 C ASP 23 9.851 20.728 23.022 1.00 0.00 ATOM 81 N LYS 24 8.564 20.987 22.806 1.00 0.00 ATOM 82 CA LYS 24 7.670 21.419 23.890 1.00 0.00 ATOM 83 CB LYS 24 6.283 21.755 23.334 1.00 0.00 ATOM 84 CG LYS 24 5.305 22.434 24.321 1.00 0.00 ATOM 85 CD LYS 24 5.838 23.685 24.967 1.00 0.00 ATOM 86 CE LYS 24 6.054 24.809 24.004 1.00 0.00 ATOM 87 NZ LYS 24 6.702 25.918 24.752 1.00 0.00 ATOM 88 O LYS 24 7.447 20.594 26.156 1.00 0.00 ATOM 89 C LYS 24 7.508 20.336 24.965 1.00 0.00 ATOM 90 N VAL 25 7.370 19.107 24.526 1.00 0.00 ATOM 91 CA VAL 25 7.227 17.972 25.472 1.00 0.00 ATOM 92 CB VAL 25 6.814 16.690 24.713 1.00 0.00 ATOM 93 CG1 VAL 25 7.050 15.467 25.509 1.00 0.00 ATOM 94 CG2 VAL 25 5.336 16.798 24.265 1.00 0.00 ATOM 95 O VAL 25 8.481 17.494 27.507 1.00 0.00 ATOM 96 C VAL 25 8.523 17.775 26.298 1.00 0.00 ATOM 97 N TYR 26 9.677 17.954 25.670 1.00 0.00 ATOM 98 CA TYR 26 10.906 17.907 26.406 1.00 0.00 ATOM 99 CB TYR 26 12.127 17.972 25.496 1.00 0.00 ATOM 100 CG TYR 26 13.443 18.008 26.284 1.00 0.00 ATOM 101 CD1 TYR 26 13.897 16.883 26.936 1.00 0.00 ATOM 102 CD2 TYR 26 14.185 19.162 26.392 1.00 0.00 ATOM 103 CE1 TYR 26 15.038 16.889 27.666 1.00 0.00 ATOM 104 CE2 TYR 26 15.356 19.186 27.135 1.00 0.00 ATOM 105 CZ TYR 26 15.788 18.035 27.748 1.00 0.00 ATOM 106 OH TYR 26 16.920 18.011 28.521 1.00 0.00 ATOM 107 O TYR 26 11.336 18.785 28.567 1.00 0.00 ATOM 108 C TYR 26 10.956 19.036 27.449 1.00 0.00 ATOM 109 N ASP 27 10.643 20.270 27.072 1.00 0.00 ATOM 110 CA ASP 27 10.628 21.385 27.994 1.00 0.00 ATOM 111 CB ASP 27 10.077 22.593 27.286 1.00 0.00 ATOM 112 CG ASP 27 11.042 23.154 26.242 1.00 0.00 ATOM 113 OD1 ASP 27 12.203 22.708 26.212 1.00 0.00 ATOM 114 OD2 ASP 27 10.634 24.047 25.455 1.00 0.00 ATOM 115 O ASP 27 10.056 21.332 30.341 1.00 0.00 ATOM 116 C ASP 27 9.727 21.073 29.190 1.00 0.00 ATOM 117 N CYS 28 8.555 20.533 28.903 1.00 0.00 ATOM 118 CA CYS 28 7.587 20.212 29.957 1.00 0.00 ATOM 119 CB CYS 28 6.322 19.710 29.266 1.00 0.00 ATOM 120 SG CYS 28 5.073 19.124 30.321 1.00 0.00 ATOM 121 O CYS 28 8.088 19.309 32.213 1.00 0.00 ATOM 122 C CYS 28 8.141 19.166 30.969 1.00 0.00 ATOM 123 N ALA 29 8.726 18.106 30.434 1.00 0.00 ATOM 124 CA ALA 29 9.304 17.083 31.300 1.00 0.00 ATOM 125 CB ALA 29 9.662 15.862 30.548 1.00 0.00 ATOM 126 O ALA 29 10.742 17.138 33.220 1.00 0.00 ATOM 127 C ALA 29 10.526 17.574 32.077 1.00 0.00 ATOM 128 N SER 30 11.341 18.423 31.459 1.00 0.00 ATOM 129 CA SER 30 12.528 18.973 32.101 1.00 0.00 ATOM 130 CB SER 30 13.368 19.819 31.132 1.00 0.00 ATOM 131 OG SER 30 13.722 19.026 30.017 1.00 0.00 ATOM 132 O SER 30 13.052 19.931 34.218 1.00 0.00 ATOM 133 C SER 30 12.204 19.818 33.327 1.00 0.00 ATOM 134 N LEU 31 11.031 20.452 33.349 1.00 0.00 ATOM 135 CA LEU 31 10.630 21.275 34.490 1.00 0.00 ATOM 136 CB LEU 31 9.345 22.034 34.172 1.00 0.00 ATOM 137 CG LEU 31 9.515 23.255 33.267 1.00 0.00 ATOM 138 CD1 LEU 31 8.160 23.636 32.678 1.00 0.00 ATOM 139 CD2 LEU 31 10.207 24.427 33.963 1.00 0.00 ATOM 140 O LEU 31 10.360 20.985 36.868 1.00 0.00 ATOM 141 C LEU 31 10.447 20.438 35.773 1.00 0.00 ATOM 142 N LEU 32 10.381 19.113 35.641 1.00 0.00 ATOM 143 CA LEU 32 10.253 18.243 36.795 1.00 0.00 ATOM 144 CB LEU 32 10.017 16.790 36.369 1.00 0.00 ATOM 145 CG LEU 32 8.615 16.433 35.853 1.00 0.00 ATOM 146 CD1 LEU 32 8.543 15.009 35.313 1.00 0.00 ATOM 147 CD2 LEU 32 7.598 16.571 36.965 1.00 0.00 ATOM 148 O LEU 32 11.387 18.086 38.910 1.00 0.00 ATOM 149 C LEU 32 11.480 18.318 37.705 1.00 0.00 ATOM 150 N VAL 33 12.651 18.619 37.149 1.00 0.00 ATOM 151 CA VAL 33 13.839 18.678 38.002 1.00 0.00 ATOM 152 CB VAL 33 15.164 18.692 37.204 1.00 0.00 ATOM 153 CG1 VAL 33 16.374 19.024 38.124 1.00 0.00 ATOM 154 CG2 VAL 33 15.363 17.361 36.510 1.00 0.00 ATOM 155 O VAL 33 13.782 19.657 40.166 1.00 0.00 ATOM 156 C VAL 33 13.727 19.869 38.965 1.00 0.00 ATOM 157 N PRO 34 13.577 21.116 38.457 1.00 0.00 ATOM 158 CA PRO 34 13.409 22.205 39.435 1.00 0.00 ATOM 159 CB PRO 34 13.436 23.462 38.595 1.00 0.00 ATOM 160 CG PRO 34 13.238 23.020 37.171 1.00 0.00 ATOM 161 CD PRO 34 13.663 21.612 37.075 1.00 0.00 ATOM 162 O PRO 34 12.136 22.554 41.423 1.00 0.00 ATOM 163 C PRO 34 12.146 22.096 40.285 1.00 0.00 ATOM 164 N PHE 35 11.108 21.447 39.775 1.00 0.00 ATOM 165 CA PHE 35 9.893 21.229 40.540 1.00 0.00 ATOM 166 CB PHE 35 8.860 20.493 39.685 1.00 0.00 ATOM 167 CG PHE 35 7.710 19.973 40.471 1.00 0.00 ATOM 168 CD1 PHE 35 6.674 20.821 40.864 1.00 0.00 ATOM 169 CD2 PHE 35 7.654 18.626 40.833 1.00 0.00 ATOM 170 CE1 PHE 35 5.597 20.341 41.606 1.00 0.00 ATOM 171 CE2 PHE 35 6.607 18.143 41.596 1.00 0.00 ATOM 172 CZ PHE 35 5.558 19.002 41.968 1.00 0.00 ATOM 173 O PHE 35 9.844 20.771 42.881 1.00 0.00 ATOM 174 C PHE 35 10.200 20.411 41.783 1.00 0.00 ATOM 175 N PHE 36 10.846 19.282 41.592 1.00 0.00 ATOM 176 CA PHE 36 11.238 18.427 42.697 1.00 0.00 ATOM 177 CB PHE 36 11.736 17.064 42.201 1.00 0.00 ATOM 178 CG PHE 36 10.612 16.055 41.980 1.00 0.00 ATOM 179 CD1 PHE 36 9.969 15.488 43.081 1.00 0.00 ATOM 180 CD2 PHE 36 10.196 15.703 40.713 1.00 0.00 ATOM 181 CE1 PHE 36 8.915 14.596 42.925 1.00 0.00 ATOM 182 CE2 PHE 36 9.154 14.777 40.519 1.00 0.00 ATOM 183 CZ PHE 36 8.511 14.214 41.620 1.00 0.00 ATOM 184 O PHE 36 12.252 18.861 44.819 1.00 0.00 ATOM 185 C PHE 36 12.284 19.062 43.598 1.00 0.00 ATOM 186 N GLU 37 13.210 19.824 43.007 1.00 0.00 ATOM 187 CA GLU 37 14.219 20.524 43.817 1.00 0.00 ATOM 188 CB GLU 37 15.286 21.241 42.967 1.00 0.00 ATOM 189 CG GLU 37 16.253 20.255 42.296 1.00 0.00 ATOM 190 CD GLU 37 17.221 20.915 41.288 1.00 0.00 ATOM 191 OE1 GLU 37 16.891 21.996 40.718 1.00 0.00 ATOM 192 OE2 GLU 37 18.320 20.339 41.053 1.00 0.00 ATOM 193 O GLU 37 13.905 21.608 45.923 1.00 0.00 ATOM 194 C GLU 37 13.519 21.490 44.776 1.00 0.00 ATOM 195 N ALA 38 12.475 22.163 44.306 1.00 0.00 ATOM 196 CA ALA 38 11.716 23.065 45.151 1.00 0.00 ATOM 197 CB ALA 38 10.707 23.836 44.308 1.00 0.00 ATOM 198 O ALA 38 11.000 22.773 47.404 1.00 0.00 ATOM 199 C ALA 38 10.997 22.320 46.268 1.00 0.00 ATOM 200 N THR 39 10.387 21.171 45.964 1.00 0.00 ATOM 201 CA THR 39 9.696 20.423 47.020 1.00 0.00 ATOM 202 CB THR 39 9.005 19.141 46.509 1.00 0.00 ATOM 203 CG2 THR 39 8.038 19.445 45.416 1.00 0.00 ATOM 204 OG1 THR 39 9.985 18.203 46.065 1.00 0.00 ATOM 205 O THR 39 10.378 20.047 49.303 1.00 0.00 ATOM 206 C THR 39 10.686 19.997 48.121 1.00 0.00 ATOM 207 N ILE 40 11.872 19.580 47.709 1.00 0.00 ATOM 208 CA ILE 40 12.923 19.112 48.606 1.00 0.00 ATOM 209 CB ILE 40 14.106 18.561 47.782 1.00 0.00 ATOM 210 CG1 ILE 40 13.735 17.213 47.163 1.00 0.00 ATOM 211 CG2 ILE 40 15.320 18.409 48.635 1.00 0.00 ATOM 212 CD1 ILE 40 14.764 16.727 46.139 1.00 0.00 ATOM 213 O ILE 40 13.680 20.010 50.719 1.00 0.00 ATOM 214 C ILE 40 13.412 20.235 49.549 1.00 0.00 ATOM 215 N THR 41 13.518 21.463 49.062 1.00 0.00 ATOM 216 CA THR 41 13.879 22.542 49.963 1.00 0.00 ATOM 217 CB THR 41 14.581 23.724 49.221 1.00 0.00 ATOM 218 CG2 THR 41 15.946 23.264 48.670 1.00 0.00 ATOM 219 OG1 THR 41 13.773 24.219 48.129 1.00 0.00 ATOM 220 O THR 41 12.747 24.032 51.425 1.00 0.00 ATOM 221 C THR 41 12.664 23.044 50.755 1.00 0.00 ATOM 222 N GLY 42 11.530 22.363 50.690 1.00 0.00 ATOM 223 CA GLY 42 10.327 22.823 51.382 1.00 0.00 ATOM 224 O GLY 42 8.860 24.699 51.564 1.00 0.00 ATOM 225 C GLY 42 9.676 24.105 50.857 1.00 0.00 ATOM 226 N ASN 43 10.023 24.560 49.648 1.00 0.00 ATOM 227 CA ASN 43 9.382 25.767 49.106 1.00 0.00 ATOM 228 CB ASN 43 10.358 26.651 48.328 1.00 0.00 ATOM 229 CG ASN 43 9.841 28.083 48.152 1.00 0.00 ATOM 230 ND2 ASN 43 10.751 29.043 48.252 1.00 0.00 ATOM 231 OD1 ASN 43 8.649 28.321 47.936 1.00 0.00 ATOM 232 O ASN 43 8.352 25.267 47.010 1.00 0.00 ATOM 233 C ASN 43 8.221 25.348 48.225 1.00 0.00 ATOM 234 N TRP 44 7.096 25.059 48.868 1.00 0.00 ATOM 235 CA TRP 44 5.880 24.635 48.206 1.00 0.00 ATOM 236 CB TRP 44 4.907 24.027 49.210 1.00 0.00 ATOM 237 CG TRP 44 5.474 22.760 49.717 1.00 0.00 ATOM 238 CD1 TRP 44 6.176 22.579 50.885 1.00 0.00 ATOM 239 CD2 TRP 44 5.496 21.504 49.041 1.00 0.00 ATOM 240 CE2 TRP 44 6.209 20.602 49.857 1.00 0.00 ATOM 241 CE3 TRP 44 4.978 21.048 47.830 1.00 0.00 ATOM 242 NE1 TRP 44 6.605 21.284 50.976 1.00 0.00 ATOM 243 CZ2 TRP 44 6.390 19.257 49.508 1.00 0.00 ATOM 244 CZ3 TRP 44 5.173 19.733 47.486 1.00 0.00 ATOM 245 CH2 TRP 44 5.869 18.847 48.321 1.00 0.00 ATOM 246 O TRP 44 4.568 25.345 46.345 1.00 0.00 ATOM 247 C TRP 44 5.221 25.692 47.333 1.00 0.00 ATOM 248 N ASP 45 5.399 26.962 47.676 1.00 0.00 ATOM 249 CA ASP 45 4.869 28.030 46.841 1.00 0.00 ATOM 250 CB ASP 45 5.101 29.424 47.454 1.00 0.00 ATOM 251 CG ASP 45 4.208 29.696 48.658 1.00 0.00 ATOM 252 OD1 ASP 45 3.432 28.790 49.055 1.00 0.00 ATOM 253 OD2 ASP 45 4.276 30.826 49.205 1.00 0.00 ATOM 254 O ASP 45 4.937 28.164 44.432 1.00 0.00 ATOM 255 C ASP 45 5.566 27.984 45.475 1.00 0.00 ATOM 256 N ASP 46 6.876 27.777 45.489 1.00 0.00 ATOM 257 CA ASP 46 7.616 27.691 44.257 1.00 0.00 ATOM 258 CB ASP 46 9.127 27.654 44.502 1.00 0.00 ATOM 259 CG ASP 46 9.692 28.998 44.946 1.00 0.00 ATOM 260 OD1 ASP 46 9.049 30.045 44.696 1.00 0.00 ATOM 261 OD2 ASP 46 10.785 29.003 45.560 1.00 0.00 ATOM 262 O ASP 46 7.139 26.488 42.263 1.00 0.00 ATOM 263 C ASP 46 7.252 26.440 43.478 1.00 0.00 ATOM 264 N ALA 47 7.084 25.323 44.173 1.00 0.00 ATOM 265 CA ALA 47 6.726 24.075 43.511 1.00 0.00 ATOM 266 CB ALA 47 6.682 22.964 44.485 1.00 0.00 ATOM 267 O ALA 47 5.201 23.724 41.721 1.00 0.00 ATOM 268 C ALA 47 5.385 24.227 42.812 1.00 0.00 ATOM 269 N VAL 48 4.458 24.923 43.455 1.00 0.00 ATOM 270 CA VAL 48 3.145 25.222 42.887 1.00 0.00 ATOM 271 CB VAL 48 2.255 25.952 43.935 1.00 0.00 ATOM 272 CG1 VAL 48 1.050 26.616 43.288 1.00 0.00 ATOM 273 CG2 VAL 48 1.841 25.007 45.046 1.00 0.00 ATOM 274 O VAL 48 2.658 25.804 40.599 1.00 0.00 ATOM 275 C VAL 48 3.305 26.083 41.617 1.00 0.00 ATOM 276 N GLN 49 4.167 27.099 41.665 1.00 0.00 ATOM 277 CA GLN 49 4.402 27.901 40.467 1.00 0.00 ATOM 278 CB GLN 49 5.280 29.106 40.759 1.00 0.00 ATOM 279 CG GLN 49 5.179 30.153 39.645 1.00 0.00 ATOM 280 CD GLN 49 6.137 31.281 39.793 1.00 0.00 ATOM 281 OE1 GLN 49 7.337 31.074 40.007 1.00 0.00 ATOM 282 NE2 GLN 49 5.630 32.501 39.645 1.00 0.00 ATOM 283 O GLN 49 4.675 27.162 38.192 1.00 0.00 ATOM 284 C GLN 49 5.055 27.053 39.349 1.00 0.00 ATOM 285 N ILE 50 6.037 26.207 39.675 1.00 0.00 ATOM 286 CA ILE 50 6.672 25.385 38.628 1.00 0.00 ATOM 287 CB ILE 50 7.935 24.680 39.134 1.00 0.00 ATOM 288 CG1 ILE 50 8.973 25.713 39.529 1.00 0.00 ATOM 289 CG2 ILE 50 8.509 23.789 38.037 1.00 0.00 ATOM 290 CD1 ILE 50 10.188 25.144 40.267 1.00 0.00 ATOM 291 O ILE 50 5.689 23.981 36.865 1.00 0.00 ATOM 292 C ILE 50 5.657 24.363 38.036 1.00 0.00 ATOM 293 N ARG 51 4.736 23.915 38.851 1.00 0.00 ATOM 294 CA ARG 51 3.678 23.074 38.351 1.00 0.00 ATOM 295 CB ARG 51 2.969 22.394 39.528 1.00 0.00 ATOM 296 CG ARG 51 1.508 22.139 39.432 1.00 0.00 ATOM 297 CD ARG 51 1.098 21.006 38.718 1.00 0.00 ATOM 298 NE ARG 51 -0.347 20.881 38.922 1.00 0.00 ATOM 299 CZ ARG 51 -1.112 19.978 38.311 1.00 0.00 ATOM 300 NH1 ARG 51 -0.584 19.140 37.435 1.00 0.00 ATOM 301 NH2 ARG 51 -2.413 19.921 38.574 1.00 0.00 ATOM 302 O ARG 51 2.288 23.196 36.410 1.00 0.00 ATOM 303 C ARG 51 2.763 23.820 37.378 1.00 0.00 ATOM 304 N LYS 52 2.566 25.135 37.564 1.00 0.00 ATOM 305 CA LYS 52 1.801 25.905 36.591 1.00 0.00 ATOM 306 CB LYS 52 1.440 27.294 37.128 1.00 0.00 ATOM 307 CG LYS 52 0.495 27.240 38.318 1.00 0.00 ATOM 308 CD LYS 52 0.088 28.610 38.867 1.00 0.00 ATOM 309 CE LYS 52 -0.832 28.390 40.096 1.00 0.00 ATOM 310 O LYS 52 2.011 26.101 34.199 1.00 0.00 ATOM 311 C LYS 52 2.585 26.011 35.269 1.00 0.00 ATOM 312 N GLN 53 3.901 26.080 35.361 1.00 0.00 ATOM 313 CA GLN 53 4.742 26.129 34.188 1.00 0.00 ATOM 314 CB GLN 53 6.190 26.419 34.621 1.00 0.00 ATOM 315 CG GLN 53 6.377 27.788 35.272 1.00 0.00 ATOM 316 CD GLN 53 7.788 28.027 35.854 1.00 0.00 ATOM 317 OE1 GLN 53 8.620 27.136 35.845 1.00 0.00 ATOM 318 NE2 GLN 53 8.047 29.253 36.346 1.00 0.00 ATOM 319 O GLN 53 4.452 24.669 32.272 1.00 0.00 ATOM 320 C GLN 53 4.606 24.757 33.465 1.00 0.00 ATOM 321 N ILE 54 4.655 23.673 34.212 1.00 0.00 ATOM 322 CA ILE 54 4.479 22.339 33.620 1.00 0.00 ATOM 323 CB ILE 54 4.665 21.187 34.688 1.00 0.00 ATOM 324 CG1 ILE 54 6.121 21.086 35.161 1.00 0.00 ATOM 325 CG2 ILE 54 4.262 19.802 34.156 1.00 0.00 ATOM 326 CD1 ILE 54 6.290 20.201 36.363 1.00 0.00 ATOM 327 O ILE 54 3.024 21.770 31.778 1.00 0.00 ATOM 328 C ILE 54 3.105 22.254 32.922 1.00 0.00 ATOM 329 N SER 55 2.052 22.759 33.562 1.00 0.00 ATOM 330 CA SER 55 0.711 22.738 32.962 1.00 0.00 ATOM 331 CB SER 55 -0.379 23.196 33.928 1.00 0.00 ATOM 332 OG SER 55 -0.553 22.261 34.965 1.00 0.00 ATOM 333 O SER 55 -0.109 23.219 30.812 1.00 0.00 ATOM 334 C SER 55 0.619 23.596 31.731 1.00 0.00 ATOM 335 N LEU 56 1.282 24.767 31.741 1.00 0.00 ATOM 336 CA LEU 56 1.282 25.613 30.594 1.00 0.00 ATOM 337 CB LEU 56 2.090 26.860 30.870 1.00 0.00 ATOM 338 CG LEU 56 2.244 27.788 29.690 1.00 0.00 ATOM 339 CD1 LEU 56 0.879 28.204 29.157 1.00 0.00 ATOM 340 CD2 LEU 56 3.100 28.989 30.069 1.00 0.00 ATOM 341 O LEU 56 1.392 24.917 28.354 1.00 0.00 ATOM 342 C LEU 56 1.927 24.906 29.426 1.00 0.00 ATOM 343 N ALA 57 3.101 24.311 29.630 1.00 0.00 ATOM 344 CA ALA 57 3.819 23.647 28.534 1.00 0.00 ATOM 345 CB ALA 57 5.195 23.162 28.983 1.00 0.00 ATOM 346 O ALA 57 3.081 22.180 26.800 1.00 0.00 ATOM 347 C ALA 57 3.018 22.476 27.970 1.00 0.00 ATOM 348 N GLU 58 2.259 21.815 28.826 1.00 0.00 ATOM 349 CA GLU 58 1.380 20.741 28.419 1.00 0.00 ATOM 350 CB GLU 58 0.882 19.988 29.667 1.00 0.00 ATOM 351 CG GLU 58 0.123 18.662 29.409 1.00 0.00 ATOM 352 CD GLU 58 -1.317 18.809 28.912 1.00 0.00 ATOM 353 OE1 GLU 58 -2.006 19.842 29.181 1.00 0.00 ATOM 354 OE2 GLU 58 -1.788 17.843 28.243 1.00 0.00 ATOM 355 O GLU 58 -0.135 20.681 26.575 1.00 0.00 ATOM 356 C GLU 58 0.221 21.280 27.580 1.00 0.00 ATOM 357 N LYS 59 -0.345 22.414 27.977 1.00 0.00 ATOM 358 CA LYS 59 -1.440 23.037 27.279 1.00 0.00 ATOM 359 CB LYS 59 -1.943 24.248 28.099 1.00 0.00 ATOM 360 CG LYS 59 -3.121 25.067 27.526 1.00 0.00 ATOM 361 CD LYS 59 -3.210 26.513 28.194 1.00 0.00 ATOM 362 O LYS 59 -1.630 23.224 24.894 1.00 0.00 ATOM 363 C LYS 59 -0.937 23.454 25.886 1.00 0.00 ATOM 364 N GLN 60 0.252 24.063 25.828 1.00 0.00 ATOM 365 CA GLN 60 0.868 24.508 24.581 1.00 0.00 ATOM 366 CB GLN 60 2.199 25.222 24.861 1.00 0.00 ATOM 367 CG GLN 60 2.062 26.566 25.588 1.00 0.00 ATOM 368 CD GLN 60 3.375 27.250 26.021 1.00 0.00 ATOM 369 OE1 GLN 60 4.376 26.592 26.280 1.00 0.00 ATOM 370 NE2 GLN 60 3.341 28.597 26.171 1.00 0.00 ATOM 371 O GLN 60 0.781 23.331 22.504 1.00 0.00 ATOM 372 C GLN 60 1.104 23.303 23.665 1.00 0.00 ATOM 373 N GLY 61 1.654 22.228 24.215 1.00 0.00 ATOM 374 CA GLY 61 1.867 20.984 23.475 1.00 0.00 ATOM 375 O GLY 61 0.480 20.091 21.726 1.00 0.00 ATOM 376 C GLY 61 0.550 20.458 22.889 1.00 0.00 ATOM 377 N ASP 62 -0.498 20.491 23.682 1.00 0.00 ATOM 378 CA ASP 62 -1.806 20.126 23.218 1.00 0.00 ATOM 379 CB ASP 62 -2.818 20.359 24.302 1.00 0.00 ATOM 380 CG ASP 62 -3.396 19.130 24.798 1.00 0.00 ATOM 381 OD1 ASP 62 -4.277 18.598 24.063 1.00 0.00 ATOM 382 OD2 ASP 62 -3.023 18.745 25.932 1.00 0.00 ATOM 383 O ASP 62 -2.896 20.370 21.121 1.00 0.00 ATOM 384 C ASP 62 -2.293 20.931 22.040 1.00 0.00 ATOM 385 N SER 63 -2.086 22.253 22.076 1.00 0.00 ATOM 386 CA SER 63 -2.524 23.073 20.998 1.00 0.00 ATOM 387 CB SER 63 -2.409 24.556 21.371 1.00 0.00 ATOM 388 OG SER 63 -3.185 24.729 22.534 1.00 0.00 ATOM 389 O SER 63 -2.339 22.768 18.670 1.00 0.00 ATOM 390 C SER 63 -1.764 22.757 19.728 1.00 0.00 ATOM 391 N LEU 64 -0.465 22.504 19.828 1.00 0.00 ATOM 392 CA LEU 64 0.310 22.084 18.648 1.00 0.00 ATOM 393 CB LEU 64 1.794 21.901 18.976 1.00 0.00 ATOM 394 CG LEU 64 2.583 23.118 19.450 1.00 0.00 ATOM 395 CD1 LEU 64 3.996 22.735 19.886 1.00 0.00 ATOM 396 CD2 LEU 64 2.633 24.177 18.380 1.00 0.00 ATOM 397 O LEU 64 -0.282 20.528 16.946 1.00 0.00 ATOM 398 C LEU 64 -0.202 20.751 18.132 1.00 0.00 ATOM 399 N LYS 65 -0.511 19.853 19.049 1.00 0.00 ATOM 400 CA LYS 65 -1.044 18.510 18.710 1.00 0.00 ATOM 401 CB LYS 65 -1.278 17.724 20.006 1.00 0.00 ATOM 402 CG LYS 65 -1.871 16.322 19.860 1.00 0.00 ATOM 403 CD LYS 65 -2.360 15.848 21.261 1.00 0.00 ATOM 404 CE LYS 65 -2.883 14.420 21.260 1.00 0.00 ATOM 405 NZ LYS 65 -3.502 14.059 22.597 1.00 0.00 ATOM 406 O LYS 65 -2.536 18.072 16.849 1.00 0.00 ATOM 407 C LYS 65 -2.348 18.656 17.915 1.00 0.00 ATOM 408 N ARG 66 -3.234 19.485 18.413 1.00 0.00 ATOM 409 CA ARG 66 -4.494 19.730 17.762 1.00 0.00 ATOM 410 CB ARG 66 -5.277 20.751 18.581 1.00 0.00 ATOM 411 CG ARG 66 -6.638 21.030 18.029 1.00 0.00 ATOM 412 CD ARG 66 -7.255 22.264 18.648 1.00 0.00 ATOM 413 NE ARG 66 -8.506 22.527 17.956 1.00 0.00 ATOM 414 CZ ARG 66 -9.700 22.055 18.293 1.00 0.00 ATOM 415 NH1 ARG 66 -9.863 21.285 19.364 1.00 0.00 ATOM 416 NH2 ARG 66 -10.746 22.374 17.548 1.00 0.00 ATOM 417 O ARG 66 -4.959 19.747 15.397 1.00 0.00 ATOM 418 C ARG 66 -4.317 20.242 16.325 1.00 0.00 ATOM 419 N GLU 67 -3.470 21.256 16.142 1.00 0.00 ATOM 420 CA GLU 67 -3.296 21.859 14.814 1.00 0.00 ATOM 421 CB GLU 67 -2.378 23.095 14.883 1.00 0.00 ATOM 422 O GLU 67 -3.203 20.705 12.716 1.00 0.00 ATOM 423 C GLU 67 -2.750 20.806 13.843 1.00 0.00 ATOM 424 N ILE 68 -1.785 20.020 14.295 1.00 0.00 ATOM 425 CA ILE 68 -1.249 18.922 13.474 1.00 0.00 ATOM 426 CB ILE 68 -0.107 18.150 14.167 1.00 0.00 ATOM 427 CG1 ILE 68 1.123 19.057 14.262 1.00 0.00 ATOM 428 CG2 ILE 68 0.221 16.879 13.345 1.00 0.00 ATOM 429 CD1 ILE 68 2.260 18.579 15.216 1.00 0.00 ATOM 430 O ILE 68 -2.498 17.597 11.904 1.00 0.00 ATOM 431 C ILE 68 -2.338 17.935 13.097 1.00 0.00 ATOM 432 N ARG 69 -3.132 17.513 14.066 1.00 0.00 ATOM 433 CA ARG 69 -4.207 16.557 13.764 1.00 0.00 ATOM 434 CB ARG 69 -4.923 16.115 15.008 1.00 0.00 ATOM 435 CG ARG 69 -4.028 15.322 15.896 1.00 0.00 ATOM 436 CD ARG 69 -4.520 15.367 17.332 1.00 0.00 ATOM 437 NE ARG 69 -5.710 14.548 17.533 1.00 0.00 ATOM 438 CZ ARG 69 -6.374 14.478 18.688 1.00 0.00 ATOM 439 NH1 ARG 69 -6.054 15.249 19.722 1.00 0.00 ATOM 440 NH2 ARG 69 -7.405 13.663 18.795 1.00 0.00 ATOM 441 O ARG 69 -5.823 16.291 12.073 1.00 0.00 ATOM 442 C ARG 69 -5.227 17.069 12.784 1.00 0.00 ATOM 443 N LEU 70 -5.453 18.367 12.759 1.00 0.00 ATOM 444 CA LEU 70 -6.413 18.909 11.866 1.00 0.00 ATOM 445 CB LEU 70 -7.176 20.060 12.541 1.00 0.00 ATOM 446 CG LEU 70 -7.999 19.741 13.792 1.00 0.00 ATOM 447 CD1 LEU 70 -8.662 21.015 14.301 1.00 0.00 ATOM 448 CD2 LEU 70 -9.050 18.639 13.473 1.00 0.00 ATOM 449 O LEU 70 -6.538 19.868 9.717 1.00 0.00 ATOM 450 C LEU 70 -5.805 19.399 10.544 1.00 0.00 ATOM 451 N THR 71 -4.492 19.286 10.336 1.00 0.00 ATOM 452 CA THR 71 -3.847 19.794 9.109 1.00 0.00 ATOM 453 CB THR 71 -3.007 21.084 9.423 1.00 0.00 ATOM 454 CG2 THR 71 -3.886 22.217 9.980 1.00 0.00 ATOM 455 OG1 THR 71 -1.993 20.781 10.394 1.00 0.00 ATOM 456 O THR 71 -2.804 17.619 8.707 1.00 0.00 ATOM 457 C THR 71 -2.916 18.819 8.381 1.00 0.00 ATOM 458 N GLY 75 -0.935 15.567 4.201 1.00 0.00 ATOM 459 CA GLY 75 -1.561 16.595 3.374 1.00 0.00 ATOM 460 O GLY 75 -3.052 15.865 1.663 1.00 0.00 ATOM 461 C GLY 75 -1.888 16.104 1.975 1.00 0.00 ATOM 462 N LEU 76 -0.867 15.985 1.122 1.00 0.00 ATOM 463 CA LEU 76 -1.035 15.484 -0.254 1.00 0.00 ATOM 464 CB LEU 76 -1.225 16.626 -1.259 1.00 0.00 ATOM 465 O LEU 76 0.286 13.488 -0.121 1.00 0.00 ATOM 466 C LEU 76 0.180 14.628 -0.603 1.00 0.00 ATOM 467 N PHE 77 1.086 15.141 -1.436 1.00 0.00 ATOM 468 CA PHE 77 2.316 14.406 -1.730 1.00 0.00 ATOM 469 CB PHE 77 3.100 15.051 -2.863 1.00 0.00 ATOM 470 CG PHE 77 2.444 14.931 -4.205 1.00 0.00 ATOM 471 CD1 PHE 77 2.251 13.688 -4.792 1.00 0.00 ATOM 472 CD2 PHE 77 2.076 16.062 -4.917 1.00 0.00 ATOM 473 CE1 PHE 77 1.667 13.566 -6.045 1.00 0.00 ATOM 474 CE2 PHE 77 1.499 15.948 -6.176 1.00 0.00 ATOM 475 CZ PHE 77 1.296 14.691 -6.738 1.00 0.00 ATOM 476 O PHE 77 3.533 15.412 0.104 1.00 0.00 ATOM 477 C PHE 77 3.145 14.368 -0.429 1.00 0.00 ATOM 478 N MET 78 3.426 13.157 0.054 1.00 0.00 ATOM 479 CA MET 78 4.056 12.947 1.364 1.00 0.00 ATOM 480 CB MET 78 2.987 12.334 2.269 1.00 0.00 ATOM 481 CG MET 78 1.919 13.268 2.712 1.00 0.00 ATOM 482 SD MET 78 2.642 14.258 4.158 1.00 0.00 ATOM 483 CE MET 78 2.602 12.946 5.535 1.00 0.00 ATOM 484 O MET 78 5.129 10.842 0.981 1.00 0.00 ATOM 485 C MET 78 5.256 11.992 1.398 1.00 0.00 ATOM 486 N PRO 79 6.407 12.443 1.946 1.00 0.00 ATOM 487 CA PRO 79 7.598 11.597 2.122 1.00 0.00 ATOM 488 CB PRO 79 8.684 12.619 2.427 1.00 0.00 ATOM 489 CG PRO 79 7.982 13.677 3.129 1.00 0.00 ATOM 490 CD PRO 79 6.660 13.812 2.435 1.00 0.00 ATOM 491 O PRO 79 8.432 9.771 3.419 1.00 0.00 ATOM 492 C PRO 79 7.535 10.588 3.288 1.00 0.00 ATOM 493 N VAL 80 6.515 10.702 4.140 1.00 0.00 ATOM 494 CA VAL 80 6.235 9.840 5.316 1.00 0.00 ATOM 495 CB VAL 80 6.694 10.551 6.634 1.00 0.00 ATOM 496 CG1 VAL 80 8.191 10.780 6.634 1.00 0.00 ATOM 497 CG2 VAL 80 5.981 11.881 6.827 1.00 0.00 ATOM 498 O VAL 80 3.935 10.307 4.841 1.00 0.00 ATOM 499 C VAL 80 4.710 9.569 5.402 1.00 0.00 ATOM 500 N GLU 81 4.279 8.521 6.086 1.00 0.00 ATOM 501 CA GLU 81 2.847 8.240 6.248 1.00 0.00 ATOM 502 CB GLU 81 2.606 6.802 6.703 1.00 0.00 ATOM 503 CG GLU 81 2.825 5.796 5.655 1.00 0.00 ATOM 504 CD GLU 81 1.638 5.693 4.754 1.00 0.00 ATOM 505 OE1 GLU 81 0.494 5.697 5.277 1.00 0.00 ATOM 506 OE2 GLU 81 1.849 5.596 3.531 1.00 0.00 ATOM 507 O GLU 81 2.740 9.348 8.371 1.00 0.00 ATOM 508 C GLU 81 2.202 9.137 7.282 1.00 0.00 ATOM 509 N ARG 82 1.024 9.631 6.925 1.00 0.00 ATOM 510 CA ARG 82 0.200 10.433 7.794 1.00 0.00 ATOM 511 CB ARG 82 -1.177 10.715 7.116 1.00 0.00 ATOM 512 CG ARG 82 -1.252 11.888 6.145 1.00 0.00 ATOM 513 CD ARG 82 -2.702 12.147 5.550 1.00 0.00 ATOM 514 NE ARG 82 -3.029 11.340 4.381 1.00 0.00 ATOM 515 O ARG 82 0.001 10.234 10.146 1.00 0.00 ATOM 516 C ARG 82 -0.051 9.669 9.081 1.00 0.00 ATOM 517 N THR 83 -0.374 8.397 8.981 1.00 0.00 ATOM 518 CA THR 83 -0.683 7.639 10.189 1.00 0.00 ATOM 519 CB THR 83 -1.337 6.344 9.867 1.00 0.00 ATOM 520 CG2 THR 83 -2.728 6.588 9.207 1.00 0.00 ATOM 521 OG1 THR 83 -0.491 5.608 8.983 1.00 0.00 ATOM 522 O THR 83 0.369 7.534 12.267 1.00 0.00 ATOM 523 C THR 83 0.528 7.467 11.091 1.00 0.00 ATOM 524 N ASP 84 1.727 7.327 10.540 1.00 0.00 ATOM 525 CA ASP 84 2.924 7.274 11.359 1.00 0.00 ATOM 526 CB ASP 84 4.172 6.976 10.511 1.00 0.00 ATOM 527 CG ASP 84 4.235 5.536 10.084 1.00 0.00 ATOM 528 OD1 ASP 84 3.619 4.717 10.788 1.00 0.00 ATOM 529 OD2 ASP 84 4.822 5.202 9.029 1.00 0.00 ATOM 530 O ASP 84 3.398 8.538 13.312 1.00 0.00 ATOM 531 C ASP 84 3.091 8.570 12.122 1.00 0.00 ATOM 532 N LEU 85 2.834 9.706 11.477 1.00 0.00 ATOM 533 CA LEU 85 3.012 10.990 12.172 1.00 0.00 ATOM 534 CB LEU 85 2.914 12.211 11.242 1.00 0.00 ATOM 535 CG LEU 85 3.961 12.198 10.110 1.00 0.00 ATOM 536 CD1 LEU 85 3.609 13.207 9.008 1.00 0.00 ATOM 537 CD2 LEU 85 5.359 12.413 10.628 1.00 0.00 ATOM 538 O LEU 85 2.395 11.613 14.324 1.00 0.00 ATOM 539 C LEU 85 2.043 11.120 13.283 1.00 0.00 ATOM 540 N LEU 86 0.814 10.666 13.070 1.00 0.00 ATOM 541 CA LEU 86 -0.193 10.718 14.136 1.00 0.00 ATOM 542 CB LEU 86 -1.587 10.336 13.597 1.00 0.00 ATOM 543 CG LEU 86 -2.239 11.357 12.667 1.00 0.00 ATOM 544 CD1 LEU 86 -3.568 10.820 12.163 1.00 0.00 ATOM 545 CD2 LEU 86 -2.429 12.694 13.384 1.00 0.00 ATOM 546 O LEU 86 0.108 10.228 16.470 1.00 0.00 ATOM 547 C LEU 86 0.183 9.811 15.318 1.00 0.00 ATOM 548 N GLU 87 0.617 8.594 15.022 1.00 0.00 ATOM 549 CA GLU 87 1.043 7.684 16.089 1.00 0.00 ATOM 550 CB GLU 87 1.290 6.302 15.519 1.00 0.00 ATOM 551 CG GLU 87 -0.005 5.762 14.943 1.00 0.00 ATOM 552 CD GLU 87 -0.075 4.262 14.862 1.00 0.00 ATOM 553 OE1 GLU 87 -0.290 3.682 15.933 1.00 0.00 ATOM 554 OE2 GLU 87 0.001 3.681 13.735 1.00 0.00 ATOM 555 O GLU 87 2.348 8.138 18.050 1.00 0.00 ATOM 556 C GLU 87 2.278 8.237 16.839 1.00 0.00 ATOM 557 N LEU 88 3.201 8.864 16.117 1.00 0.00 ATOM 558 CA LEU 88 4.353 9.472 16.730 1.00 0.00 ATOM 559 CB LEU 88 5.275 10.025 15.627 1.00 0.00 ATOM 560 CG LEU 88 6.539 10.746 16.083 1.00 0.00 ATOM 561 CD1 LEU 88 7.410 9.783 16.870 1.00 0.00 ATOM 562 CD2 LEU 88 7.306 11.310 14.868 1.00 0.00 ATOM 563 O LEU 88 4.271 10.589 18.848 1.00 0.00 ATOM 564 C LEU 88 3.886 10.561 17.685 1.00 0.00 ATOM 565 N LEU 89 3.013 11.428 17.201 1.00 0.00 ATOM 566 CA LEU 89 2.461 12.524 18.009 1.00 0.00 ATOM 567 CB LEU 89 1.412 13.277 17.157 1.00 0.00 ATOM 568 CG LEU 89 0.801 14.555 17.695 1.00 0.00 ATOM 569 CD1 LEU 89 1.857 15.577 17.936 1.00 0.00 ATOM 570 CD2 LEU 89 -0.226 15.063 16.668 1.00 0.00 ATOM 571 O LEU 89 1.893 12.643 20.324 1.00 0.00 ATOM 572 C LEU 89 1.793 12.040 19.270 1.00 0.00 ATOM 573 N THR 90 1.057 10.945 19.150 1.00 0.00 ATOM 574 CA THR 90 0.377 10.361 20.298 1.00 0.00 ATOM 575 CB THR 90 -0.426 9.151 19.859 1.00 0.00 ATOM 576 CG2 THR 90 -1.086 8.447 21.014 1.00 0.00 ATOM 577 OG1 THR 90 -1.420 9.612 18.990 1.00 0.00 ATOM 578 O THR 90 1.140 10.220 22.536 1.00 0.00 ATOM 579 C THR 90 1.368 9.953 21.361 1.00 0.00 ATOM 580 N GLN 91 2.458 9.294 20.967 1.00 0.00 ATOM 581 CA GLN 91 3.469 8.884 21.939 1.00 0.00 ATOM 582 CB GLN 91 4.511 7.970 21.278 1.00 0.00 ATOM 583 CG GLN 91 3.950 6.621 20.852 1.00 0.00 ATOM 584 CD GLN 91 3.213 5.904 22.015 1.00 0.00 ATOM 585 OE1 GLN 91 3.695 5.889 23.163 1.00 0.00 ATOM 586 NE2 GLN 91 2.015 5.384 21.728 1.00 0.00 ATOM 587 O GLN 91 4.382 10.062 23.796 1.00 0.00 ATOM 588 C GLN 91 4.144 10.068 22.592 1.00 0.00 ATOM 589 N GLN 92 4.473 11.078 21.797 1.00 0.00 ATOM 590 CA GLN 92 5.076 12.290 22.319 1.00 0.00 ATOM 591 CB GLN 92 5.370 13.236 21.140 1.00 0.00 ATOM 592 CG GLN 92 6.513 12.705 20.215 1.00 0.00 ATOM 593 CD GLN 92 6.910 13.617 19.060 1.00 0.00 ATOM 594 OE1 GLN 92 6.367 14.719 18.868 1.00 0.00 ATOM 595 NE2 GLN 92 7.889 13.164 18.292 1.00 0.00 ATOM 596 O GLN 92 4.732 13.409 24.415 1.00 0.00 ATOM 597 C GLN 92 4.219 12.984 23.360 1.00 0.00 ATOM 598 N ASP 93 2.922 13.133 23.111 1.00 0.00 ATOM 599 CA ASP 93 2.107 13.933 24.035 1.00 0.00 ATOM 600 CB ASP 93 0.794 14.367 23.360 1.00 0.00 ATOM 601 CG ASP 93 0.251 15.715 23.873 1.00 0.00 ATOM 602 OD1 ASP 93 0.742 16.832 23.492 1.00 0.00 ATOM 603 OD2 ASP 93 -0.764 15.648 24.594 1.00 0.00 ATOM 604 O ASP 93 1.753 13.763 26.408 1.00 0.00 ATOM 605 C ASP 93 1.930 13.154 25.365 1.00 0.00 ATOM 606 N LYS 94 1.995 11.818 25.347 1.00 0.00 ATOM 607 CA LYS 94 1.975 11.059 26.615 1.00 0.00 ATOM 608 CB LYS 94 2.122 9.566 26.358 1.00 0.00 ATOM 609 CG LYS 94 0.870 8.895 25.754 1.00 0.00 ATOM 610 CD LYS 94 1.145 7.425 25.498 1.00 0.00 ATOM 611 CE LYS 94 -0.093 6.686 24.872 1.00 0.00 ATOM 612 O LYS 94 2.820 11.479 28.809 1.00 0.00 ATOM 613 C LYS 94 3.064 11.492 27.604 1.00 0.00 ATOM 614 N ILE 95 4.232 11.888 27.102 1.00 0.00 ATOM 615 CA ILE 95 5.332 12.305 27.957 1.00 0.00 ATOM 616 CB ILE 95 6.641 12.489 27.147 1.00 0.00 ATOM 617 CG1 ILE 95 7.133 11.149 26.561 1.00 0.00 ATOM 618 CG2 ILE 95 7.736 13.113 28.000 1.00 0.00 ATOM 619 CD1 ILE 95 8.176 11.327 25.463 1.00 0.00 ATOM 620 O ILE 95 5.115 13.640 29.968 1.00 0.00 ATOM 621 C ILE 95 4.943 13.562 28.735 1.00 0.00 ATOM 622 N ALA 96 4.415 14.547 28.037 1.00 0.00 ATOM 623 CA ALA 96 3.948 15.763 28.703 1.00 0.00 ATOM 624 CB ALA 96 3.509 16.750 27.687 1.00 0.00 ATOM 625 O ALA 96 2.828 15.979 30.805 1.00 0.00 ATOM 626 C ALA 96 2.816 15.464 29.705 1.00 0.00 ATOM 627 N ASN 97 1.835 14.660 29.326 1.00 0.00 ATOM 628 CA ASN 97 0.778 14.301 30.252 1.00 0.00 ATOM 629 CB ASN 97 -0.213 13.305 29.594 1.00 0.00 ATOM 630 CG ASN 97 -1.055 13.928 28.492 1.00 0.00 ATOM 631 ND2 ASN 97 -1.690 13.086 27.627 1.00 0.00 ATOM 632 OD1 ASN 97 -1.123 15.136 28.394 1.00 0.00 ATOM 633 O ASN 97 0.818 13.778 32.627 1.00 0.00 ATOM 634 C ASN 97 1.324 13.604 31.532 1.00 0.00 ATOM 635 N LYS 98 2.331 12.765 31.363 1.00 0.00 ATOM 636 CA LYS 98 2.967 12.093 32.490 1.00 0.00 ATOM 637 CB LYS 98 4.031 11.104 31.948 1.00 0.00 ATOM 638 CG LYS 98 4.846 10.265 32.959 1.00 0.00 ATOM 639 CD LYS 98 3.986 9.398 33.839 1.00 0.00 ATOM 640 CE LYS 98 3.468 8.161 33.153 1.00 0.00 ATOM 641 NZ LYS 98 2.618 7.366 34.124 1.00 0.00 ATOM 642 O LYS 98 3.436 13.093 34.624 1.00 0.00 ATOM 643 C LYS 98 3.609 13.152 33.427 1.00 0.00 ATOM 644 N ALA 99 4.340 14.114 32.877 1.00 0.00 ATOM 645 CA ALA 99 4.949 15.113 33.696 1.00 0.00 ATOM 646 CB ALA 99 5.820 16.035 32.853 1.00 0.00 ATOM 647 O ALA 99 4.054 16.142 35.676 1.00 0.00 ATOM 648 C ALA 99 3.893 15.899 34.476 1.00 0.00 ATOM 649 N LYS 100 2.827 16.318 33.810 1.00 0.00 ATOM 650 CA LYS 100 1.749 17.065 34.474 1.00 0.00 ATOM 651 CB LYS 100 0.711 17.447 33.446 1.00 0.00 ATOM 652 CG LYS 100 -0.365 18.329 34.015 1.00 0.00 ATOM 653 CD LYS 100 -1.441 18.572 33.006 1.00 0.00 ATOM 654 CE LYS 100 -2.478 19.518 33.613 1.00 0.00 ATOM 655 NZ LYS 100 -3.674 19.636 32.721 1.00 0.00 ATOM 656 O LYS 100 0.827 16.710 36.694 1.00 0.00 ATOM 657 C LYS 100 1.084 16.225 35.586 1.00 0.00 ATOM 658 N ASP 101 0.821 14.957 35.292 1.00 0.00 ATOM 659 CA ASP 101 0.248 14.063 36.274 1.00 0.00 ATOM 660 CB ASP 101 -0.017 12.658 35.652 1.00 0.00 ATOM 661 CG ASP 101 -1.271 12.632 34.756 1.00 0.00 ATOM 662 OD1 ASP 101 -2.010 13.644 34.680 1.00 0.00 ATOM 663 OD2 ASP 101 -1.518 11.590 34.118 1.00 0.00 ATOM 664 O ASP 101 0.651 13.914 38.642 1.00 0.00 ATOM 665 C ASP 101 1.133 13.878 37.522 1.00 0.00 ATOM 666 N ILE 102 2.406 13.593 37.313 1.00 0.00 ATOM 667 CA ILE 102 3.327 13.417 38.408 1.00 0.00 ATOM 668 CB ILE 102 4.752 13.183 37.893 1.00 0.00 ATOM 669 CG1 ILE 102 4.827 11.840 37.165 1.00 0.00 ATOM 670 CG2 ILE 102 5.768 13.270 39.077 1.00 0.00 ATOM 671 CD1 ILE 102 6.154 11.507 36.561 1.00 0.00 ATOM 672 O ILE 102 3.248 14.598 40.510 1.00 0.00 ATOM 673 C ILE 102 3.360 14.678 39.293 1.00 0.00 ATOM 674 N SER 103 3.534 15.836 38.675 1.00 0.00 ATOM 675 CA SER 103 3.611 17.065 39.446 1.00 0.00 ATOM 676 CB SER 103 3.948 18.277 38.544 1.00 0.00 ATOM 677 OG SER 103 3.069 18.347 37.430 1.00 0.00 ATOM 678 O SER 103 2.435 17.796 41.392 1.00 0.00 ATOM 679 C SER 103 2.347 17.338 40.248 1.00 0.00 ATOM 680 N GLY 104 1.185 17.049 39.661 1.00 0.00 ATOM 681 CA GLY 104 -0.102 17.225 40.343 1.00 0.00 ATOM 682 O GLY 104 -0.645 16.763 42.583 1.00 0.00 ATOM 683 C GLY 104 -0.232 16.318 41.535 1.00 0.00 ATOM 684 N ARG 105 0.122 15.033 41.386 1.00 0.00 ATOM 685 CA ARG 105 0.005 14.089 42.498 1.00 0.00 ATOM 686 CB ARG 105 0.200 12.644 41.971 1.00 0.00 ATOM 687 CG ARG 105 -1.095 12.116 41.160 1.00 0.00 ATOM 688 CD ARG 105 -2.178 11.513 42.123 1.00 0.00 ATOM 689 NE ARG 105 -2.321 10.025 42.057 1.00 0.00 ATOM 690 CZ ARG 105 -2.674 9.270 43.087 1.00 0.00 ATOM 691 NH1 ARG 105 -2.867 9.844 44.269 1.00 0.00 ATOM 692 NH2 ARG 105 -2.818 7.916 42.967 1.00 0.00 ATOM 693 O ARG 105 0.587 14.410 44.849 1.00 0.00 ATOM 694 C ARG 105 0.937 14.493 43.654 1.00 0.00 ATOM 695 N VAL 106 2.112 15.004 43.312 1.00 0.00 ATOM 696 CA VAL 106 3.091 15.404 44.324 1.00 0.00 ATOM 697 CB VAL 106 4.462 15.626 43.665 1.00 0.00 ATOM 698 CG1 VAL 106 5.429 16.288 44.621 1.00 0.00 ATOM 699 CG2 VAL 106 5.013 14.279 43.219 1.00 0.00 ATOM 700 O VAL 106 2.654 16.713 46.315 1.00 0.00 ATOM 701 C VAL 106 2.591 16.642 45.098 1.00 0.00 ATOM 702 N ILE 107 2.088 17.624 44.384 1.00 0.00 ATOM 703 CA ILE 107 1.481 18.780 45.052 1.00 0.00 ATOM 704 CB ILE 107 1.029 19.832 44.022 1.00 0.00 ATOM 705 CG1 ILE 107 2.247 20.491 43.416 1.00 0.00 ATOM 706 CG2 ILE 107 0.141 20.880 44.665 1.00 0.00 ATOM 707 CD1 ILE 107 3.094 21.330 44.365 1.00 0.00 ATOM 708 O ILE 107 0.117 18.816 47.020 1.00 0.00 ATOM 709 C ILE 107 0.279 18.364 45.902 1.00 0.00 ATOM 710 N GLY 108 -0.551 17.484 45.376 1.00 0.00 ATOM 711 CA GLY 108 -1.728 17.037 46.105 1.00 0.00 ATOM 712 O GLY 108 -2.249 16.422 48.347 1.00 0.00 ATOM 713 C GLY 108 -1.446 16.324 47.433 1.00 0.00 ATOM 714 N ARG 109 -0.340 15.589 47.549 1.00 0.00 ATOM 715 CA ARG 109 -0.037 14.935 48.801 1.00 0.00 ATOM 716 CB ARG 109 0.516 13.534 48.543 1.00 0.00 ATOM 717 CG ARG 109 -0.409 12.595 47.817 1.00 0.00 ATOM 718 CD ARG 109 0.108 11.161 47.870 1.00 0.00 ATOM 719 NE ARG 109 0.225 10.622 49.219 1.00 0.00 ATOM 720 CZ ARG 109 -0.753 10.039 49.885 1.00 0.00 ATOM 721 NH1 ARG 109 -1.935 9.942 49.340 1.00 0.00 ATOM 722 NH2 ARG 109 -0.551 9.590 51.115 1.00 0.00 ATOM 723 O ARG 109 1.314 15.298 50.683 1.00 0.00 ATOM 724 C ARG 109 1.016 15.686 49.573 1.00 0.00 ATOM 725 N GLN 110 1.566 16.758 48.999 1.00 0.00 ATOM 726 CA GLN 110 2.757 17.450 49.553 1.00 0.00 ATOM 727 CB GLN 110 2.454 18.336 50.759 1.00 0.00 ATOM 728 CG GLN 110 1.698 19.576 50.358 1.00 0.00 ATOM 729 CD GLN 110 1.960 20.763 51.269 1.00 0.00 ATOM 730 OE1 GLN 110 1.823 21.896 50.830 1.00 0.00 ATOM 731 NE2 GLN 110 2.371 20.514 52.529 1.00 0.00 ATOM 732 O GLN 110 4.285 16.345 50.991 1.00 0.00 ATOM 733 C GLN 110 3.815 16.419 49.883 1.00 0.00 ATOM 734 N LEU 111 4.143 15.607 48.891 1.00 0.00 ATOM 735 CA LEU 111 5.104 14.539 49.033 1.00 0.00 ATOM 736 CB LEU 111 5.211 13.777 47.702 1.00 0.00 ATOM 737 CG LEU 111 6.305 12.689 47.640 1.00 0.00 ATOM 738 CD1 LEU 111 6.040 11.662 48.714 1.00 0.00 ATOM 739 CD2 LEU 111 6.442 12.007 46.298 1.00 0.00 ATOM 740 O LEU 111 7.099 15.771 48.686 1.00 0.00 ATOM 741 C LEU 111 6.488 15.013 49.418 1.00 0.00 ATOM 742 N LEU 112 6.990 14.545 50.554 1.00 0.00 ATOM 743 CA LEU 112 8.358 14.838 50.975 1.00 0.00 ATOM 744 CB LEU 112 8.389 15.236 52.450 1.00 0.00 ATOM 745 CG LEU 112 9.691 15.882 52.973 1.00 0.00 ATOM 746 O LEU 112 9.024 12.516 51.206 1.00 0.00 ATOM 747 C LEU 112 9.237 13.590 50.672 1.00 0.00 ATOM 748 N ILE 113 10.189 13.715 49.764 1.00 0.00 ATOM 749 CA ILE 113 11.128 12.647 49.512 1.00 0.00 ATOM 750 CB ILE 113 12.031 12.959 48.276 1.00 0.00 ATOM 751 CG1 ILE 113 11.235 13.334 47.004 1.00 0.00 ATOM 752 CG2 ILE 113 12.963 11.804 47.999 1.00 0.00 ATOM 753 CD1 ILE 113 10.653 12.198 46.216 1.00 0.00 ATOM 754 O ILE 113 12.570 13.655 51.131 1.00 0.00 ATOM 755 C ILE 113 12.035 12.619 50.753 1.00 0.00 ATOM 756 N PRO 114 12.178 11.463 51.423 1.00 0.00 ATOM 757 CA PRO 114 13.101 11.357 52.571 1.00 0.00 ATOM 758 CB PRO 114 13.075 9.883 52.872 1.00 0.00 ATOM 759 CG PRO 114 11.664 9.490 52.477 1.00 0.00 ATOM 760 CD PRO 114 11.432 10.208 51.212 1.00 0.00 ATOM 761 O PRO 114 15.026 11.656 51.136 1.00 0.00 ATOM 762 C PRO 114 14.526 11.839 52.245 1.00 0.00 ATOM 763 N GLN 115 15.149 12.467 53.231 1.00 0.00 ATOM 764 CA GLN 115 16.473 13.079 53.113 1.00 0.00 ATOM 765 CB GLN 115 16.982 13.404 54.543 1.00 0.00 ATOM 766 CG GLN 115 18.388 13.980 54.626 1.00 0.00 ATOM 767 CD GLN 115 18.468 15.373 54.034 1.00 0.00 ATOM 768 OE1 GLN 115 17.526 16.168 54.157 1.00 0.00 ATOM 769 NE2 GLN 115 19.602 15.689 53.408 1.00 0.00 ATOM 770 O GLN 115 18.109 12.717 51.411 1.00 0.00 ATOM 771 C GLN 115 17.497 12.250 52.357 1.00 0.00 ATOM 772 N ALA 116 17.644 11.008 52.771 1.00 0.00 ATOM 773 CA ALA 116 18.607 10.072 52.208 1.00 0.00 ATOM 774 CB ALA 116 18.559 8.785 53.041 1.00 0.00 ATOM 775 O ALA 116 19.292 9.320 50.069 1.00 0.00 ATOM 776 C ALA 116 18.369 9.734 50.761 1.00 0.00 ATOM 777 N LEU 117 17.128 9.882 50.305 1.00 0.00 ATOM 778 CA LEU 117 16.777 9.569 48.933 1.00 0.00 ATOM 779 CB LEU 117 15.336 9.073 48.893 1.00 0.00 ATOM 780 CG LEU 117 14.950 7.814 49.686 1.00 0.00 ATOM 781 CD1 LEU 117 13.555 7.416 49.299 1.00 0.00 ATOM 782 CD2 LEU 117 15.880 6.685 49.392 1.00 0.00 ATOM 783 O LEU 117 16.731 10.617 46.805 1.00 0.00 ATOM 784 C LEU 117 16.847 10.775 48.012 1.00 0.00 ATOM 785 N GLN 118 17.035 11.974 48.569 1.00 0.00 ATOM 786 CA GLN 118 16.929 13.184 47.771 1.00 0.00 ATOM 787 CB GLN 118 16.994 14.411 48.679 1.00 0.00 ATOM 788 CG GLN 118 15.782 14.514 49.604 1.00 0.00 ATOM 789 CD GLN 118 15.775 15.735 50.521 1.00 0.00 ATOM 790 OE1 GLN 118 16.742 16.511 50.598 1.00 0.00 ATOM 791 NE2 GLN 118 14.657 15.927 51.190 1.00 0.00 ATOM 792 O GLN 118 17.533 13.373 45.468 1.00 0.00 ATOM 793 C GLN 118 17.928 13.266 46.622 1.00 0.00 ATOM 794 N VAL 119 19.209 13.148 46.932 1.00 0.00 ATOM 795 CA VAL 119 20.246 13.231 45.929 1.00 0.00 ATOM 796 CB VAL 119 21.678 13.289 46.578 1.00 0.00 ATOM 797 CG1 VAL 119 22.809 12.967 45.542 1.00 0.00 ATOM 798 CG2 VAL 119 21.902 14.685 47.247 1.00 0.00 ATOM 799 O VAL 119 20.078 12.510 43.660 1.00 0.00 ATOM 800 C VAL 119 20.082 12.166 44.845 1.00 0.00 ATOM 801 N PRO 120 19.990 10.890 45.234 1.00 0.00 ATOM 802 CA PRO 120 19.774 9.826 44.238 1.00 0.00 ATOM 803 CB PRO 120 19.770 8.530 45.070 1.00 0.00 ATOM 804 CG PRO 120 19.696 8.951 46.528 1.00 0.00 ATOM 805 CD PRO 120 20.235 10.363 46.596 1.00 0.00 ATOM 806 O PRO 120 18.462 9.483 42.297 1.00 0.00 ATOM 807 C PRO 120 18.486 9.916 43.441 1.00 0.00 ATOM 808 N PHE 121 17.418 10.417 44.054 1.00 0.00 ATOM 809 CA PHE 121 16.153 10.582 43.347 1.00 0.00 ATOM 810 CB PHE 121 15.037 10.995 44.279 1.00 0.00 ATOM 811 CG PHE 121 13.736 11.199 43.583 1.00 0.00 ATOM 812 CD1 PHE 121 12.898 10.138 43.353 1.00 0.00 ATOM 813 CD2 PHE 121 13.359 12.453 43.138 1.00 0.00 ATOM 814 CE1 PHE 121 11.684 10.321 42.670 1.00 0.00 ATOM 815 CE2 PHE 121 12.148 12.647 42.469 1.00 0.00 ATOM 816 CZ PHE 121 11.310 11.583 42.233 1.00 0.00 ATOM 817 O PHE 121 15.922 11.379 41.121 1.00 0.00 ATOM 818 C PHE 121 16.336 11.617 42.247 1.00 0.00 ATOM 819 N ILE 122 16.941 12.755 42.566 1.00 0.00 ATOM 820 CA ILE 122 17.170 13.769 41.555 1.00 0.00 ATOM 821 CB ILE 122 17.729 15.080 42.174 1.00 0.00 ATOM 822 CG1 ILE 122 16.668 15.699 43.095 1.00 0.00 ATOM 823 CG2 ILE 122 18.119 16.092 41.087 1.00 0.00 ATOM 824 CD1 ILE 122 15.334 16.063 42.354 1.00 0.00 ATOM 825 O ILE 122 17.786 13.504 39.217 1.00 0.00 ATOM 826 C ILE 122 18.055 13.229 40.402 1.00 0.00 ATOM 827 N ALA 123 19.083 12.456 40.732 1.00 0.00 ATOM 828 CA ALA 123 19.961 11.911 39.689 1.00 0.00 ATOM 829 CB ALA 123 21.291 11.249 40.304 1.00 0.00 ATOM 830 O ALA 123 19.420 10.893 37.578 1.00 0.00 ATOM 831 C ALA 123 19.199 10.915 38.797 1.00 0.00 ATOM 832 N TYR 124 18.338 10.097 39.401 1.00 0.00 ATOM 833 CA TYR 124 17.467 9.164 38.659 1.00 0.00 ATOM 834 CB TYR 124 16.711 8.262 39.645 1.00 0.00 ATOM 835 CG TYR 124 15.601 7.390 39.045 1.00 0.00 ATOM 836 CD1 TYR 124 15.897 6.350 38.157 1.00 0.00 ATOM 837 CD2 TYR 124 14.273 7.557 39.429 1.00 0.00 ATOM 838 CE1 TYR 124 14.878 5.544 37.615 1.00 0.00 ATOM 839 CE2 TYR 124 13.251 6.752 38.884 1.00 0.00 ATOM 840 CZ TYR 124 13.573 5.756 37.992 1.00 0.00 ATOM 841 OH TYR 124 12.588 4.951 37.503 1.00 0.00 ATOM 842 O TYR 124 16.293 9.585 36.557 1.00 0.00 ATOM 843 C TYR 124 16.472 9.921 37.742 1.00 0.00 ATOM 844 N LEU 125 15.828 10.936 38.295 1.00 0.00 ATOM 845 CA LEU 125 14.919 11.776 37.539 1.00 0.00 ATOM 846 CB LEU 125 14.388 12.866 38.439 1.00 0.00 ATOM 847 CG LEU 125 13.528 13.975 37.852 1.00 0.00 ATOM 848 CD1 LEU 125 12.290 13.417 37.151 1.00 0.00 ATOM 849 CD2 LEU 125 13.141 14.948 38.958 1.00 0.00 ATOM 850 O LEU 125 15.051 12.390 35.257 1.00 0.00 ATOM 851 C LEU 125 15.586 12.399 36.359 1.00 0.00 ATOM 852 N GLN 126 16.755 12.971 36.588 1.00 0.00 ATOM 853 CA GLN 126 17.508 13.642 35.549 1.00 0.00 ATOM 854 CB GLN 126 18.751 14.270 36.174 1.00 0.00 ATOM 855 CG GLN 126 19.629 15.036 35.185 1.00 0.00 ATOM 856 CD GLN 126 18.903 16.178 34.512 1.00 0.00 ATOM 857 OE1 GLN 126 18.736 17.218 35.106 1.00 0.00 ATOM 858 NE2 GLN 126 18.490 15.990 33.240 1.00 0.00 ATOM 859 O GLN 126 17.760 13.003 33.233 1.00 0.00 ATOM 860 C GLN 126 17.881 12.678 34.416 1.00 0.00 ATOM 861 N ARG 127 18.303 11.472 34.780 1.00 0.00 ATOM 862 CA ARG 127 18.657 10.476 33.791 1.00 0.00 ATOM 863 CB ARG 127 19.327 9.298 34.464 1.00 0.00 ATOM 864 CG ARG 127 20.318 8.596 33.599 1.00 0.00 ATOM 865 CD ARG 127 21.591 9.416 33.503 1.00 0.00 ATOM 866 NE ARG 127 22.480 8.802 32.548 1.00 0.00 ATOM 867 CZ ARG 127 22.627 9.157 31.273 1.00 0.00 ATOM 868 NH1 ARG 127 21.973 10.187 30.748 1.00 0.00 ATOM 869 NH2 ARG 127 23.478 8.479 30.520 1.00 0.00 ATOM 870 O ARG 127 17.473 9.740 31.804 1.00 0.00 ATOM 871 C ARG 127 17.395 10.004 32.990 1.00 0.00 ATOM 872 N CYS 128 16.250 9.873 33.644 1.00 0.00 ATOM 873 CA CYS 128 14.987 9.585 32.923 1.00 0.00 ATOM 874 CB CYS 128 13.837 9.324 33.928 1.00 0.00 ATOM 875 SG CYS 128 14.119 7.821 34.873 1.00 0.00 ATOM 876 O CYS 128 14.127 10.500 30.866 1.00 0.00 ATOM 877 C CYS 128 14.621 10.721 31.954 1.00 0.00 ATOM 878 N ILE 129 14.838 11.945 32.371 1.00 0.00 ATOM 879 CA ILE 129 14.646 13.080 31.492 1.00 0.00 ATOM 880 CB ILE 129 14.712 14.359 32.332 1.00 0.00 ATOM 881 CG1 ILE 129 13.341 14.531 33.005 1.00 0.00 ATOM 882 CG2 ILE 129 15.056 15.568 31.479 1.00 0.00 ATOM 883 CD1 ILE 129 13.353 15.505 34.108 1.00 0.00 ATOM 884 O ILE 129 15.292 13.538 29.191 1.00 0.00 ATOM 885 C ILE 129 15.640 13.078 30.299 1.00 0.00 ATOM 886 N ASP 130 16.865 12.578 30.529 1.00 0.00 ATOM 887 CA ASP 130 17.855 12.457 29.472 1.00 0.00 ATOM 888 CB ASP 130 19.189 11.945 30.024 1.00 0.00 ATOM 889 CG ASP 130 19.891 12.936 30.987 1.00 0.00 ATOM 890 OD1 ASP 130 19.583 14.156 30.994 1.00 0.00 ATOM 891 OD2 ASP 130 20.814 12.484 31.719 1.00 0.00 ATOM 892 O ASP 130 17.640 11.654 27.216 1.00 0.00 ATOM 893 C ASP 130 17.337 11.498 28.389 1.00 0.00 ATOM 894 N ALA 131 16.544 10.500 28.789 1.00 0.00 ATOM 895 CA ALA 131 15.936 9.590 27.850 1.00 0.00 ATOM 896 CB ALA 131 15.269 8.458 28.583 1.00 0.00 ATOM 897 O ALA 131 14.875 10.093 25.747 1.00 0.00 ATOM 898 C ALA 131 14.941 10.341 26.947 1.00 0.00 ATOM 899 N VAL 132 14.203 11.283 27.519 1.00 0.00 ATOM 900 CA VAL 132 13.329 12.146 26.734 1.00 0.00 ATOM 901 CB VAL 132 12.430 13.076 27.640 1.00 0.00 ATOM 902 CG1 VAL 132 11.432 13.877 26.784 1.00 0.00 ATOM 903 CG2 VAL 132 11.727 12.283 28.732 1.00 0.00 ATOM 904 O VAL 132 13.816 13.272 24.666 1.00 0.00 ATOM 905 C VAL 132 14.202 13.019 25.801 1.00 0.00 ATOM 906 N GLY 133 15.331 13.514 26.324 1.00 0.00 ATOM 907 CA GLY 133 16.316 14.310 25.563 1.00 0.00 ATOM 908 O GLY 133 16.971 14.062 23.319 1.00 0.00 ATOM 909 C GLY 133 16.810 13.523 24.352 1.00 0.00 ATOM 910 N LEU 134 17.032 12.225 24.494 1.00 0.00 ATOM 911 CA LEU 134 17.421 11.391 23.377 1.00 0.00 ATOM 912 CB LEU 134 17.770 9.966 23.842 1.00 0.00 ATOM 913 CG LEU 134 18.108 9.019 22.669 1.00 0.00 ATOM 914 CD1 LEU 134 19.297 9.578 21.873 1.00 0.00 ATOM 915 CD2 LEU 134 18.353 7.562 23.134 1.00 0.00 ATOM 916 O LEU 134 16.591 11.460 21.129 1.00 0.00 ATOM 917 C LEU 134 16.313 11.344 22.321 1.00 0.00 ATOM 918 N ALA 135 15.060 11.199 22.745 1.00 0.00 ATOM 919 CA ALA 135 13.957 11.238 21.796 1.00 0.00 ATOM 920 CB ALA 135 12.618 10.992 22.487 1.00 0.00 ATOM 921 O ALA 135 13.802 12.555 19.790 1.00 0.00 ATOM 922 C ALA 135 13.928 12.551 21.013 1.00 0.00 ATOM 923 N GLN 136 14.041 13.664 21.714 1.00 0.00 ATOM 924 CA GLN 136 14.107 14.965 21.063 1.00 0.00 ATOM 925 CB GLN 136 14.295 16.093 22.109 1.00 0.00 ATOM 926 CG GLN 136 14.561 17.489 21.480 1.00 0.00 ATOM 927 CD GLN 136 14.971 18.524 22.463 1.00 0.00 ATOM 928 OE1 GLN 136 15.830 18.279 23.328 1.00 0.00 ATOM 929 NE2 GLN 136 14.380 19.728 22.343 1.00 0.00 ATOM 930 O GLN 136 15.114 15.473 18.961 1.00 0.00 ATOM 931 C GLN 136 15.266 14.989 20.076 1.00 0.00 ATOM 932 N GLN 137 16.412 14.462 20.484 1.00 0.00 ATOM 933 CA GLN 137 17.598 14.440 19.629 1.00 0.00 ATOM 934 CB GLN 137 18.839 13.939 20.399 1.00 0.00 ATOM 935 CG GLN 137 20.157 14.128 19.642 1.00 0.00 ATOM 936 CD GLN 137 21.396 13.479 20.311 1.00 0.00 ATOM 937 OE1 GLN 137 22.392 13.210 19.632 1.00 0.00 ATOM 938 NE2 GLN 137 21.323 13.219 21.619 1.00 0.00 ATOM 939 O GLN 137 17.759 14.009 17.307 1.00 0.00 ATOM 940 C GLN 137 17.386 13.591 18.380 1.00 0.00 ATOM 941 N VAL 138 16.798 12.402 18.512 1.00 0.00 ATOM 942 CA VAL 138 16.587 11.556 17.339 1.00 0.00 ATOM 943 CB VAL 138 16.169 10.090 17.665 1.00 0.00 ATOM 944 CG1 VAL 138 17.240 9.388 18.423 1.00 0.00 ATOM 945 CG2 VAL 138 14.855 9.981 18.458 1.00 0.00 ATOM 946 O VAL 138 15.714 11.986 15.124 1.00 0.00 ATOM 947 C VAL 138 15.579 12.171 16.338 1.00 0.00 ATOM 948 N ILE 139 14.561 12.866 16.844 1.00 0.00 ATOM 949 CA ILE 139 13.555 13.483 15.987 1.00 0.00 ATOM 950 CB ILE 139 12.333 14.025 16.827 1.00 0.00 ATOM 951 CG1 ILE 139 11.491 12.878 17.403 1.00 0.00 ATOM 952 CG2 ILE 139 11.369 14.788 15.990 1.00 0.00 ATOM 953 O ILE 139 13.934 14.719 13.944 1.00 0.00 ATOM 954 C ILE 139 14.227 14.568 15.136 1.00 0.00 ATOM 955 N ASN 140 15.130 15.309 15.760 1.00 0.00 ATOM 956 CA ASN 140 15.882 16.374 15.104 1.00 0.00 ATOM 957 CB ASN 140 16.711 17.170 16.133 1.00 0.00 ATOM 958 CG ASN 140 15.876 18.078 17.003 1.00 0.00 ATOM 959 ND2 ASN 140 16.417 18.399 18.193 1.00 0.00 ATOM 960 OD1 ASN 140 14.777 18.528 16.612 1.00 0.00 ATOM 961 O ASN 140 17.010 16.389 13.025 1.00 0.00 ATOM 962 C ASN 140 16.878 15.853 14.097 1.00 0.00 ATOM 963 N GLU 141 17.596 14.806 14.465 1.00 0.00 ATOM 964 CA GLU 141 18.581 14.192 13.583 1.00 0.00 ATOM 965 CB GLU 141 19.325 13.046 14.284 1.00 0.00 ATOM 966 CG GLU 141 20.123 13.382 15.553 1.00 0.00 ATOM 967 CD GLU 141 21.528 13.919 15.302 1.00 0.00 ATOM 968 OE1 GLU 141 22.026 13.852 14.153 1.00 0.00 ATOM 969 OE2 GLU 141 22.141 14.395 16.284 1.00 0.00 ATOM 970 O GLU 141 18.600 13.309 11.366 1.00 0.00 ATOM 971 C GLU 141 17.911 13.594 12.350 1.00 0.00 ATOM 972 N LEU 142 16.588 13.399 12.407 1.00 0.00 ATOM 973 CA LEU 142 15.825 12.809 11.306 1.00 0.00 ATOM 974 CB LEU 142 14.433 12.369 11.758 1.00 0.00 ATOM 975 CG LEU 142 13.787 11.333 10.821 1.00 0.00 ATOM 976 CD1 LEU 142 14.688 10.101 10.663 1.00 0.00 ATOM 977 CD2 LEU 142 12.383 10.923 11.298 1.00 0.00 ATOM 978 O LEU 142 15.510 13.273 9.003 1.00 0.00 ATOM 979 C LEU 142 15.694 13.743 10.113 1.00 0.00 ATOM 980 N ASP 143 15.742 15.054 10.321 1.00 0.00 ATOM 981 CA ASP 143 15.757 15.973 9.168 1.00 0.00 ATOM 982 CB ASP 143 15.995 17.418 9.614 1.00 0.00 ATOM 983 CG ASP 143 14.725 18.149 9.980 1.00 0.00 ATOM 984 OD1 ASP 143 13.661 17.878 9.363 1.00 0.00 ATOM 985 OD2 ASP 143 14.826 19.044 10.851 1.00 0.00 ATOM 986 O ASP 143 16.712 15.525 7.002 1.00 0.00 ATOM 987 C ASP 143 16.893 15.613 8.221 1.00 0.00 ATOM 988 N ASP 144 18.074 15.420 8.801 1.00 0.00 ATOM 989 CA ASP 144 19.245 15.035 8.039 1.00 0.00 ATOM 990 CB ASP 144 20.414 14.759 8.981 1.00 0.00 ATOM 991 O ASP 144 19.285 13.764 6.005 1.00 0.00 ATOM 992 C ASP 144 18.959 13.797 7.185 1.00 0.00 ATOM 993 N LEU 145 18.309 12.798 7.767 1.00 0.00 ATOM 994 CA LEU 145 18.016 11.560 7.048 1.00 0.00 ATOM 995 CB LEU 145 17.570 10.476 8.027 1.00 0.00 ATOM 996 CG LEU 145 17.758 9.054 7.510 1.00 0.00 ATOM 997 CD1 LEU 145 19.228 8.768 7.226 1.00 0.00 ATOM 998 CD2 LEU 145 17.244 8.082 8.525 1.00 0.00 ATOM 999 O LEU 145 16.903 11.067 4.970 1.00 0.00 ATOM 1000 C LEU 145 16.952 11.793 5.967 1.00 0.00 ATOM 1001 N LEU 146 16.103 12.801 6.179 1.00 0.00 ATOM 1002 CA LEU 146 15.097 13.195 5.202 1.00 0.00 ATOM 1003 CB LEU 146 13.945 13.931 5.894 1.00 0.00 ATOM 1004 O LEU 146 15.190 14.192 3.003 1.00 0.00 ATOM 1005 C LEU 146 15.744 14.065 4.092 1.00 0.00 ATOM 1006 N GLU 147 16.914 14.648 4.371 1.00 0.00 ATOM 1007 CA GLU 147 17.659 15.460 3.391 1.00 0.00 ATOM 1008 CB GLU 147 18.028 16.825 3.997 1.00 0.00 ATOM 1009 O GLU 147 18.888 13.796 2.123 1.00 0.00 ATOM 1010 C GLU 147 18.937 14.746 2.913 1.00 0.00 ATOM 1011 N ARG 151 19.803 6.476 1.207 1.00 0.00 ATOM 1012 CA ARG 151 19.764 5.046 0.920 1.00 0.00 ATOM 1013 O ARG 151 19.354 4.003 3.058 1.00 0.00 ATOM 1014 C ARG 151 20.163 4.216 2.151 1.00 0.00 ATOM 1015 N GLY 152 21.419 3.781 2.207 1.00 0.00 ATOM 1016 CA GLY 152 21.890 2.932 3.309 1.00 0.00 ATOM 1017 O GLY 152 22.031 2.848 5.706 1.00 0.00 ATOM 1018 C GLY 152 21.977 3.565 4.687 1.00 0.00 ATOM 1019 N ARG 153 21.960 4.895 4.739 1.00 0.00 ATOM 1020 CA ARG 153 22.118 5.626 6.010 1.00 0.00 ATOM 1021 CB ARG 153 22.087 7.143 5.735 1.00 0.00 ATOM 1022 CG ARG 153 23.312 7.664 4.960 1.00 0.00 ATOM 1023 CD ARG 153 23.293 9.191 4.817 1.00 0.00 ATOM 1024 O ARG 153 21.516 5.408 8.330 1.00 0.00 ATOM 1025 C ARG 153 21.153 5.261 7.168 1.00 0.00 ATOM 1026 N GLU 154 19.959 4.772 6.847 1.00 0.00 ATOM 1027 CA GLU 154 18.951 4.419 7.858 1.00 0.00 ATOM 1028 CB GLU 154 17.622 4.017 7.180 1.00 0.00 ATOM 1029 CG GLU 154 17.703 2.905 6.100 1.00 0.00 ATOM 1030 CD GLU 154 16.341 2.244 5.832 1.00 0.00 ATOM 1031 O GLU 154 19.069 3.482 10.077 1.00 0.00 ATOM 1032 C GLU 154 19.394 3.366 8.893 1.00 0.00 ATOM 1033 N VAL 155 20.162 2.371 8.460 1.00 0.00 ATOM 1034 CA VAL 155 20.672 1.338 9.360 1.00 0.00 ATOM 1035 CB VAL 155 21.299 0.180 8.554 1.00 0.00 ATOM 1036 CG1 VAL 155 21.996 -0.828 9.461 1.00 0.00 ATOM 1037 CG2 VAL 155 20.207 -0.523 7.747 1.00 0.00 ATOM 1038 O VAL 155 21.619 1.596 11.571 1.00 0.00 ATOM 1039 C VAL 155 21.667 1.923 10.377 1.00 0.00 ATOM 1040 N ASP 156 22.569 2.786 9.902 1.00 0.00 ATOM 1041 CA ASP 156 23.538 3.431 10.783 1.00 0.00 ATOM 1042 CB ASP 156 24.537 4.280 9.983 1.00 0.00 ATOM 1043 CG ASP 156 25.663 4.859 10.868 1.00 0.00 ATOM 1044 O ASP 156 23.179 4.321 12.975 1.00 0.00 ATOM 1045 C ASP 156 22.809 4.303 11.816 1.00 0.00 ATOM 1046 N PHE 157 21.773 5.012 11.376 1.00 0.00 ATOM 1047 CA PHE 157 20.946 5.857 12.240 1.00 0.00 ATOM 1048 CB PHE 157 19.837 6.499 11.387 1.00 0.00 ATOM 1049 CG PHE 157 18.958 7.463 12.132 1.00 0.00 ATOM 1050 CD1 PHE 157 17.851 7.025 12.801 1.00 0.00 ATOM 1051 CD2 PHE 157 19.240 8.812 12.138 1.00 0.00 ATOM 1052 CE1 PHE 157 17.050 7.897 13.481 1.00 0.00 ATOM 1053 CE2 PHE 157 18.440 9.699 12.814 1.00 0.00 ATOM 1054 CZ PHE 157 17.341 9.231 13.489 1.00 0.00 ATOM 1055 O PHE 157 20.382 5.466 14.567 1.00 0.00 ATOM 1056 C PHE 157 20.317 5.059 13.403 1.00 0.00 ATOM 1057 N VAL 158 19.693 3.935 13.063 1.00 0.00 ATOM 1058 CA VAL 158 19.077 3.063 14.039 1.00 0.00 ATOM 1059 CB VAL 158 18.212 1.975 13.347 1.00 0.00 ATOM 1060 CG1 VAL 158 17.787 0.883 14.344 1.00 0.00 ATOM 1061 CG2 VAL 158 17.027 2.638 12.698 1.00 0.00 ATOM 1062 O VAL 158 19.914 2.325 16.139 1.00 0.00 ATOM 1063 C VAL 158 20.124 2.442 14.924 1.00 0.00 ATOM 1064 N ALA 159 21.248 2.010 14.347 1.00 0.00 ATOM 1065 CA ALA 159 22.332 1.456 15.174 1.00 0.00 ATOM 1066 CB ALA 159 23.509 1.111 14.309 1.00 0.00 ATOM 1067 O ALA 159 23.003 2.049 17.401 1.00 0.00 ATOM 1068 C ALA 159 22.770 2.443 16.266 1.00 0.00 ATOM 1069 N LYS 160 22.918 3.712 15.889 1.00 0.00 ATOM 1070 CA LYS 160 23.369 4.772 16.798 1.00 0.00 ATOM 1071 CB LYS 160 23.609 6.100 16.040 1.00 0.00 ATOM 1072 CG LYS 160 24.850 6.115 15.094 1.00 0.00 ATOM 1073 CD LYS 160 24.967 7.450 14.297 1.00 0.00 ATOM 1074 CE LYS 160 26.147 7.463 13.269 1.00 0.00 ATOM 1075 O LYS 160 22.671 5.113 19.067 1.00 0.00 ATOM 1076 C LYS 160 22.348 5.001 17.885 1.00 0.00 ATOM 1077 N MET 161 21.096 5.069 17.471 1.00 0.00 ATOM 1078 CA MET 161 19.975 5.256 18.401 1.00 0.00 ATOM 1079 CB MET 161 18.669 5.259 17.621 1.00 0.00 ATOM 1080 CG MET 161 17.478 5.686 18.409 1.00 0.00 ATOM 1081 SD MET 161 15.855 5.727 17.270 1.00 0.00 ATOM 1082 CE MET 161 15.369 3.749 17.375 1.00 0.00 ATOM 1083 O MET 161 19.808 4.408 20.631 1.00 0.00 ATOM 1084 C MET 161 19.951 4.148 19.452 1.00 0.00 ATOM 1085 N ILE 162 20.091 2.911 19.007 1.00 0.00 ATOM 1086 CA ILE 162 20.166 1.766 19.894 1.00 0.00 ATOM 1087 CB ILE 162 20.330 0.451 19.088 1.00 0.00 ATOM 1088 CG1 ILE 162 19.047 0.118 18.320 1.00 0.00 ATOM 1089 CG2 ILE 162 20.626 -0.716 20.024 1.00 0.00 ATOM 1090 CD1 ILE 162 19.180 -1.172 17.468 1.00 0.00 ATOM 1091 O ILE 162 21.187 1.721 22.048 1.00 0.00 ATOM 1092 C ILE 162 21.343 1.909 20.858 1.00 0.00 ATOM 1093 N ASN 163 22.514 2.271 20.351 1.00 0.00 ATOM 1094 CA ASN 163 23.688 2.408 21.218 1.00 0.00 ATOM 1095 CB ASN 163 24.954 2.693 20.394 1.00 0.00 ATOM 1096 CG ASN 163 25.348 1.519 19.482 1.00 0.00 ATOM 1097 ND2 ASN 163 25.937 1.823 18.327 1.00 0.00 ATOM 1098 OD1 ASN 163 25.099 0.372 19.803 1.00 0.00 ATOM 1099 O ASN 163 23.854 3.324 23.423 1.00 0.00 ATOM 1100 C ASN 163 23.487 3.498 22.279 1.00 0.00 ATOM 1101 N GLU 164 22.920 4.625 21.872 1.00 0.00 ATOM 1102 CA GLU 164 22.677 5.750 22.768 1.00 0.00 ATOM 1103 CB GLU 164 22.144 6.945 21.961 1.00 0.00 ATOM 1104 CG GLU 164 23.160 7.684 21.106 1.00 0.00 ATOM 1105 CD GLU 164 23.889 8.771 21.851 1.00 0.00 ATOM 1106 O GLU 164 21.874 5.713 25.057 1.00 0.00 ATOM 1107 C GLU 164 21.673 5.386 23.877 1.00 0.00 ATOM 1108 N LEU 165 20.622 4.684 23.498 1.00 0.00 ATOM 1109 CA LEU 165 19.635 4.236 24.465 1.00 0.00 ATOM 1110 CB LEU 165 18.401 3.685 23.743 1.00 0.00 ATOM 1111 CG LEU 165 17.242 3.254 24.657 1.00 0.00 ATOM 1112 CD1 LEU 165 16.717 4.390 25.574 1.00 0.00 ATOM 1113 CD2 LEU 165 16.101 2.656 23.842 1.00 0.00 ATOM 1114 O LEU 165 19.880 3.220 26.634 1.00 0.00 ATOM 1115 C LEU 165 20.192 3.187 25.437 1.00 0.00 ATOM 1116 N ASP 166 20.995 2.253 24.936 1.00 0.00 ATOM 1117 CA ASP 166 21.592 1.237 25.810 1.00 0.00 ATOM 1118 CB ASP 166 22.465 0.247 25.017 1.00 0.00 ATOM 1119 CG ASP 166 21.646 -0.694 24.125 1.00 0.00 ATOM 1120 OD1 ASP 166 20.368 -0.680 24.167 1.00 0.00 ATOM 1121 OD2 ASP 166 22.306 -1.441 23.359 1.00 0.00 ATOM 1122 O ASP 166 22.465 1.360 28.043 1.00 0.00 ATOM 1123 C ASP 166 22.430 1.873 26.920 1.00 0.00 ATOM 1124 N ILE 167 23.142 2.948 26.593 1.00 0.00 ATOM 1125 CA ILE 167 23.900 3.661 27.593 1.00 0.00 ATOM 1126 CB ILE 167 24.726 4.744 26.965 1.00 0.00 ATOM 1127 CG1 ILE 167 25.926 4.090 26.255 1.00 0.00 ATOM 1128 CG2 ILE 167 25.192 5.713 28.044 1.00 0.00 ATOM 1129 CD1 ILE 167 26.740 5.016 25.402 1.00 0.00 ATOM 1130 O ILE 167 23.237 4.108 29.853 1.00 0.00 ATOM 1131 C ILE 167 22.991 4.263 28.651 1.00 0.00 ATOM 1132 N ILE 168 21.936 4.943 28.228 1.00 0.00 ATOM 1133 CA ILE 168 21.021 5.555 29.178 1.00 0.00 ATOM 1134 CB ILE 168 20.024 6.477 28.478 1.00 0.00 ATOM 1135 CG1 ILE 168 20.775 7.662 27.881 1.00 0.00 ATOM 1136 CG2 ILE 168 18.965 6.975 29.458 1.00 0.00 ATOM 1137 CD1 ILE 168 19.931 8.535 27.061 1.00 0.00 ATOM 1138 O ILE 168 20.100 4.722 31.214 1.00 0.00 ATOM 1139 C ILE 168 20.277 4.511 30.011 1.00 0.00 ATOM 1140 N GLU 169 19.840 3.414 29.384 1.00 0.00 ATOM 1141 CA GLU 169 19.103 2.357 30.100 1.00 0.00 ATOM 1142 CB GLU 169 18.513 1.322 29.154 1.00 0.00 ATOM 1143 CG GLU 169 17.280 1.845 28.446 1.00 0.00 ATOM 1144 CD GLU 169 16.611 0.826 27.491 1.00 0.00 ATOM 1145 OE1 GLU 169 17.300 -0.105 27.008 1.00 0.00 ATOM 1146 OE2 GLU 169 15.391 0.997 27.211 1.00 0.00 ATOM 1147 O GLU 169 19.453 1.266 32.188 1.00 0.00 ATOM 1148 C GLU 169 19.948 1.650 31.145 1.00 0.00 ATOM 1149 N GLU 170 21.237 1.516 30.876 1.00 0.00 ATOM 1150 CA GLU 170 22.122 0.877 31.814 1.00 0.00 ATOM 1151 CB GLU 170 23.501 0.683 31.154 1.00 0.00 ATOM 1152 CG GLU 170 24.497 -0.199 31.917 1.00 0.00 ATOM 1153 CD GLU 170 25.867 -0.318 31.201 1.00 0.00 ATOM 1154 O GLU 170 22.075 1.244 34.175 1.00 0.00 ATOM 1155 C GLU 170 22.186 1.758 33.071 1.00 0.00 ATOM 1156 N ASP 171 22.354 3.072 32.877 1.00 0.00 ATOM 1157 CA ASP 171 22.435 4.020 33.972 1.00 0.00 ATOM 1158 CB ASP 171 22.786 5.410 33.438 1.00 0.00 ATOM 1159 CG ASP 171 24.233 5.515 32.968 1.00 0.00 ATOM 1160 OD1 ASP 171 24.974 4.503 33.036 1.00 0.00 ATOM 1161 OD2 ASP 171 24.642 6.617 32.530 1.00 0.00 ATOM 1162 O ASP 171 21.163 4.014 35.949 1.00 0.00 ATOM 1163 C ASP 171 21.132 4.094 34.751 1.00 0.00 ATOM 1164 N THR 172 20.001 4.247 34.065 1.00 0.00 ATOM 1165 CA THR 172 18.716 4.353 34.753 1.00 0.00 ATOM 1166 CB THR 172 17.527 4.677 33.825 1.00 0.00 ATOM 1167 CG2 THR 172 17.730 5.977 33.132 1.00 0.00 ATOM 1168 OG1 THR 172 17.384 3.643 32.847 1.00 0.00 ATOM 1169 O THR 172 17.845 3.181 36.604 1.00 0.00 ATOM 1170 C THR 172 18.376 3.103 35.519 1.00 0.00 ATOM 1171 N ASP 173 18.700 1.941 34.978 1.00 0.00 ATOM 1172 CA ASP 173 18.442 0.699 35.710 1.00 0.00 ATOM 1173 CB ASP 173 18.795 -0.530 34.880 1.00 0.00 ATOM 1174 CG ASP 173 17.901 -0.672 33.642 1.00 0.00 ATOM 1175 OD1 ASP 173 16.847 0.042 33.575 1.00 0.00 ATOM 1176 OD2 ASP 173 18.274 -1.469 32.732 1.00 0.00 ATOM 1177 O ASP 173 18.678 0.292 38.038 1.00 0.00 ATOM 1178 C ASP 173 19.225 0.642 37.003 1.00 0.00 ATOM 1179 N ASP 174 20.516 0.955 36.932 1.00 0.00 ATOM 1180 CA ASP 174 21.342 0.942 38.121 1.00 0.00 ATOM 1181 CB ASP 174 22.819 1.257 37.789 1.00 0.00 ATOM 1182 CG ASP 174 23.454 0.212 36.837 1.00 0.00 ATOM 1183 OD1 ASP 174 22.740 -0.747 36.438 1.00 0.00 ATOM 1184 OD2 ASP 174 24.663 0.340 36.476 1.00 0.00 ATOM 1185 O ASP 174 20.719 1.633 40.314 1.00 0.00 ATOM 1186 C ASP 174 20.806 1.944 39.150 1.00 0.00 ATOM 1187 N LEU 175 20.471 3.149 38.722 1.00 0.00 ATOM 1188 CA LEU 175 20.000 4.165 39.651 1.00 0.00 ATOM 1189 CB LEU 175 19.908 5.522 38.949 1.00 0.00 ATOM 1190 CG LEU 175 21.219 6.133 38.459 1.00 0.00 ATOM 1191 CD1 LEU 175 20.918 7.407 37.690 1.00 0.00 ATOM 1192 CD2 LEU 175 22.152 6.432 39.598 1.00 0.00 ATOM 1193 O LEU 175 18.460 4.038 41.457 1.00 0.00 ATOM 1194 C LEU 175 18.671 3.794 40.285 1.00 0.00 ATOM 1195 N GLN 176 17.800 3.161 39.516 1.00 0.00 ATOM 1196 CA GLN 176 16.487 2.750 40.000 1.00 0.00 ATOM 1197 CB GLN 176 15.670 2.158 38.852 1.00 0.00 ATOM 1198 CG GLN 176 14.196 2.033 39.179 1.00 0.00 ATOM 1199 CD GLN 176 13.375 1.597 37.970 1.00 0.00 ATOM 1200 OE1 GLN 176 12.423 2.286 37.570 1.00 0.00 ATOM 1201 NE2 GLN 176 13.785 0.511 37.343 1.00 0.00 ATOM 1202 O GLN 176 15.944 1.758 42.111 1.00 0.00 ATOM 1203 C GLN 176 16.627 1.709 41.088 1.00 0.00 ATOM 1204 N ILE 177 17.565 0.781 40.881 1.00 0.00 ATOM 1205 CA ILE 177 17.822 -0.262 41.854 1.00 0.00 ATOM 1206 CB ILE 177 18.755 -1.324 41.285 1.00 0.00 ATOM 1207 CG1 ILE 177 18.012 -2.091 40.187 1.00 0.00 ATOM 1208 CG2 ILE 177 19.224 -2.272 42.410 1.00 0.00 ATOM 1209 CD1 ILE 177 18.914 -3.071 39.372 1.00 0.00 ATOM 1210 O ILE 177 17.869 -0.060 44.238 1.00 0.00 ATOM 1211 C ILE 177 18.361 0.310 43.162 1.00 0.00 ATOM 1212 N GLN 178 19.370 1.177 43.070 1.00 0.00 ATOM 1213 CA GLN 178 19.934 1.825 44.247 1.00 0.00 ATOM 1214 CB GLN 178 21.072 2.761 43.860 1.00 0.00 ATOM 1215 CG GLN 178 22.346 2.082 43.319 1.00 0.00 ATOM 1216 O GLN 178 18.717 2.508 46.182 1.00 0.00 ATOM 1217 C GLN 178 18.860 2.613 44.988 1.00 0.00 ATOM 1218 N LEU 179 18.039 3.336 44.253 1.00 0.00 ATOM 1219 CA LEU 179 16.992 4.125 44.865 1.00 0.00 ATOM 1220 CB LEU 179 16.347 4.955 43.770 1.00 0.00 ATOM 1221 CG LEU 179 15.311 5.988 44.121 1.00 0.00 ATOM 1222 CD1 LEU 179 15.912 7.024 45.071 1.00 0.00 ATOM 1223 CD2 LEU 179 14.891 6.611 42.795 1.00 0.00 ATOM 1224 O LEU 179 15.598 3.548 46.753 1.00 0.00 ATOM 1225 C LEU 179 15.971 3.238 45.629 1.00 0.00 ATOM 1226 N ARG 180 15.540 2.138 45.028 1.00 0.00 ATOM 1227 CA ARG 180 14.628 1.195 45.707 1.00 0.00 ATOM 1228 CB ARG 180 14.119 0.154 44.737 1.00 0.00 ATOM 1229 CG ARG 180 13.182 0.754 43.745 1.00 0.00 ATOM 1230 CD ARG 180 12.564 -0.295 42.802 1.00 0.00 ATOM 1231 NE ARG 180 11.589 0.404 41.982 1.00 0.00 ATOM 1232 CZ ARG 180 11.393 0.185 40.682 1.00 0.00 ATOM 1233 NH1 ARG 180 12.125 -0.714 40.027 1.00 0.00 ATOM 1234 NH2 ARG 180 10.482 0.904 40.021 1.00 0.00 ATOM 1235 O ARG 180 14.572 0.158 47.845 1.00 0.00 ATOM 1236 C ARG 180 15.256 0.486 46.890 1.00 0.00 ATOM 1237 N ARG 181 16.545 0.196 46.787 1.00 0.00 ATOM 1238 CA ARG 181 17.292 -0.446 47.866 1.00 0.00 ATOM 1239 CB ARG 181 18.730 -0.712 47.395 1.00 0.00 ATOM 1240 CG ARG 181 19.651 -1.478 48.369 1.00 0.00 ATOM 1241 CD ARG 181 21.010 -1.871 47.672 1.00 0.00 ATOM 1242 NE ARG 181 20.830 -2.524 46.354 1.00 0.00 ATOM 1243 CZ ARG 181 21.809 -2.781 45.480 1.00 0.00 ATOM 1244 O ARG 181 17.063 0.115 50.206 1.00 0.00 ATOM 1245 C ARG 181 17.274 0.519 49.074 1.00 0.00 ATOM 1246 N GLN 182 17.496 1.797 48.819 1.00 0.00 ATOM 1247 CA GLN 182 17.464 2.772 49.887 1.00 0.00 ATOM 1248 CB GLN 182 17.911 4.148 49.396 1.00 0.00 ATOM 1249 CG GLN 182 19.410 4.256 49.215 1.00 0.00 ATOM 1250 CD GLN 182 19.851 5.598 48.667 1.00 0.00 ATOM 1251 OE1 GLN 182 19.128 6.238 47.895 1.00 0.00 ATOM 1252 NE2 GLN 182 21.054 6.012 49.028 1.00 0.00 ATOM 1253 O GLN 182 15.989 3.136 51.690 1.00 0.00 ATOM 1254 C GLN 182 16.105 2.934 50.494 1.00 0.00 ATOM 1255 N LEU 183 15.074 2.916 49.660 1.00 0.00 ATOM 1256 CA LEU 183 13.720 3.046 50.181 1.00 0.00 ATOM 1257 CB LEU 183 12.711 3.241 49.027 1.00 0.00 ATOM 1258 CG LEU 183 11.233 3.462 49.373 1.00 0.00 ATOM 1259 CD1 LEU 183 11.023 4.448 50.495 1.00 0.00 ATOM 1260 CD2 LEU 183 10.467 3.867 48.197 1.00 0.00 ATOM 1261 O LEU 183 12.883 1.981 52.112 1.00 0.00 ATOM 1262 C LEU 183 13.405 1.839 51.036 1.00 0.00 ATOM 1263 N PHE 184 13.779 0.653 50.575 1.00 0.00 ATOM 1264 CA PHE 184 13.543 -0.589 51.301 1.00 0.00 ATOM 1265 CB PHE 184 14.139 -1.747 50.526 1.00 0.00 ATOM 1266 CG PHE 184 13.837 -3.077 51.112 1.00 0.00 ATOM 1267 CD1 PHE 184 12.542 -3.510 51.233 1.00 0.00 ATOM 1268 CD2 PHE 184 14.854 -3.918 51.520 1.00 0.00 ATOM 1269 CE1 PHE 184 12.254 -4.756 51.777 1.00 0.00 ATOM 1270 CE2 PHE 184 14.570 -5.163 52.056 1.00 0.00 ATOM 1271 CZ PHE 184 13.262 -5.580 52.191 1.00 0.00 ATOM 1272 O PHE 184 13.420 -0.915 53.709 1.00 0.00 ATOM 1273 C PHE 184 14.094 -0.511 52.738 1.00 0.00 ATOM 1274 N ALA 185 15.292 0.060 52.879 1.00 0.00 ATOM 1275 CA ALA 185 15.919 0.239 54.192 1.00 0.00 ATOM 1276 CB ALA 185 17.346 0.740 54.016 1.00 0.00 ATOM 1277 O ALA 185 15.268 1.118 56.306 1.00 0.00 ATOM 1278 C ALA 185 15.175 1.213 55.090 1.00 0.00 ATOM 1279 N LEU 186 14.461 2.167 54.505 1.00 0.00 ATOM 1280 CA LEU 186 13.720 3.177 55.279 1.00 0.00 ATOM 1281 CB LEU 186 13.666 4.529 54.530 1.00 0.00 ATOM 1282 CG LEU 186 14.867 5.397 54.280 1.00 0.00 ATOM 1283 CD1 LEU 186 14.455 6.679 53.568 1.00 0.00 ATOM 1284 CD2 LEU 186 15.561 5.725 55.614 1.00 0.00 ATOM 1285 O LEU 186 11.606 3.543 56.282 1.00 0.00 ATOM 1286 C LEU 186 12.258 2.826 55.534 1.00 0.00 ATOM 1287 N GLU 187 11.733 1.764 54.941 1.00 0.00 ATOM 1288 CA GLU 187 10.300 1.463 55.089 1.00 0.00 ATOM 1289 CB GLU 187 9.918 0.196 54.342 1.00 0.00 ATOM 1290 CG GLU 187 10.111 0.334 52.819 1.00 0.00 ATOM 1291 CD GLU 187 9.745 -0.937 52.084 1.00 0.00 ATOM 1292 OE1 GLU 187 9.181 -1.848 52.749 1.00 0.00 ATOM 1293 OE2 GLU 187 10.018 -1.024 50.849 1.00 0.00 ATOM 1294 O GLU 187 8.746 1.888 56.850 1.00 0.00 ATOM 1295 C GLU 187 9.838 1.390 56.544 1.00 0.00 ATOM 1296 N SER 188 10.649 0.779 57.416 1.00 0.00 ATOM 1297 CA SER 188 10.303 0.615 58.835 1.00 0.00 ATOM 1298 CB SER 188 11.459 -0.088 59.575 1.00 0.00 ATOM 1299 OG SER 188 12.657 0.697 59.445 1.00 0.00 ATOM 1300 O SER 188 9.478 1.992 60.607 1.00 0.00 ATOM 1301 C SER 188 10.072 1.942 59.549 1.00 0.00 ATOM 1302 N GLU 189 10.562 3.024 58.989 1.00 0.00 ATOM 1303 CA GLU 189 10.413 4.304 59.653 1.00 0.00 ATOM 1304 CB GLU 189 11.789 4.964 59.864 1.00 0.00 ATOM 1305 CG GLU 189 12.549 5.438 58.713 1.00 0.00 ATOM 1306 CD GLU 189 13.998 5.784 59.124 1.00 0.00 ATOM 1307 OE1 GLU 189 14.656 4.912 59.752 1.00 0.00 ATOM 1308 OE2 GLU 189 14.475 6.908 58.802 1.00 0.00 ATOM 1309 O GLU 189 9.140 6.344 59.509 1.00 0.00 ATOM 1310 C GLU 189 9.384 5.246 59.026 1.00 0.00 ATOM 1311 N LEU 190 8.706 4.770 57.999 1.00 0.00 ATOM 1312 CA LEU 190 7.756 5.597 57.310 1.00 0.00 ATOM 1313 CB LEU 190 8.188 5.756 55.839 1.00 0.00 ATOM 1314 CG LEU 190 9.571 6.333 55.509 1.00 0.00 ATOM 1315 CD1 LEU 190 9.764 6.268 53.984 1.00 0.00 ATOM 1316 CD2 LEU 190 9.748 7.786 55.985 1.00 0.00 ATOM 1317 O LEU 190 6.155 3.874 57.775 1.00 0.00 ATOM 1318 C LEU 190 6.345 5.020 57.411 1.00 0.00 ATOM 1319 N ASN 191 5.358 5.847 57.107 1.00 0.00 ATOM 1320 CA ASN 191 3.955 5.380 57.013 1.00 0.00 ATOM 1321 CB ASN 191 2.998 6.575 57.041 1.00 0.00 ATOM 1322 CG ASN 191 1.518 6.136 57.016 1.00 0.00 ATOM 1323 ND2 ASN 191 0.930 6.028 58.179 1.00 0.00 ATOM 1324 OD1 ASN 191 0.934 5.934 55.977 1.00 0.00 ATOM 1325 O ASN 191 4.276 4.940 54.672 1.00 0.00 ATOM 1326 C ASN 191 3.773 4.554 55.736 1.00 0.00 ATOM 1327 N PRO 192 3.076 3.397 55.830 1.00 0.00 ATOM 1328 CA PRO 192 2.989 2.538 54.645 1.00 0.00 ATOM 1329 CB PRO 192 2.075 1.381 55.109 1.00 0.00 ATOM 1330 CG PRO 192 1.499 1.829 56.397 1.00 0.00 ATOM 1331 CD PRO 192 2.433 2.773 56.999 1.00 0.00 ATOM 1332 O PRO 192 2.851 2.791 52.293 1.00 0.00 ATOM 1333 C PRO 192 2.431 3.150 53.385 1.00 0.00 ATOM 1334 N VAL 193 1.418 3.998 53.533 1.00 0.00 ATOM 1335 CA VAL 193 0.804 4.640 52.389 1.00 0.00 ATOM 1336 CB VAL 193 -0.519 5.360 52.826 1.00 0.00 ATOM 1337 CG1 VAL 193 -1.112 6.169 51.705 1.00 0.00 ATOM 1338 CG2 VAL 193 -1.560 4.320 53.303 1.00 0.00 ATOM 1339 O VAL 193 1.967 5.566 50.472 1.00 0.00 ATOM 1340 C VAL 193 1.843 5.547 51.719 1.00 0.00 ATOM 1341 N ASP 194 2.600 6.282 52.525 1.00 0.00 ATOM 1342 CA ASP 194 3.696 7.122 51.999 1.00 0.00 ATOM 1343 CB ASP 194 4.338 7.947 53.108 1.00 0.00 ATOM 1344 CG ASP 194 3.397 9.020 53.669 1.00 0.00 ATOM 1345 OD1 ASP 194 2.343 9.259 53.041 1.00 0.00 ATOM 1346 OD2 ASP 194 3.727 9.652 54.721 1.00 0.00 ATOM 1347 O ASP 194 5.316 6.712 50.268 1.00 0.00 ATOM 1348 C ASP 194 4.780 6.283 51.285 1.00 0.00 ATOM 1349 N VAL 195 5.101 5.100 51.819 1.00 0.00 ATOM 1350 CA VAL 195 6.063 4.208 51.209 1.00 0.00 ATOM 1351 CB VAL 195 6.308 2.911 52.048 1.00 0.00 ATOM 1352 CG1 VAL 195 7.153 1.878 51.270 1.00 0.00 ATOM 1353 CG2 VAL 195 7.042 3.222 53.349 1.00 0.00 ATOM 1354 O VAL 195 6.287 3.897 48.861 1.00 0.00 ATOM 1355 C VAL 195 5.555 3.817 49.827 1.00 0.00 ATOM 1356 N MET 196 4.294 3.402 49.739 1.00 0.00 ATOM 1357 CA MET 196 3.699 3.017 48.472 1.00 0.00 ATOM 1358 CB MET 196 2.256 2.509 48.693 1.00 0.00 ATOM 1359 CG MET 196 2.158 1.258 49.578 1.00 0.00 ATOM 1360 SD MET 196 3.396 -0.191 48.962 1.00 0.00 ATOM 1361 CE MET 196 4.926 0.329 49.781 1.00 0.00 ATOM 1362 O MET 196 3.988 4.040 46.331 1.00 0.00 ATOM 1363 C MET 196 3.702 4.207 47.485 1.00 0.00 ATOM 1364 N PHE 197 3.370 5.401 47.940 1.00 0.00 ATOM 1365 CA PHE 197 3.383 6.527 47.013 1.00 0.00 ATOM 1366 CB PHE 197 2.536 7.702 47.513 1.00 0.00 ATOM 1367 CG PHE 197 1.084 7.548 47.174 1.00 0.00 ATOM 1368 CD1 PHE 197 0.630 7.845 45.892 1.00 0.00 ATOM 1369 CD2 PHE 197 0.174 7.044 48.098 1.00 0.00 ATOM 1370 CE1 PHE 197 -0.714 7.654 45.565 1.00 0.00 ATOM 1371 CE2 PHE 197 -1.131 6.861 47.786 1.00 0.00 ATOM 1372 CZ PHE 197 -1.582 7.153 46.511 1.00 0.00 ATOM 1373 O PHE 197 4.950 7.591 45.534 1.00 0.00 ATOM 1374 C PHE 197 4.787 6.930 46.570 1.00 0.00 ATOM 1375 N LEU 198 5.790 6.582 47.358 1.00 0.00 ATOM 1376 CA LEU 198 7.191 6.785 46.940 1.00 0.00 ATOM 1377 CB LEU 198 8.108 6.733 48.108 1.00 0.00 ATOM 1378 CG LEU 198 8.061 7.955 49.032 1.00 0.00 ATOM 1379 CD1 LEU 198 8.708 7.661 50.375 1.00 0.00 ATOM 1380 CD2 LEU 198 8.729 9.128 48.422 1.00 0.00 ATOM 1381 O LEU 198 8.215 6.138 44.882 1.00 0.00 ATOM 1382 C LEU 198 7.573 5.769 45.861 1.00 0.00 ATOM 1383 N TYR 199 7.205 4.492 46.042 1.00 0.00 ATOM 1384 CA TYR 199 7.409 3.531 44.974 1.00 0.00 ATOM 1385 CB TYR 199 6.970 2.110 45.386 1.00 0.00 ATOM 1386 CG TYR 199 8.000 1.451 46.267 1.00 0.00 ATOM 1387 CD1 TYR 199 9.218 1.072 45.742 1.00 0.00 ATOM 1388 CD2 TYR 199 7.767 1.223 47.629 1.00 0.00 ATOM 1389 CE1 TYR 199 10.208 0.469 46.550 1.00 0.00 ATOM 1390 CE2 TYR 199 8.718 0.604 48.412 1.00 0.00 ATOM 1391 CZ TYR 199 9.941 0.235 47.858 1.00 0.00 ATOM 1392 OH TYR 199 10.900 -0.348 48.631 1.00 0.00 ATOM 1393 O TYR 199 7.222 3.789 42.652 1.00 0.00 ATOM 1394 C TYR 199 6.678 3.939 43.723 1.00 0.00 ATOM 1395 N LYS 200 5.424 4.377 43.825 1.00 0.00 ATOM 1396 CA LYS 200 4.667 4.828 42.626 1.00 0.00 ATOM 1397 CB LYS 200 3.229 5.267 42.945 1.00 0.00 ATOM 1398 CG LYS 200 2.185 4.139 42.944 1.00 0.00 ATOM 1399 CD LYS 200 0.895 4.525 43.732 1.00 0.00 ATOM 1400 O LYS 200 5.372 6.050 40.717 1.00 0.00 ATOM 1401 C LYS 200 5.354 5.988 41.926 1.00 0.00 ATOM 1402 N THR 201 5.925 6.910 42.679 1.00 0.00 ATOM 1403 CA THR 201 6.620 8.060 42.079 1.00 0.00 ATOM 1404 CB THR 201 6.959 9.113 43.145 1.00 0.00 ATOM 1405 CG2 THR 201 7.677 10.320 42.556 1.00 0.00 ATOM 1406 OG1 THR 201 5.750 9.584 43.735 1.00 0.00 ATOM 1407 O THR 201 8.154 8.035 40.235 1.00 0.00 ATOM 1408 C THR 201 7.884 7.594 41.328 1.00 0.00 ATOM 1409 N ILE 202 8.639 6.661 41.892 1.00 0.00 ATOM 1410 CA ILE 202 9.808 6.135 41.202 1.00 0.00 ATOM 1411 CB ILE 202 10.518 5.165 42.106 1.00 0.00 ATOM 1412 CG1 ILE 202 11.079 5.946 43.294 1.00 0.00 ATOM 1413 CG2 ILE 202 11.630 4.402 41.372 1.00 0.00 ATOM 1414 CD1 ILE 202 11.612 5.093 44.383 1.00 0.00 ATOM 1415 O ILE 202 9.964 5.671 38.873 1.00 0.00 ATOM 1416 C ILE 202 9.358 5.470 39.895 1.00 0.00 ATOM 1417 N GLU 203 8.278 4.693 39.956 1.00 0.00 ATOM 1418 CA GLU 203 7.721 4.031 38.808 1.00 0.00 ATOM 1419 CB GLU 203 6.498 3.204 39.240 1.00 0.00 ATOM 1420 CG GLU 203 5.779 2.471 38.115 1.00 0.00 ATOM 1421 CD GLU 203 4.323 2.006 38.460 1.00 0.00 ATOM 1422 OE1 GLU 203 3.857 2.107 39.623 1.00 0.00 ATOM 1423 OE2 GLU 203 3.633 1.540 37.529 1.00 0.00 ATOM 1424 O GLU 203 7.634 4.825 36.564 1.00 0.00 ATOM 1425 C GLU 203 7.305 5.014 37.732 1.00 0.00 ATOM 1426 N TRP 204 6.542 6.040 38.117 1.00 0.00 ATOM 1427 CA TRP 204 6.094 7.053 37.199 1.00 0.00 ATOM 1428 CB TRP 204 5.214 8.107 37.853 1.00 0.00 ATOM 1429 CG TRP 204 3.879 7.635 38.314 1.00 0.00 ATOM 1430 CD1 TRP 204 3.099 6.643 37.755 1.00 0.00 ATOM 1431 CD2 TRP 204 3.129 8.155 39.422 1.00 0.00 ATOM 1432 CE2 TRP 204 1.916 7.435 39.482 1.00 0.00 ATOM 1433 CE3 TRP 204 3.361 9.171 40.364 1.00 0.00 ATOM 1434 NE1 TRP 204 1.928 6.516 38.463 1.00 0.00 ATOM 1435 CZ2 TRP 204 0.940 7.699 40.445 1.00 0.00 ATOM 1436 CZ3 TRP 204 2.395 9.423 41.330 1.00 0.00 ATOM 1437 CH2 TRP 204 1.193 8.684 41.357 1.00 0.00 ATOM 1438 O TRP 204 7.178 8.011 35.327 1.00 0.00 ATOM 1439 C TRP 204 7.242 7.772 36.515 1.00 0.00 ATOM 1440 N VAL 205 8.288 8.101 37.254 1.00 0.00 ATOM 1441 CA VAL 205 9.429 8.748 36.665 1.00 0.00 ATOM 1442 CB VAL 205 10.421 9.218 37.738 1.00 0.00 ATOM 1443 CG1 VAL 205 11.736 9.693 37.138 1.00 0.00 ATOM 1444 CG2 VAL 205 9.768 10.390 38.520 1.00 0.00 ATOM 1445 O VAL 205 10.375 8.333 34.514 1.00 0.00 ATOM 1446 C VAL 205 10.054 7.852 35.607 1.00 0.00 ATOM 1447 N GLY 206 10.215 6.569 35.934 1.00 0.00 ATOM 1448 CA GLY 206 10.710 5.558 35.035 1.00 0.00 ATOM 1449 O GLY 206 10.421 5.237 32.714 1.00 0.00 ATOM 1450 C GLY 206 9.878 5.449 33.771 1.00 0.00 ATOM 1451 N GLY 207 8.562 5.619 33.901 1.00 0.00 ATOM 1452 CA GLY 207 7.614 5.698 32.776 1.00 0.00 ATOM 1453 O GLY 207 7.641 6.610 30.566 1.00 0.00 ATOM 1454 C GLY 207 7.917 6.781 31.756 1.00 0.00 ATOM 1455 N LEU 208 8.537 7.878 32.177 1.00 0.00 ATOM 1456 CA LEU 208 8.955 8.911 31.211 1.00 0.00 ATOM 1457 CB LEU 208 9.594 10.089 31.921 1.00 0.00 ATOM 1458 CG LEU 208 8.730 10.951 32.855 1.00 0.00 ATOM 1459 CD1 LEU 208 9.635 11.826 33.703 1.00 0.00 ATOM 1460 CD2 LEU 208 7.774 11.802 32.062 1.00 0.00 ATOM 1461 O LEU 208 9.888 8.614 29.027 1.00 0.00 ATOM 1462 C LEU 208 9.959 8.350 30.225 1.00 0.00 ATOM 1463 N ALA 209 10.920 7.600 30.732 1.00 0.00 ATOM 1464 CA ALA 209 11.928 6.960 29.891 1.00 0.00 ATOM 1465 CB ALA 209 13.025 6.444 30.731 1.00 0.00 ATOM 1466 O ALA 209 11.662 5.669 27.882 1.00 0.00 ATOM 1467 C ALA 209 11.296 5.847 29.048 1.00 0.00 ATOM 1468 N ASP 210 10.323 5.119 29.596 1.00 0.00 ATOM 1469 CA ASP 210 9.627 4.127 28.785 1.00 0.00 ATOM 1470 CB ASP 210 8.570 3.363 29.589 1.00 0.00 ATOM 1471 CG ASP 210 9.186 2.417 30.662 1.00 0.00 ATOM 1472 OD1 ASP 210 10.426 2.237 30.689 1.00 0.00 ATOM 1473 OD2 ASP 210 8.412 1.858 31.480 1.00 0.00 ATOM 1474 O ASP 210 8.958 4.201 26.519 1.00 0.00 ATOM 1475 C ASP 210 8.925 4.753 27.613 1.00 0.00 ATOM 1476 N LEU 211 8.277 5.895 27.850 1.00 0.00 ATOM 1477 CA LEU 211 7.517 6.598 26.810 1.00 0.00 ATOM 1478 CB LEU 211 6.647 7.692 27.434 1.00 0.00 ATOM 1479 CG LEU 211 5.532 7.167 28.324 1.00 0.00 ATOM 1480 CD1 LEU 211 4.948 8.237 29.207 1.00 0.00 ATOM 1481 CD2 LEU 211 4.419 6.480 27.512 1.00 0.00 ATOM 1482 O LEU 211 8.181 7.089 24.554 1.00 0.00 ATOM 1483 C LEU 211 8.465 7.158 25.741 1.00 0.00 ATOM 1484 N ALA 212 9.592 7.699 26.166 1.00 0.00 ATOM 1485 CA ALA 212 10.594 8.201 25.246 1.00 0.00 ATOM 1486 CB ALA 212 11.738 8.835 26.009 1.00 0.00 ATOM 1487 O ALA 212 11.329 7.302 23.109 1.00 0.00 ATOM 1488 C ALA 212 11.112 7.075 24.314 1.00 0.00 ATOM 1489 N GLU 213 11.262 5.874 24.849 1.00 0.00 ATOM 1490 CA GLU 213 11.706 4.719 24.042 1.00 0.00 ATOM 1491 CB GLU 213 11.961 3.507 24.929 1.00 0.00 ATOM 1492 CG GLU 213 12.573 2.297 24.251 1.00 0.00 ATOM 1493 O GLU 213 11.024 4.082 21.812 1.00 0.00 ATOM 1494 C GLU 213 10.666 4.410 22.947 1.00 0.00 ATOM 1495 N ARG 214 9.384 4.566 23.266 1.00 0.00 ATOM 1496 CA ARG 214 8.333 4.303 22.295 1.00 0.00 ATOM 1497 CB ARG 214 6.970 4.231 22.982 1.00 0.00 ATOM 1498 CG ARG 214 6.774 3.001 23.901 1.00 0.00 ATOM 1499 CD ARG 214 5.456 3.076 24.770 1.00 0.00 ATOM 1500 O ARG 214 8.078 5.075 20.025 1.00 0.00 ATOM 1501 C ARG 214 8.392 5.365 21.162 1.00 0.00 ATOM 1502 N VAL 215 8.879 6.570 21.451 1.00 0.00 ATOM 1503 CA VAL 215 9.067 7.561 20.400 1.00 0.00 ATOM 1504 CB VAL 215 9.431 9.003 20.965 1.00 0.00 ATOM 1505 CG1 VAL 215 9.667 9.985 19.880 1.00 0.00 ATOM 1506 CG2 VAL 215 8.284 9.579 21.844 1.00 0.00 ATOM 1507 O VAL 215 9.879 7.085 18.160 1.00 0.00 ATOM 1508 C VAL 215 10.108 7.054 19.383 1.00 0.00 ATOM 1509 N GLY 216 11.227 6.555 19.861 1.00 0.00 ATOM 1510 CA GLY 216 12.276 6.072 18.954 1.00 0.00 ATOM 1511 O GLY 216 12.227 4.675 17.023 1.00 0.00 ATOM 1512 C GLY 216 11.822 4.835 18.184 1.00 0.00 ATOM 1513 N SER 217 10.981 3.986 18.807 1.00 0.00 ATOM 1514 CA SER 217 10.415 2.832 18.144 1.00 0.00 ATOM 1515 CB SER 217 9.589 1.955 19.101 1.00 0.00 ATOM 1516 OG SER 217 10.487 1.316 19.972 1.00 0.00 ATOM 1517 O SER 217 9.546 2.562 15.965 1.00 0.00 ATOM 1518 C SER 217 9.534 3.234 16.987 1.00 0.00 ATOM 1519 N ARG 218 8.700 4.253 17.184 1.00 0.00 ATOM 1520 CA ARG 218 7.880 4.725 16.079 1.00 0.00 ATOM 1521 CB ARG 218 6.850 5.765 16.493 1.00 0.00 ATOM 1522 CG ARG 218 6.031 6.403 15.273 1.00 0.00 ATOM 1523 CD ARG 218 5.220 5.449 14.366 1.00 0.00 ATOM 1524 NE ARG 218 4.460 4.496 15.188 1.00 0.00 ATOM 1525 CZ ARG 218 3.678 3.532 14.693 1.00 0.00 ATOM 1526 NH1 ARG 218 3.494 3.400 13.381 1.00 0.00 ATOM 1527 NH2 ARG 218 3.076 2.691 15.510 1.00 0.00 ATOM 1528 O ARG 218 8.402 4.999 13.781 1.00 0.00 ATOM 1529 C ARG 218 8.727 5.251 14.933 1.00 0.00 ATOM 1530 N LEU 219 9.829 5.952 15.226 1.00 0.00 ATOM 1531 CA LEU 219 10.715 6.408 14.156 1.00 0.00 ATOM 1532 CB LEU 219 11.860 7.289 14.640 1.00 0.00 ATOM 1533 CG LEU 219 11.640 8.767 14.857 1.00 0.00 ATOM 1534 CD1 LEU 219 10.762 8.996 16.035 1.00 0.00 ATOM 1535 CD2 LEU 219 13.016 9.383 15.079 1.00 0.00 ATOM 1536 O LEU 219 11.577 5.327 12.205 1.00 0.00 ATOM 1537 C LEU 219 11.366 5.265 13.439 1.00 0.00 ATOM 1538 N GLU 220 11.730 4.236 14.192 1.00 0.00 ATOM 1539 CA GLU 220 12.346 3.079 13.576 1.00 0.00 ATOM 1540 CB GLU 220 12.905 2.136 14.625 1.00 0.00 ATOM 1541 CG GLU 220 13.444 0.830 14.103 1.00 0.00 ATOM 1542 CD GLU 220 14.039 -0.018 15.230 1.00 0.00 ATOM 1543 OE1 GLU 220 13.820 0.331 16.402 1.00 0.00 ATOM 1544 OE2 GLU 220 14.747 -0.989 14.929 1.00 0.00 ATOM 1545 O GLU 220 11.737 2.013 11.521 1.00 0.00 ATOM 1546 C GLU 220 11.350 2.414 12.617 1.00 0.00 ATOM 1547 N LEU 221 10.077 2.346 12.987 1.00 0.00 ATOM 1548 CA LEU 221 9.059 1.773 12.091 1.00 0.00 ATOM 1549 CB LEU 221 7.689 1.718 12.758 1.00 0.00 ATOM 1550 CG LEU 221 7.502 0.605 13.788 1.00 0.00 ATOM 1551 CD1 LEU 221 6.151 0.760 14.476 1.00 0.00 ATOM 1552 CD2 LEU 221 7.624 -0.769 13.169 1.00 0.00 ATOM 1553 O LEU 221 8.737 1.979 9.723 1.00 0.00 ATOM 1554 C LEU 221 8.910 2.547 10.801 1.00 0.00 ATOM 1555 N MET 222 8.981 3.859 10.906 1.00 0.00 ATOM 1556 CA MET 222 8.904 4.710 9.712 1.00 0.00 ATOM 1557 CB MET 222 8.897 6.192 10.075 1.00 0.00 ATOM 1558 CG MET 222 7.680 6.596 10.843 1.00 0.00 ATOM 1559 SD MET 222 7.726 8.436 11.554 1.00 0.00 ATOM 1560 CE MET 222 8.096 9.218 10.019 1.00 0.00 ATOM 1561 O MET 222 9.895 4.379 7.583 1.00 0.00 ATOM 1562 C MET 222 10.078 4.460 8.788 1.00 0.00 ATOM 1563 N LEU 223 11.287 4.362 9.343 1.00 0.00 ATOM 1564 CA LEU 223 12.451 4.087 8.527 1.00 0.00 ATOM 1565 CB LEU 223 13.760 4.239 9.325 1.00 0.00 ATOM 1566 CG LEU 223 13.978 5.659 9.858 1.00 0.00 ATOM 1567 CD1 LEU 223 15.092 5.778 10.865 1.00 0.00 ATOM 1568 CD2 LEU 223 14.228 6.581 8.693 1.00 0.00 ATOM 1569 O LEU 223 12.922 2.536 6.813 1.00 0.00 ATOM 1570 C LEU 223 12.363 2.715 7.888 1.00 0.00 ATOM 1571 N ALA 224 11.678 1.757 8.520 1.00 0.00 ATOM 1572 CA ALA 224 11.556 0.421 7.938 1.00 0.00 ATOM 1573 CB ALA 224 11.084 -0.607 8.984 1.00 0.00 ATOM 1574 O ALA 224 10.686 -0.560 5.988 1.00 0.00 ATOM 1575 C ALA 224 10.644 0.400 6.744 1.00 0.00 ATOM 1576 N ARG 225 9.790 1.415 6.561 1.00 0.00 ATOM 1577 CA ARG 225 8.898 1.413 5.384 1.00 0.00 ATOM 1578 CB ARG 225 7.696 2.329 5.536 1.00 0.00 ATOM 1579 CG ARG 225 6.774 1.875 6.571 1.00 0.00 ATOM 1580 CD ARG 225 5.462 2.678 6.591 1.00 0.00 ATOM 1581 NE ARG 225 4.972 2.698 7.977 1.00 0.00 ATOM 1582 CZ ARG 225 4.171 1.787 8.520 1.00 0.00 ATOM 1583 NH1 ARG 225 3.722 0.777 7.793 1.00 0.00 ATOM 1584 NH2 ARG 225 3.817 1.887 9.811 1.00 0.00 ATOM 1585 O ARG 225 8.974 1.700 3.032 1.00 0.00 ATOM 1586 C ARG 225 9.599 1.756 4.073 1.00 0.00 ATOM 1587 N VAL 226 10.881 2.112 4.126 1.00 0.00 ATOM 1588 CA VAL 226 11.700 2.420 2.929 1.00 0.00 ATOM 1589 CB VAL 226 10.954 2.164 1.588 1.00 0.00 ATOM 1590 O VAL 226 12.092 4.611 3.896 1.00 0.00 ATOM 1591 C VAL 226 12.220 3.867 2.914 1.00 0.00 ENDMDL # command:# Prefix for output files set to decoys/ # command:# request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1478561357.pdb -s /var/tmp/to_scwrl_1478561357.seq -o /var/tmp/from_scwrl_1478561357.pdb > /var/tmp/scwrl_1478561357.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1478561357.pdb # conformation set from SCWRL output # command:# naming current conformation model1-scwrl # command:# ReadConformPDB reading from PDB file model2.ts-submitted looking for model 1 # Found a chain break before 110 # copying to AlignedFragments data structure # command:Warning: Couldn't open file decoys/model2.gdt for output # fraction of real conformation used = 1.000 # GDT_score = -24.038 # GDT_score(maxd=8.000,maxw=2.900)= -24.310 # GDT_score(maxd=8.000,maxw=3.200)= -23.352 # GDT_score(maxd=8.000,maxw=3.500)= -22.314 # GDT_score(maxd=10.000,maxw=3.800)= -23.472 # GDT_score(maxd=10.000,maxw=4.000)= -22.780 # GDT_score(maxd=10.000,maxw=4.200)= -22.123 # GDT_score(maxd=12.000,maxw=4.300)= -23.622 # GDT_score(maxd=12.000,maxw=4.500)= -22.967 # GDT_score(maxd=12.000,maxw=4.700)= -22.327 # GDT_score(maxd=14.000,maxw=5.200)= -22.347 # GDT_score(maxd=14.000,maxw=5.500)= -21.465 # command:# request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1665297456.pdb -s /var/tmp/to_scwrl_1665297456.seq -o /var/tmp/from_scwrl_1665297456.pdb > /var/tmp/scwrl_1665297456.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1665297456.pdb # conformation set from SCWRL output # command:# naming current conformation model2-scwrl # command:# ReadConformPDB reading from PDB file model3.ts-submitted looking for model 1 # Found a chain break before 164 # copying to AlignedFragments data structure # command:Warning: Couldn't open file decoys/model3.gdt for output # fraction of real conformation used = 1.000 # GDT_score = -51.322 # GDT_score(maxd=8.000,maxw=2.900)= -48.812 # GDT_score(maxd=8.000,maxw=3.200)= -45.633 # GDT_score(maxd=8.000,maxw=3.500)= -42.756 # GDT_score(maxd=10.000,maxw=3.800)= -47.552 # GDT_score(maxd=10.000,maxw=4.000)= -45.699 # GDT_score(maxd=10.000,maxw=4.200)= -43.973 # GDT_score(maxd=12.000,maxw=4.300)= -48.664 # GDT_score(maxd=12.000,maxw=4.500)= -46.913 # GDT_score(maxd=12.000,maxw=4.700)= -45.281 # GDT_score(maxd=14.000,maxw=5.200)= -45.623 # GDT_score(maxd=14.000,maxw=5.500)= -43.528 # command:# request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_425197206.pdb -s /var/tmp/to_scwrl_425197206.seq -o /var/tmp/from_scwrl_425197206.pdb > /var/tmp/scwrl_425197206.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_425197206.pdb # conformation set from SCWRL output # command:# naming current conformation model3-scwrl # command:# ReadConformPDB reading from PDB file model4.ts-submitted looking for model 1 # Found a chain break before 198 # copying to AlignedFragments data structure # command:Warning: Couldn't open file decoys/model4.gdt for output # fraction of real conformation used = 1.000 # GDT_score = -58.774 # GDT_score(maxd=8.000,maxw=2.900)= -60.423 # GDT_score(maxd=8.000,maxw=3.200)= -56.104 # GDT_score(maxd=8.000,maxw=3.500)= -52.290 # GDT_score(maxd=10.000,maxw=3.800)= -56.568 # GDT_score(maxd=10.000,maxw=4.000)= -54.233 # GDT_score(maxd=10.000,maxw=4.200)= -52.086 # GDT_score(maxd=12.000,maxw=4.300)= -56.645 # GDT_score(maxd=12.000,maxw=4.500)= -54.530 # GDT_score(maxd=12.000,maxw=4.700)= -52.555 # GDT_score(maxd=14.000,maxw=5.200)= -52.150 # GDT_score(maxd=14.000,maxw=5.500)= -49.651 # command:# request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1284393787.pdb -s /var/tmp/to_scwrl_1284393787.seq -o /var/tmp/from_scwrl_1284393787.pdb > /var/tmp/scwrl_1284393787.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1284393787.pdb # conformation set from SCWRL output # command:# naming current conformation model4-scwrl # command:# ReadConformPDB reading from PDB file model5.ts-submitted looking for model 1 # Found a chain break before 201 # copying to AlignedFragments data structure # command:Warning: Couldn't open file decoys/model5.gdt for output # fraction of real conformation used = 1.000 # GDT_score = -44.712 # GDT_score(maxd=8.000,maxw=2.900)= -42.351 # GDT_score(maxd=8.000,maxw=3.200)= -39.491 # GDT_score(maxd=8.000,maxw=3.500)= -36.937 # GDT_score(maxd=10.000,maxw=3.800)= -41.999 # GDT_score(maxd=10.000,maxw=4.000)= -40.337 # GDT_score(maxd=10.000,maxw=4.200)= -38.795 # GDT_score(maxd=12.000,maxw=4.300)= -43.688 # GDT_score(maxd=12.000,maxw=4.500)= -42.093 # GDT_score(maxd=12.000,maxw=4.700)= -40.629 # GDT_score(maxd=14.000,maxw=5.200)= -41.406 # GDT_score(maxd=14.000,maxw=5.500)= -39.514 # command:# request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1957974322.pdb -s /var/tmp/to_scwrl_1957974322.seq -o /var/tmp/from_scwrl_1957974322.pdb > /var/tmp/scwrl_1957974322.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1957974322.pdb # conformation set from SCWRL output # command:# naming current conformation model5-scwrl # command:# Prefix for input files set to decoys/ # command:# ReadConformPDB reading from PDB file T0365.try1-opt2.pdb looking for model 1 # Found a chain break before 189 # copying to AlignedFragments data structure # command:Warning: Couldn't open file decoys/try1.gdt for output # fraction of real conformation used = 1.000 # GDT_score = -23.918 # GDT_score(maxd=8.000,maxw=2.900)= -24.130 # GDT_score(maxd=8.000,maxw=3.200)= -23.189 # GDT_score(maxd=8.000,maxw=3.500)= -22.130 # GDT_score(maxd=10.000,maxw=3.800)= -23.298 # GDT_score(maxd=10.000,maxw=4.000)= -22.614 # GDT_score(maxd=10.000,maxw=4.200)= -21.953 # GDT_score(maxd=12.000,maxw=4.300)= -23.478 # GDT_score(maxd=12.000,maxw=4.500)= -22.811 # GDT_score(maxd=12.000,maxw=4.700)= -22.152 # GDT_score(maxd=14.000,maxw=5.200)= -22.183 # GDT_score(maxd=14.000,maxw=5.500)= -21.321 # command:# Prefix for output files set to # command:Warning: Couldn't open file T0365.try1-real.pdb for output Error: Couldn't open file T0365.try1-real.pdb for output superimposing iter= 0 total_weight= 2423.000 rmsd (weighted)= 23.049 (unweighted)= 26.799 superimposing iter= 1 total_weight= 4652.502 rmsd (weighted)= 12.260 (unweighted)= 26.736 superimposing iter= 2 total_weight= 3633.109 rmsd (weighted)= 7.640 (unweighted)= 26.971 superimposing iter= 3 total_weight= 2976.412 rmsd (weighted)= 5.351 (unweighted)= 27.214 superimposing iter= 4 total_weight= 2555.025 rmsd (weighted)= 4.076 (unweighted)= 27.352 superimposing iter= 5 total_weight= 2252.421 rmsd (weighted)= 3.320 (unweighted)= 27.442 EXPDTA T0365.try1-opt2.pdb MODEL 1 REMARK 44 REMARK 44 model 1 is called T0365.try1-opt2.pdb ATOM 1 N MET A 1 7.541 23.303 38.829 1.00 0.00 ATOM 2 CA MET A 1 7.541 21.956 39.383 1.00 0.00 ATOM 3 CB MET A 1 7.456 22.006 40.910 1.00 0.00 ATOM 4 CG MET A 1 8.639 22.689 41.575 1.00 0.00 ATOM 5 SD MET A 1 10.192 21.811 41.308 1.00 0.00 ATOM 6 CE MET A 1 11.365 22.981 41.986 1.00 0.00 ATOM 7 O MET A 1 5.266 21.691 38.607 1.00 0.00 ATOM 8 C MET A 1 6.343 21.148 38.862 1.00 0.00 ATOM 9 N PRO A 2 6.542 19.831 38.771 1.00 0.00 ATOM 10 CA PRO A 2 5.462 18.950 38.310 1.00 0.00 ATOM 11 CB PRO A 2 6.054 17.555 38.481 1.00 0.00 ATOM 12 CG PRO A 2 7.515 17.784 38.236 1.00 0.00 ATOM 13 CD PRO A 2 7.778 19.065 39.006 1.00 0.00 ATOM 14 O PRO A 2 4.302 19.335 40.370 1.00 0.00 ATOM 15 C PRO A 2 4.211 19.150 39.157 1.00 0.00 ATOM 16 N VAL A 3 3.044 19.106 38.524 1.00 0.00 ATOM 17 CA VAL A 3 1.809 19.312 39.259 1.00 0.00 ATOM 18 CB VAL A 3 0.606 19.298 38.216 1.00 0.00 ATOM 19 CG1 VAL A 3 -0.758 19.395 38.922 1.00 0.00 ATOM 20 CG2 VAL A 3 0.729 20.501 37.261 1.00 0.00 ATOM 21 O VAL A 3 1.132 18.757 41.484 1.00 0.00 ATOM 22 C VAL A 3 1.606 18.341 40.422 1.00 0.00 ATOM 23 N ASN A 4 1.986 17.073 40.269 1.00 0.00 ATOM 24 CA ASN A 4 1.791 16.171 41.395 1.00 0.00 ATOM 25 CB ASN A 4 1.980 14.677 41.013 1.00 0.00 ATOM 26 CG ASN A 4 3.293 14.371 40.290 1.00 0.00 ATOM 27 ND2 ASN A 4 3.527 13.080 40.059 1.00 0.00 ATOM 28 OD1 ASN A 4 4.069 15.258 39.930 1.00 0.00 ATOM 29 O ASN A 4 2.233 16.546 43.721 1.00 0.00 ATOM 30 C ASN A 4 2.674 16.591 42.570 1.00 0.00 ATOM 31 N SER A 5 3.925 17.123 42.308 1.00 0.00 ATOM 32 CA SER A 5 4.791 17.617 43.362 1.00 0.00 ATOM 33 CB SER A 5 6.152 18.024 42.793 1.00 0.00 ATOM 34 OG SER A 5 6.028 19.136 41.921 1.00 0.00 ATOM 35 O SER A 5 4.267 19.053 45.210 1.00 0.00 ATOM 36 C SER A 5 4.135 18.830 44.010 1.00 0.00 ATOM 37 N ILE A 6 3.618 19.885 43.111 1.00 0.00 ATOM 38 CA ILE A 6 2.972 21.094 43.575 1.00 0.00 ATOM 39 CB ILE A 6 2.551 21.978 42.365 1.00 0.00 ATOM 40 CG1 ILE A 6 3.780 22.316 41.522 1.00 0.00 ATOM 41 CG2 ILE A 6 1.884 23.265 42.856 1.00 0.00 ATOM 42 CD1 ILE A 6 3.464 23.024 40.215 1.00 0.00 ATOM 43 O ILE A 6 1.695 21.369 45.587 1.00 0.00 ATOM 44 C ILE A 6 1.842 20.745 44.535 1.00 0.00 ATOM 45 N LEU A 7 1.064 19.722 44.188 1.00 0.00 ATOM 46 CA LEU A 7 -0.047 19.298 45.028 1.00 0.00 ATOM 47 CB LEU A 7 -0.812 18.162 44.346 1.00 0.00 ATOM 48 CG LEU A 7 -1.944 17.505 45.139 1.00 0.00 ATOM 49 CD1 LEU A 7 -3.008 18.531 45.497 1.00 0.00 ATOM 50 CD2 LEU A 7 -2.534 16.374 44.303 1.00 0.00 ATOM 51 O LEU A 7 -0.049 19.147 47.424 1.00 0.00 ATOM 52 C LEU A 7 0.500 18.828 46.369 1.00 0.00 ATOM 53 N GLY A 8 1.546 18.124 46.316 1.00 0.00 ATOM 54 CA GLY A 8 2.201 17.640 47.518 1.00 0.00 ATOM 55 O GLY A 8 2.527 18.731 49.627 1.00 0.00 ATOM 56 C GLY A 8 2.664 18.782 48.402 1.00 0.00 ATOM 57 N VAL A 9 3.271 19.792 47.785 1.00 0.00 ATOM 58 CA VAL A 9 3.752 20.953 48.519 1.00 0.00 ATOM 59 CB VAL A 9 4.498 21.930 47.577 1.00 0.00 ATOM 60 CG1 VAL A 9 4.912 23.191 48.331 1.00 0.00 ATOM 61 CG2 VAL A 9 5.720 21.241 47.006 1.00 0.00 ATOM 62 O VAL A 9 2.677 22.072 50.352 1.00 0.00 ATOM 63 C VAL A 9 2.577 21.660 49.195 1.00 0.00 ATOM 64 N PHE A 10 1.458 21.789 48.486 1.00 0.00 ATOM 65 CA PHE A 10 0.284 22.431 49.068 1.00 0.00 ATOM 66 CB PHE A 10 -0.844 22.517 48.106 1.00 0.00 ATOM 67 CG PHE A 10 -2.074 23.224 48.622 1.00 0.00 ATOM 68 CD1 PHE A 10 -2.212 24.602 48.495 1.00 0.00 ATOM 69 CD2 PHE A 10 -3.105 22.513 49.206 1.00 0.00 ATOM 70 CE1 PHE A 10 -3.334 25.246 48.943 1.00 0.00 ATOM 71 CE2 PHE A 10 -4.246 23.152 49.640 1.00 0.00 ATOM 72 CZ PHE A 10 -4.390 24.521 49.511 1.00 0.00 ATOM 73 O PHE A 10 -0.429 22.195 51.345 1.00 0.00 ATOM 74 C PHE A 10 -0.194 21.637 50.278 1.00 0.00 ATOM 75 N ALA A 11 -0.339 20.328 50.106 1.00 0.00 ATOM 76 CA ALA A 11 -0.804 19.478 51.196 1.00 0.00 ATOM 77 CB ALA A 11 -1.031 18.081 50.611 1.00 0.00 ATOM 78 O ALA A 11 -0.203 19.523 53.494 1.00 0.00 ATOM 79 C ALA A 11 0.194 19.502 52.356 1.00 0.00 ATOM 80 N LYS A 12 1.555 19.513 52.068 1.00 0.00 ATOM 81 CA LYS A 12 2.569 19.589 53.119 1.00 0.00 ATOM 82 CB LYS A 12 3.929 19.394 52.443 1.00 0.00 ATOM 83 CG LYS A 12 5.057 19.560 53.413 1.00 0.00 ATOM 84 CD LYS A 12 6.320 19.010 52.765 1.00 0.00 ATOM 85 CE LYS A 12 7.436 18.943 53.754 1.00 0.00 ATOM 86 NZ LYS A 12 7.072 17.964 54.797 1.00 0.00 ATOM 87 O LYS A 12 2.753 20.966 55.042 1.00 0.00 ATOM 88 C LYS A 12 2.611 20.933 53.830 1.00 0.00 ATOM 89 N SER A 13 2.460 22.026 53.089 1.00 0.00 ATOM 90 CA SER A 13 2.424 23.358 53.684 1.00 0.00 ATOM 91 CB SER A 13 3.824 23.973 53.733 1.00 0.00 ATOM 92 OG SER A 13 3.789 25.279 54.284 1.00 0.00 ATOM 93 O SER A 13 1.498 24.239 51.659 1.00 0.00 ATOM 94 C SER A 13 1.531 24.289 52.889 1.00 0.00 ATOM 95 N PRO A 14 0.790 25.159 53.590 1.00 0.00 ATOM 96 CA PRO A 14 -0.094 26.103 52.911 1.00 0.00 ATOM 97 CB PRO A 14 -0.862 26.776 54.049 1.00 0.00 ATOM 98 CG PRO A 14 0.012 26.600 55.246 1.00 0.00 ATOM 99 CD PRO A 14 0.702 25.277 55.066 1.00 0.00 ATOM 100 O PRO A 14 0.187 27.680 51.120 1.00 0.00 ATOM 101 C PRO A 14 0.698 27.127 52.095 1.00 0.00 ATOM 102 N ILE A 15 1.948 27.368 52.487 1.00 0.00 ATOM 103 CA ILE A 15 2.784 28.331 51.777 1.00 0.00 ATOM 104 CB ILE A 15 4.015 28.618 52.704 1.00 0.00 ATOM 105 CG1 ILE A 15 3.561 29.529 53.854 1.00 0.00 ATOM 106 CG2 ILE A 15 5.251 29.203 51.921 1.00 0.00 ATOM 107 CD1 ILE A 15 4.690 29.931 54.815 1.00 0.00 ATOM 108 O ILE A 15 3.353 28.442 49.456 1.00 0.00 ATOM 109 C ILE A 15 3.210 27.728 50.440 1.00 0.00 ATOM 110 N LYS A 16 2.392 31.918 48.688 1.00 0.00 ATOM 111 CA LYS A 16 3.562 32.478 48.015 1.00 0.00 ATOM 112 CB LYS A 16 4.272 33.487 48.921 1.00 0.00 ATOM 113 CG LYS A 16 5.503 34.122 48.298 1.00 0.00 ATOM 114 CD LYS A 16 6.134 35.140 49.235 1.00 0.00 ATOM 115 CE LYS A 16 7.375 35.762 48.619 1.00 0.00 ATOM 116 NZ LYS A 16 8.023 36.738 49.540 1.00 0.00 ATOM 117 O LYS A 16 4.935 31.295 46.463 1.00 0.00 ATOM 118 C LYS A 16 4.587 31.421 47.634 1.00 0.00 ATOM 119 N PRO A 17 5.084 30.674 48.617 1.00 0.00 ATOM 120 CA PRO A 17 6.069 29.641 48.324 1.00 0.00 ATOM 121 CB PRO A 17 6.315 28.970 49.676 1.00 0.00 ATOM 122 CG PRO A 17 6.030 30.037 50.680 1.00 0.00 ATOM 123 CD PRO A 17 4.858 30.810 50.146 1.00 0.00 ATOM 124 O PRO A 17 6.278 28.166 46.441 1.00 0.00 ATOM 125 C PRO A 17 5.529 28.650 47.297 1.00 0.00 ATOM 126 N LEU A 18 4.229 28.365 47.384 1.00 0.00 ATOM 127 CA LEU A 18 3.559 27.425 46.484 1.00 0.00 ATOM 128 CB LEU A 18 2.111 27.201 46.925 1.00 0.00 ATOM 129 CG LEU A 18 1.913 26.424 48.228 1.00 0.00 ATOM 130 CD1 LEU A 18 0.449 26.437 48.645 1.00 0.00 ATOM 131 CD2 LEU A 18 2.347 24.975 48.062 1.00 0.00 ATOM 132 O LEU A 18 3.988 27.264 44.136 1.00 0.00 ATOM 133 C LEU A 18 3.537 27.943 45.058 1.00 0.00 ATOM 134 N GLN A 19 3.089 29.187 44.849 1.00 0.00 ATOM 135 CA GLN A 19 3.077 29.748 43.511 1.00 0.00 ATOM 136 CB GLN A 19 2.524 31.174 43.532 1.00 0.00 ATOM 137 CG GLN A 19 1.034 31.259 43.815 1.00 0.00 ATOM 138 CD GLN A 19 0.544 32.689 43.941 1.00 0.00 ATOM 139 OE1 GLN A 19 1.335 33.630 43.906 1.00 0.00 ATOM 140 NE2 GLN A 19 -0.766 32.853 44.089 1.00 0.00 ATOM 141 O GLN A 19 4.657 29.580 41.716 1.00 0.00 ATOM 142 C GLN A 19 4.477 29.796 42.914 1.00 0.00 ATOM 143 N GLU A 20 5.471 30.059 43.754 1.00 0.00 ATOM 144 CA GLU A 20 6.850 30.141 43.286 1.00 0.00 ATOM 145 CB GLU A 20 7.796 30.441 44.450 1.00 0.00 ATOM 146 CG GLU A 20 7.673 31.854 45.000 1.00 0.00 ATOM 147 CD GLU A 20 8.533 32.077 46.228 1.00 0.00 ATOM 148 OE1 GLU A 20 9.169 31.106 46.692 1.00 0.00 ATOM 149 OE2 GLU A 20 8.572 33.221 46.726 1.00 0.00 ATOM 150 O GLU A 20 7.924 28.827 41.582 1.00 0.00 ATOM 151 C GLU A 20 7.293 28.825 42.641 1.00 0.00 ATOM 152 N HIS A 21 6.961 27.706 43.278 1.00 0.00 ATOM 153 CA HIS A 21 7.302 26.396 42.734 1.00 0.00 ATOM 154 CB HIS A 21 7.030 25.299 43.765 1.00 0.00 ATOM 155 CG HIS A 21 7.981 25.310 44.922 1.00 0.00 ATOM 156 CD2 HIS A 21 7.870 25.544 46.354 1.00 0.00 ATOM 157 ND1 HIS A 21 9.328 25.058 44.781 1.00 0.00 ATOM 158 CE1 HIS A 21 9.916 25.137 45.988 1.00 0.00 ATOM 159 NE2 HIS A 21 9.047 25.428 46.936 1.00 0.00 ATOM 160 O HIS A 21 6.979 25.543 40.507 1.00 0.00 ATOM 161 C HIS A 21 6.470 26.099 41.481 1.00 0.00 ATOM 162 N MET A 22 5.313 26.598 41.493 1.00 0.00 ATOM 163 CA MET A 22 4.429 26.372 40.364 1.00 0.00 ATOM 164 CB MET A 22 3.015 26.862 40.686 1.00 0.00 ATOM 165 CG MET A 22 2.023 26.684 39.547 1.00 0.00 ATOM 166 SD MET A 22 0.389 27.336 39.940 1.00 0.00 ATOM 167 CE MET A 22 0.704 29.099 39.875 1.00 0.00 ATOM 168 O MET A 22 4.785 26.551 37.995 1.00 0.00 ATOM 169 C MET A 22 4.858 27.102 39.094 1.00 0.00 ATOM 170 N ASP A 23 5.297 28.363 39.262 1.00 0.00 ATOM 171 CA ASP A 23 5.780 29.172 38.132 1.00 0.00 ATOM 172 CB ASP A 23 6.160 30.586 38.575 1.00 0.00 ATOM 173 CG ASP A 23 4.951 31.440 38.900 1.00 0.00 ATOM 174 OD1 ASP A 23 3.822 31.026 38.561 1.00 0.00 ATOM 175 OD2 ASP A 23 5.131 32.524 39.494 1.00 0.00 ATOM 176 O ASP A 23 7.131 28.550 36.245 1.00 0.00 ATOM 177 C ASP A 23 7.004 28.540 37.485 1.00 0.00 ATOM 178 N LYS A 24 7.905 27.976 38.291 1.00 0.00 ATOM 179 CA LYS A 24 9.080 27.306 37.764 1.00 0.00 ATOM 180 CB LYS A 24 9.955 26.785 38.905 1.00 0.00 ATOM 181 CG LYS A 24 10.657 27.876 39.698 1.00 0.00 ATOM 182 CD LYS A 24 11.502 27.289 40.818 1.00 0.00 ATOM 183 CE LYS A 24 12.199 28.380 41.615 1.00 0.00 ATOM 184 NZ LYS A 24 13.005 27.821 42.734 1.00 0.00 ATOM 185 O LYS A 24 9.240 25.785 35.888 1.00 0.00 ATOM 186 C LYS A 24 8.602 26.132 36.886 1.00 0.00 ATOM 187 N VAL A 25 7.471 25.536 37.255 1.00 0.00 ATOM 188 CA VAL A 25 6.922 24.417 36.499 1.00 0.00 ATOM 189 CB VAL A 25 5.646 23.822 37.066 1.00 0.00 ATOM 190 CG1 VAL A 25 4.434 24.748 36.976 1.00 0.00 ATOM 191 CG2 VAL A 25 5.376 22.504 36.389 1.00 0.00 ATOM 192 O VAL A 25 6.814 24.206 34.118 1.00 0.00 ATOM 193 C VAL A 25 6.554 24.900 35.094 1.00 0.00 ATOM 194 N TYR A 26 5.958 26.074 34.995 1.00 0.00 ATOM 195 CA TYR A 26 5.576 26.566 33.686 1.00 0.00 ATOM 196 CB TYR A 26 4.761 27.853 33.839 1.00 0.00 ATOM 197 CG TYR A 26 4.288 28.437 32.528 1.00 0.00 ATOM 198 CD1 TYR A 26 3.201 27.890 31.857 1.00 0.00 ATOM 199 CD2 TYR A 26 4.926 29.534 31.966 1.00 0.00 ATOM 200 CE1 TYR A 26 2.761 28.418 30.658 1.00 0.00 ATOM 201 CE2 TYR A 26 4.500 30.075 30.768 1.00 0.00 ATOM 202 CZ TYR A 26 3.408 29.506 30.115 1.00 0.00 ATOM 203 OH TYR A 26 2.970 30.034 28.921 1.00 0.00 ATOM 204 O TYR A 26 6.826 26.616 31.646 1.00 0.00 ATOM 205 C TYR A 26 6.808 26.863 32.852 1.00 0.00 ATOM 206 N ASP A 27 7.852 27.389 33.478 1.00 0.00 ATOM 207 CA ASP A 27 9.062 27.672 32.723 1.00 0.00 ATOM 208 CB ASP A 27 10.130 28.283 33.634 1.00 0.00 ATOM 209 CG ASP A 27 9.822 29.717 34.012 1.00 0.00 ATOM 210 OD1 ASP A 27 8.919 30.315 33.391 1.00 0.00 ATOM 211 OD2 ASP A 27 10.483 30.243 34.932 1.00 0.00 ATOM 212 O ASP A 27 9.948 26.325 30.929 1.00 0.00 ATOM 213 C ASP A 27 9.536 26.359 32.092 1.00 0.00 ATOM 214 N CYS A 28 9.479 25.279 32.874 1.00 0.00 ATOM 215 CA CYS A 28 9.898 23.967 32.386 1.00 0.00 ATOM 216 CB CYS A 28 9.868 22.917 33.498 1.00 0.00 ATOM 217 SG CYS A 28 11.121 23.149 34.779 1.00 0.00 ATOM 218 O CYS A 28 9.425 23.085 30.200 1.00 0.00 ATOM 219 C CYS A 28 8.969 23.528 31.250 1.00 0.00 ATOM 220 N ALA A 29 7.658 23.645 31.447 1.00 0.00 ATOM 221 CA ALA A 29 6.757 23.247 30.381 1.00 0.00 ATOM 222 CB ALA A 29 5.312 23.463 30.802 1.00 0.00 ATOM 223 O ALA A 29 6.908 23.587 27.988 1.00 0.00 ATOM 224 C ALA A 29 7.034 24.081 29.122 1.00 0.00 ATOM 225 N SER A 30 7.339 25.365 29.306 1.00 0.00 ATOM 226 CA SER A 30 7.613 26.228 28.155 1.00 0.00 ATOM 227 CB SER A 30 7.954 27.646 28.617 1.00 0.00 ATOM 228 OG SER A 30 6.837 28.264 29.231 1.00 0.00 ATOM 229 O SER A 30 8.787 25.646 26.131 1.00 0.00 ATOM 230 C SER A 30 8.785 25.657 27.370 1.00 0.00 ATOM 231 N LEU A 31 9.804 25.207 28.090 1.00 0.00 ATOM 232 CA LEU A 31 10.976 24.643 27.433 1.00 0.00 ATOM 233 CB LEU A 31 12.073 24.347 28.458 1.00 0.00 ATOM 234 CG LEU A 31 12.719 25.560 29.129 1.00 0.00 ATOM 235 CD1 LEU A 31 13.675 25.123 30.229 1.00 0.00 ATOM 236 CD2 LEU A 31 13.503 26.382 28.117 1.00 0.00 ATOM 237 O LEU A 31 11.251 23.035 25.663 1.00 0.00 ATOM 238 C LEU A 31 10.658 23.330 26.698 1.00 0.00 ATOM 239 N LEU A 32 9.736 22.543 27.245 1.00 0.00 ATOM 240 CA LEU A 32 9.333 21.285 26.620 1.00 0.00 ATOM 241 CB LEU A 32 8.317 20.551 27.498 1.00 0.00 ATOM 242 CG LEU A 32 8.849 19.978 28.814 1.00 0.00 ATOM 243 CD1 LEU A 32 7.709 19.440 29.666 1.00 0.00 ATOM 244 CD2 LEU A 32 9.824 18.840 28.552 1.00 0.00 ATOM 245 O LEU A 32 9.028 20.954 24.236 1.00 0.00 ATOM 246 C LEU A 32 8.709 21.590 25.243 1.00 0.00 ATOM 247 N VAL A 33 7.814 22.566 25.216 1.00 0.00 ATOM 248 CA VAL A 33 7.171 22.978 23.989 1.00 0.00 ATOM 249 CB VAL A 33 6.094 24.047 24.249 1.00 0.00 ATOM 250 CG1 VAL A 33 5.553 24.590 22.936 1.00 0.00 ATOM 251 CG2 VAL A 33 4.937 23.455 25.038 1.00 0.00 ATOM 252 O VAL A 33 8.251 23.185 21.845 1.00 0.00 ATOM 253 C VAL A 33 8.195 23.560 23.023 1.00 0.00 ATOM 254 N PRO A 34 9.027 24.461 23.526 1.00 0.00 ATOM 255 CA PRO A 34 10.042 25.084 22.682 1.00 0.00 ATOM 256 CB PRO A 34 10.710 26.065 23.675 1.00 0.00 ATOM 257 CG PRO A 34 9.570 26.445 24.562 1.00 0.00 ATOM 258 CD PRO A 34 8.913 25.103 24.823 1.00 0.00 ATOM 259 O PRO A 34 11.320 24.197 20.863 1.00 0.00 ATOM 260 C PRO A 34 10.973 24.061 22.035 1.00 0.00 ATOM 261 N PHE A 35 11.375 23.038 22.788 1.00 0.00 ATOM 262 CA PHE A 35 12.253 22.007 22.242 1.00 0.00 ATOM 263 CB PHE A 35 12.881 21.171 23.379 1.00 0.00 ATOM 264 CG PHE A 35 13.542 19.907 22.876 1.00 0.00 ATOM 265 CD1 PHE A 35 14.701 19.992 22.128 1.00 0.00 ATOM 266 CD2 PHE A 35 12.947 18.645 23.074 1.00 0.00 ATOM 267 CE1 PHE A 35 15.321 18.845 21.626 1.00 0.00 ATOM 268 CE2 PHE A 35 13.546 17.478 22.570 1.00 0.00 ATOM 269 CZ PHE A 35 14.731 17.573 21.832 1.00 0.00 ATOM 270 O PHE A 35 11.987 21.052 20.041 1.00 0.00 ATOM 271 C PHE A 35 11.470 21.301 21.125 1.00 0.00 ATOM 272 N PHE A 36 10.237 20.940 21.388 1.00 0.00 ATOM 273 CA PHE A 36 9.409 20.256 20.381 1.00 0.00 ATOM 274 CB PHE A 36 7.849 20.712 20.759 1.00 0.00 ATOM 275 CG PHE A 36 6.708 19.881 20.260 1.00 0.00 ATOM 276 CD1 PHE A 36 6.065 18.972 21.102 1.00 0.00 ATOM 277 CD2 PHE A 36 6.253 20.017 18.945 1.00 0.00 ATOM 278 CE1 PHE A 36 4.988 18.211 20.641 1.00 0.00 ATOM 279 CE2 PHE A 36 5.197 19.262 18.478 1.00 0.00 ATOM 280 CZ PHE A 36 4.556 18.359 19.327 1.00 0.00 ATOM 281 O PHE A 36 9.482 20.548 17.982 1.00 0.00 ATOM 282 C PHE A 36 9.288 21.077 19.084 1.00 0.00 ATOM 283 N GLU A 37 8.988 22.371 19.218 1.00 0.00 ATOM 284 CA GLU A 37 8.867 23.261 18.056 1.00 0.00 ATOM 285 CB GLU A 37 8.506 24.679 18.501 1.00 0.00 ATOM 286 CG GLU A 37 8.316 25.661 17.356 1.00 0.00 ATOM 287 CD GLU A 37 7.927 27.046 17.836 1.00 0.00 ATOM 288 OE1 GLU A 37 7.792 27.234 19.064 1.00 0.00 ATOM 289 OE2 GLU A 37 7.755 27.942 16.984 1.00 0.00 ATOM 290 O GLU A 37 10.159 23.310 16.031 1.00 0.00 ATOM 291 C GLU A 37 10.164 23.348 17.256 1.00 0.00 ATOM 292 N ALA A 38 11.273 23.518 17.962 1.00 0.00 ATOM 293 CA ALA A 38 12.566 23.637 17.325 1.00 0.00 ATOM 294 CB ALA A 38 13.655 23.832 18.368 1.00 0.00 ATOM 295 O ALA A 38 13.322 22.430 15.395 1.00 0.00 ATOM 296 C ALA A 38 12.857 22.371 16.533 1.00 0.00 ATOM 297 N THR A 39 12.569 21.219 17.172 1.00 0.00 ATOM 298 CA THR A 39 12.758 19.946 16.507 1.00 0.00 ATOM 299 CB THR A 39 12.469 18.767 17.454 1.00 0.00 ATOM 300 CG2 THR A 39 13.404 18.807 18.654 1.00 0.00 ATOM 301 OG1 THR A 39 11.115 18.841 17.917 1.00 0.00 ATOM 302 O THR A 39 12.209 19.233 14.327 1.00 0.00 ATOM 303 C THR A 39 11.837 19.820 15.325 1.00 0.00 ATOM 304 N ILE A 40 10.590 20.366 15.414 1.00 0.00 ATOM 305 CA ILE A 40 9.681 20.325 14.273 1.00 0.00 ATOM 306 CB ILE A 40 8.332 21.008 14.566 1.00 0.00 ATOM 307 CG1 ILE A 40 7.611 20.293 15.710 1.00 0.00 ATOM 308 CG2 ILE A 40 7.440 20.971 13.335 1.00 0.00 ATOM 309 CD1 ILE A 40 7.325 18.833 15.434 1.00 0.00 ATOM 310 O ILE A 40 10.003 20.520 11.904 1.00 0.00 ATOM 311 C ILE A 40 10.246 20.984 13.014 1.00 0.00 ATOM 312 N THR A 41 11.024 22.046 13.188 1.00 0.00 ATOM 313 CA THR A 41 11.637 22.744 12.059 1.00 0.00 ATOM 314 CB THR A 41 11.957 24.247 12.325 1.00 0.00 ATOM 315 CG2 THR A 41 10.644 24.977 12.661 1.00 0.00 ATOM 316 OG1 THR A 41 12.964 24.412 13.344 1.00 0.00 ATOM 317 O THR A 41 13.569 22.404 10.671 1.00 0.00 ATOM 318 C THR A 41 12.920 22.023 11.645 1.00 0.00 ATOM 319 N GLY A 42 13.250 20.938 12.397 1.00 0.00 ATOM 320 CA GLY A 42 14.442 20.159 12.100 1.00 0.00 ATOM 321 O GLY A 42 16.795 20.277 12.318 1.00 0.00 ATOM 322 C GLY A 42 15.723 20.804 12.624 1.00 0.00 ATOM 323 N ASN A 43 15.589 21.898 13.384 1.00 0.00 ATOM 324 CA ASN A 43 16.778 22.629 13.838 1.00 0.00 ATOM 325 CB ASN A 43 16.408 24.081 14.141 1.00 0.00 ATOM 326 CG ASN A 43 17.611 24.922 14.526 1.00 0.00 ATOM 327 ND2 ASN A 43 17.357 26.065 15.152 1.00 0.00 ATOM 328 OD1 ASN A 43 18.753 24.545 14.262 1.00 0.00 ATOM 329 O ASN A 43 17.170 22.391 16.219 1.00 0.00 ATOM 330 C ASN A 43 17.240 21.888 15.096 1.00 0.00 ATOM 331 N TRP A 44 17.682 20.592 14.838 1.00 0.00 ATOM 332 CA TRP A 44 18.100 19.738 15.930 1.00 0.00 ATOM 333 CB TRP A 44 18.660 18.432 15.361 1.00 0.00 ATOM 334 CG TRP A 44 17.618 17.555 14.737 1.00 0.00 ATOM 335 CD1 TRP A 44 17.461 17.287 13.407 1.00 0.00 ATOM 336 CD2 TRP A 44 16.588 16.828 15.418 1.00 0.00 ATOM 337 CE2 TRP A 44 15.843 16.143 14.438 1.00 0.00 ATOM 338 CE3 TRP A 44 16.220 16.692 16.760 1.00 0.00 ATOM 339 NE1 TRP A 44 16.397 16.439 13.218 1.00 0.00 ATOM 340 CZ2 TRP A 44 14.755 15.333 14.757 1.00 0.00 ATOM 341 CZ3 TRP A 44 15.141 15.886 17.073 1.00 0.00 ATOM 342 CH2 TRP A 44 14.419 15.218 16.078 1.00 0.00 ATOM 343 O TRP A 44 19.215 20.026 18.022 1.00 0.00 ATOM 344 C TRP A 44 19.176 20.320 16.836 1.00 0.00 ATOM 345 N ASP A 45 20.046 21.139 16.270 1.00 0.00 ATOM 346 CA ASP A 45 21.117 21.752 17.036 1.00 0.00 ATOM 347 CB ASP A 45 21.929 22.705 16.156 1.00 0.00 ATOM 348 CG ASP A 45 22.804 21.972 15.156 1.00 0.00 ATOM 349 OD1 ASP A 45 22.965 20.742 15.300 1.00 0.00 ATOM 350 OD2 ASP A 45 23.326 22.628 14.232 1.00 0.00 ATOM 351 O ASP A 45 21.166 22.334 19.358 1.00 0.00 ATOM 352 C ASP A 45 20.693 22.581 18.243 1.00 0.00 ATOM 353 N ASP A 46 19.703 23.598 17.984 1.00 0.00 ATOM 354 CA ASP A 46 19.239 24.402 19.111 1.00 0.00 ATOM 355 CB ASP A 46 18.462 25.624 18.616 1.00 0.00 ATOM 356 CG ASP A 46 19.362 26.678 18.006 1.00 0.00 ATOM 357 OD1 ASP A 46 20.596 26.583 18.184 1.00 0.00 ATOM 358 OD2 ASP A 46 18.836 27.603 17.351 1.00 0.00 ATOM 359 O ASP A 46 18.181 23.846 21.206 1.00 0.00 ATOM 360 C ASP A 46 18.321 23.572 20.006 1.00 0.00 ATOM 361 N ALA A 47 17.692 22.552 19.430 1.00 0.00 ATOM 362 CA ALA A 47 16.806 21.700 20.225 1.00 0.00 ATOM 363 CB ALA A 47 16.248 20.574 19.370 1.00 0.00 ATOM 364 O ALA A 47 17.092 21.032 22.517 1.00 0.00 ATOM 365 C ALA A 47 17.588 21.100 21.393 1.00 0.00 ATOM 366 N VAL A 48 18.809 20.649 21.123 1.00 0.00 ATOM 367 CA VAL A 48 19.639 20.070 22.174 1.00 0.00 ATOM 368 CB VAL A 48 20.990 19.583 21.621 1.00 0.00 ATOM 369 CG1 VAL A 48 21.913 19.168 22.757 1.00 0.00 ATOM 370 CG2 VAL A 48 20.791 18.385 20.704 1.00 0.00 ATOM 371 O VAL A 48 19.868 20.777 24.464 1.00 0.00 ATOM 372 C VAL A 48 19.932 21.096 23.275 1.00 0.00 ATOM 373 N GLN A 49 20.247 22.327 22.882 1.00 0.00 ATOM 374 CA GLN A 49 20.544 23.378 23.861 1.00 0.00 ATOM 375 CB GLN A 49 20.883 24.690 23.151 1.00 0.00 ATOM 376 CG GLN A 49 22.223 24.679 22.433 1.00 0.00 ATOM 377 CD GLN A 49 22.473 25.952 21.649 1.00 0.00 ATOM 378 OE1 GLN A 49 21.605 26.820 21.562 1.00 0.00 ATOM 379 NE2 GLN A 49 23.665 26.065 21.072 1.00 0.00 ATOM 380 O GLN A 49 19.509 23.778 25.989 1.00 0.00 ATOM 381 C GLN A 49 19.349 23.630 24.778 1.00 0.00 ATOM 382 N ILE A 50 18.150 23.689 24.204 1.00 0.00 ATOM 383 CA ILE A 50 16.952 23.923 24.999 1.00 0.00 ATOM 384 CB ILE A 50 15.710 24.100 24.108 1.00 0.00 ATOM 385 CG1 ILE A 50 15.812 25.396 23.301 1.00 0.00 ATOM 386 CG2 ILE A 50 14.450 24.161 24.958 1.00 0.00 ATOM 387 CD1 ILE A 50 14.770 25.521 22.211 1.00 0.00 ATOM 388 O ILE A 50 16.413 22.924 27.114 1.00 0.00 ATOM 389 C ILE A 50 16.701 22.737 25.933 1.00 0.00 ATOM 390 N ARG A 51 16.816 21.512 25.424 1.00 0.00 ATOM 391 CA ARG A 51 16.572 20.331 26.242 1.00 0.00 ATOM 392 CB ARG A 51 16.645 19.075 25.371 1.00 0.00 ATOM 393 CG ARG A 51 16.346 17.785 26.115 1.00 0.00 ATOM 394 CD ARG A 51 16.314 16.596 25.169 1.00 0.00 ATOM 395 NE ARG A 51 16.027 15.346 25.869 1.00 0.00 ATOM 396 CZ ARG A 51 16.006 14.151 25.287 1.00 0.00 ATOM 397 NH1 ARG A 51 15.735 13.069 26.003 1.00 0.00 ATOM 398 NH2 ARG A 51 16.255 14.041 23.989 1.00 0.00 ATOM 399 O ARG A 51 17.302 19.704 28.452 1.00 0.00 ATOM 400 C ARG A 51 17.612 20.188 27.360 1.00 0.00 ATOM 401 N LYS A 52 18.848 20.582 27.076 1.00 0.00 ATOM 402 CA LYS A 52 19.905 20.520 28.075 1.00 0.00 ATOM 403 CB LYS A 52 21.240 20.952 27.469 1.00 0.00 ATOM 404 CG LYS A 52 22.413 20.879 28.436 1.00 0.00 ATOM 405 CD LYS A 52 23.717 21.253 27.750 1.00 0.00 ATOM 406 CE LYS A 52 24.882 21.227 28.727 1.00 0.00 ATOM 407 NZ LYS A 52 26.163 21.615 28.074 1.00 0.00 ATOM 408 O LYS A 52 19.555 21.071 30.380 1.00 0.00 ATOM 409 C LYS A 52 19.526 21.462 29.216 1.00 0.00 ATOM 410 N GLN A 53 19.154 22.695 28.873 1.00 0.00 ATOM 411 CA GLN A 53 18.767 23.691 29.872 1.00 0.00 ATOM 412 CB GLN A 53 18.542 25.064 29.078 1.00 0.00 ATOM 413 CG GLN A 53 18.103 26.210 29.970 1.00 0.00 ATOM 414 CD GLN A 53 17.972 27.559 29.320 1.00 0.00 ATOM 415 OE1 GLN A 53 17.789 28.566 30.016 1.00 0.00 ATOM 416 NE2 GLN A 53 18.039 27.680 28.000 1.00 0.00 ATOM 417 O GLN A 53 17.525 23.435 31.907 1.00 0.00 ATOM 418 C GLN A 53 17.567 23.239 30.691 1.00 0.00 ATOM 419 N ILE A 54 16.584 22.644 30.023 1.00 0.00 ATOM 420 CA ILE A 54 15.394 22.185 30.722 1.00 0.00 ATOM 421 CB ILE A 54 14.281 21.736 29.744 1.00 0.00 ATOM 422 CG1 ILE A 54 12.978 21.505 30.511 1.00 0.00 ATOM 423 CG2 ILE A 54 14.689 20.480 28.996 1.00 0.00 ATOM 424 CD1 ILE A 54 12.378 22.768 31.090 1.00 0.00 ATOM 425 O ILE A 54 15.158 20.905 32.739 1.00 0.00 ATOM 426 C ILE A 54 15.693 20.996 31.635 1.00 0.00 ATOM 427 N SER A 55 16.525 20.129 31.162 1.00 0.00 ATOM 428 CA SER A 55 16.874 18.957 31.959 1.00 0.00 ATOM 429 CB SER A 55 17.877 18.091 31.193 1.00 0.00 ATOM 430 OG SER A 55 17.284 17.526 30.037 1.00 0.00 ATOM 431 O SER A 55 17.100 18.758 34.339 1.00 0.00 ATOM 432 C SER A 55 17.499 19.296 33.305 1.00 0.00 ATOM 433 N LEU A 56 18.472 20.197 33.292 1.00 0.00 ATOM 434 CA LEU A 56 19.157 20.606 34.507 1.00 0.00 ATOM 435 CB LEU A 56 20.232 21.642 34.174 1.00 0.00 ATOM 436 CG LEU A 56 21.036 22.188 35.354 1.00 0.00 ATOM 437 CD1 LEU A 56 21.806 21.073 36.044 1.00 0.00 ATOM 438 CD2 LEU A 56 22.035 23.235 34.886 1.00 0.00 ATOM 439 O LEU A 56 18.223 20.958 36.677 1.00 0.00 ATOM 440 C LEU A 56 18.177 21.240 35.497 1.00 0.00 ATOM 441 N ALA A 57 17.308 22.121 35.019 1.00 0.00 ATOM 442 CA ALA A 57 16.327 22.760 35.862 1.00 0.00 ATOM 443 CB ALA A 57 15.410 23.644 35.031 1.00 0.00 ATOM 444 O ALA A 57 15.217 21.746 37.767 1.00 0.00 ATOM 445 C ALA A 57 15.481 21.673 36.563 1.00 0.00 ATOM 446 N GLU A 58 15.090 20.653 35.807 1.00 0.00 ATOM 447 CA GLU A 58 14.211 19.629 36.322 1.00 0.00 ATOM 448 CB GLU A 58 13.788 18.674 35.204 1.00 0.00 ATOM 449 CG GLU A 58 12.847 19.291 34.183 1.00 0.00 ATOM 450 CD GLU A 58 12.548 18.357 33.027 1.00 0.00 ATOM 451 OE1 GLU A 58 13.134 17.253 32.987 1.00 0.00 ATOM 452 OE2 GLU A 58 11.729 18.727 32.161 1.00 0.00 ATOM 453 O GLU A 58 14.369 18.506 38.480 1.00 0.00 ATOM 454 C GLU A 58 14.946 18.827 37.418 1.00 0.00 ATOM 455 N LYS A 59 16.235 18.619 37.219 1.00 0.00 ATOM 456 CA LYS A 59 17.039 17.908 38.196 1.00 0.00 ATOM 457 CB LYS A 59 18.601 18.149 37.540 1.00 0.00 ATOM 458 CG LYS A 59 19.747 17.237 37.977 1.00 0.00 ATOM 459 CD LYS A 59 21.092 17.796 37.524 1.00 0.00 ATOM 460 CE LYS A 59 22.232 16.853 37.880 1.00 0.00 ATOM 461 NZ LYS A 59 22.411 16.736 39.355 1.00 0.00 ATOM 462 O LYS A 59 17.145 18.107 40.569 1.00 0.00 ATOM 463 C LYS A 59 17.170 18.683 39.484 1.00 0.00 ATOM 464 N GLN A 60 17.313 19.995 39.371 1.00 0.00 ATOM 465 CA GLN A 60 17.429 20.826 40.556 1.00 0.00 ATOM 466 CB GLN A 60 17.681 22.283 40.165 1.00 0.00 ATOM 467 CG GLN A 60 19.062 22.541 39.584 1.00 0.00 ATOM 468 CD GLN A 60 19.235 23.969 39.105 1.00 0.00 ATOM 469 OE1 GLN A 60 18.290 24.758 39.121 1.00 0.00 ATOM 470 NE2 GLN A 60 20.445 24.304 38.676 1.00 0.00 ATOM 471 O GLN A 60 16.197 20.674 42.628 1.00 0.00 ATOM 472 C GLN A 60 16.136 20.774 41.404 1.00 0.00 ATOM 473 N GLY A 61 15.011 20.816 40.719 1.00 0.00 ATOM 474 CA GLY A 61 13.733 20.774 41.431 1.00 0.00 ATOM 475 O GLY A 61 12.995 19.326 43.184 1.00 0.00 ATOM 476 C GLY A 61 13.511 19.416 42.069 1.00 0.00 ATOM 477 N ASP A 62 13.886 18.353 41.350 1.00 0.00 ATOM 478 CA ASP A 62 13.717 16.993 41.856 1.00 0.00 ATOM 479 CB ASP A 62 14.170 15.980 40.803 1.00 0.00 ATOM 480 CG ASP A 62 13.174 15.834 39.669 1.00 0.00 ATOM 481 OD1 ASP A 62 12.036 16.330 39.810 1.00 0.00 ATOM 482 OD2 ASP A 62 13.531 15.223 38.640 1.00 0.00 ATOM 483 O ASP A 62 14.115 16.255 44.096 1.00 0.00 ATOM 484 C ASP A 62 14.573 16.815 43.103 1.00 0.00 ATOM 485 N SER A 63 15.810 17.296 43.055 1.00 0.00 ATOM 486 CA SER A 63 16.706 17.162 44.196 1.00 0.00 ATOM 487 CB SER A 63 18.126 17.584 43.811 1.00 0.00 ATOM 488 OG SER A 63 18.189 18.970 43.532 1.00 0.00 ATOM 489 O SER A 63 16.412 17.679 46.514 1.00 0.00 ATOM 490 C SER A 63 16.190 18.003 45.347 1.00 0.00 ATOM 491 N LEU A 64 15.489 19.086 45.020 1.00 0.00 ATOM 492 CA LEU A 64 14.955 19.963 46.060 1.00 0.00 ATOM 493 CB LEU A 64 14.529 21.297 45.432 1.00 0.00 ATOM 494 CG LEU A 64 15.660 22.169 44.853 1.00 0.00 ATOM 495 CD1 LEU A 64 15.019 23.392 44.209 1.00 0.00 ATOM 496 CD2 LEU A 64 16.645 22.575 45.906 1.00 0.00 ATOM 497 O LEU A 64 13.666 19.519 48.030 1.00 0.00 ATOM 498 C LEU A 64 13.815 19.308 46.831 1.00 0.00 ATOM 499 N LYS A 65 12.937 18.376 45.830 1.00 0.00 ATOM 500 CA LYS A 65 11.990 17.932 46.844 1.00 0.00 ATOM 501 CB LYS A 65 11.158 19.088 47.325 1.00 0.00 ATOM 502 CG LYS A 65 10.254 18.774 48.499 1.00 0.00 ATOM 503 CD LYS A 65 9.347 19.952 48.814 1.00 0.00 ATOM 504 CE LYS A 65 10.126 21.258 48.866 1.00 0.00 ATOM 505 NZ LYS A 65 11.265 21.191 49.822 1.00 0.00 ATOM 506 O LYS A 65 10.707 15.908 46.922 1.00 0.00 ATOM 507 C LYS A 65 11.807 16.430 46.712 1.00 0.00 ATOM 508 N ARG A 66 12.819 15.718 46.201 1.00 0.00 ATOM 509 CA ARG A 66 12.645 14.336 45.810 1.00 0.00 ATOM 510 CB ARG A 66 14.054 13.766 45.638 1.00 0.00 ATOM 511 CG ARG A 66 14.086 12.304 45.223 1.00 0.00 ATOM 512 CD ARG A 66 15.513 11.804 45.068 1.00 0.00 ATOM 513 NE ARG A 66 16.139 12.309 43.849 1.00 0.00 ATOM 514 CZ ARG A 66 17.395 12.056 43.496 1.00 0.00 ATOM 515 NH1 ARG A 66 17.880 12.558 42.368 1.00 0.00 ATOM 516 NH2 ARG A 66 18.164 11.302 44.270 1.00 0.00 ATOM 517 O ARG A 66 10.897 12.920 46.662 1.00 0.00 ATOM 518 C ARG A 66 11.973 13.474 46.879 1.00 0.00 ATOM 519 N GLU A 67 12.616 13.366 48.037 1.00 0.00 ATOM 520 CA GLU A 67 12.108 12.548 49.132 1.00 0.00 ATOM 521 CB GLU A 67 13.031 12.650 50.348 1.00 0.00 ATOM 522 CG GLU A 67 12.596 11.798 51.530 1.00 0.00 ATOM 523 CD GLU A 67 13.551 11.898 52.703 1.00 0.00 ATOM 524 OE1 GLU A 67 14.561 12.624 52.588 1.00 0.00 ATOM 525 OE2 GLU A 67 13.289 11.251 53.739 1.00 0.00 ATOM 526 O GLU A 67 9.828 12.118 49.731 1.00 0.00 ATOM 527 C GLU A 67 10.719 12.957 49.612 1.00 0.00 ATOM 528 N ILE A 68 10.538 14.243 49.891 1.00 0.00 ATOM 529 CA ILE A 68 9.250 14.740 50.355 1.00 0.00 ATOM 530 CB ILE A 68 9.295 16.287 50.656 1.00 0.00 ATOM 531 CG1 ILE A 68 10.176 16.557 51.860 1.00 0.00 ATOM 532 CG2 ILE A 68 7.870 16.848 50.834 1.00 0.00 ATOM 533 CD1 ILE A 68 10.515 18.048 52.102 1.00 0.00 ATOM 534 O ILE A 68 7.026 14.035 49.754 1.00 0.00 ATOM 535 C ILE A 68 8.144 14.386 49.363 1.00 0.00 ATOM 536 N ARG A 69 8.453 14.486 48.075 1.00 0.00 ATOM 537 CA ARG A 69 7.478 14.165 47.040 1.00 0.00 ATOM 538 CB ARG A 69 8.058 14.656 45.656 1.00 0.00 ATOM 539 CG ARG A 69 8.222 16.155 45.507 1.00 0.00 ATOM 540 CD ARG A 69 8.572 16.496 44.056 1.00 0.00 ATOM 541 NE ARG A 69 8.367 17.927 43.798 1.00 0.00 ATOM 542 CZ ARG A 69 9.268 18.887 44.009 1.00 0.00 ATOM 543 NH1 ARG A 69 10.489 18.609 44.469 1.00 0.00 ATOM 544 NH2 ARG A 69 8.923 20.155 43.818 1.00 0.00 ATOM 545 O ARG A 69 6.053 12.254 46.805 1.00 0.00 ATOM 546 C ARG A 69 7.191 12.668 47.009 1.00 0.00 ATOM 547 N LEU A 70 8.225 11.858 47.214 1.00 0.00 ATOM 548 CA LEU A 70 8.069 10.406 47.208 1.00 0.00 ATOM 549 CB LEU A 70 9.418 9.722 47.440 1.00 0.00 ATOM 550 CG LEU A 70 10.440 9.834 46.306 1.00 0.00 ATOM 551 CD1 LEU A 70 11.785 9.273 46.737 1.00 0.00 ATOM 552 CD2 LEU A 70 9.971 9.060 45.083 1.00 0.00 ATOM 553 O LEU A 70 6.235 9.108 48.055 1.00 0.00 ATOM 554 C LEU A 70 7.112 9.936 48.303 1.00 0.00 ATOM 555 N THR A 71 7.258 10.499 49.501 1.00 0.00 ATOM 556 CA THR A 71 6.414 10.131 50.627 1.00 0.00 ATOM 557 CB THR A 71 6.899 10.787 51.933 1.00 0.00 ATOM 558 CG2 THR A 71 5.979 10.420 53.087 1.00 0.00 ATOM 559 OG1 THR A 71 8.224 10.334 52.235 1.00 0.00 ATOM 560 O THR A 71 4.038 9.781 50.653 1.00 0.00 ATOM 561 C THR A 71 4.964 10.542 50.374 1.00 0.00 ATOM 562 N LEU A 72 4.780 11.745 49.849 1.00 0.00 ATOM 563 CA LEU A 72 3.430 12.224 49.561 1.00 0.00 ATOM 564 CB LEU A 72 3.495 13.673 49.074 1.00 0.00 ATOM 565 CG LEU A 72 3.930 14.716 50.104 1.00 0.00 ATOM 566 CD1 LEU A 72 4.123 16.074 49.446 1.00 0.00 ATOM 567 CD2 LEU A 72 2.882 14.863 51.197 1.00 0.00 ATOM 568 O LEU A 72 1.584 10.997 48.627 1.00 0.00 ATOM 569 C LEU A 72 2.750 11.376 48.488 1.00 0.00 ATOM 570 N PRO A 73 3.488 11.066 47.427 1.00 0.00 ATOM 571 CA PRO A 73 2.946 10.267 46.335 1.00 0.00 ATOM 572 CB PRO A 73 4.090 10.207 45.319 1.00 0.00 ATOM 573 CG PRO A 73 4.866 11.458 45.557 1.00 0.00 ATOM 574 CD PRO A 73 4.860 11.677 47.043 1.00 0.00 ATOM 575 O PRO A 73 1.503 8.353 46.478 1.00 0.00 ATOM 576 C PRO A 73 2.558 8.876 46.834 1.00 0.00 ATOM 577 N SER A 74 3.419 8.293 47.670 1.00 0.00 ATOM 578 CA SER A 74 3.146 6.966 48.213 1.00 0.00 ATOM 579 CB SER A 74 4.342 6.463 49.023 1.00 0.00 ATOM 580 OG SER A 74 5.469 6.250 48.191 1.00 0.00 ATOM 581 O SER A 74 1.039 6.152 48.975 1.00 0.00 ATOM 582 C SER A 74 1.911 7.004 49.094 1.00 0.00 ATOM 583 N GLY A 75 1.779 8.064 49.899 1.00 0.00 ATOM 584 CA GLY A 75 0.642 8.208 50.789 1.00 0.00 ATOM 585 O GLY A 75 -1.706 7.947 50.399 1.00 0.00 ATOM 586 C GLY A 75 -0.639 8.382 49.983 1.00 0.00 ATOM 587 N LEU A 76 -0.530 8.992 48.809 1.00 0.00 ATOM 588 CA LEU A 76 -1.696 9.206 47.958 1.00 0.00 ATOM 589 CB LEU A 76 -1.390 10.248 46.881 1.00 0.00 ATOM 590 CG LEU A 76 -1.124 11.673 47.372 1.00 0.00 ATOM 591 CD1 LEU A 76 -0.707 12.571 46.218 1.00 0.00 ATOM 592 CD2 LEU A 76 -2.373 12.264 48.008 1.00 0.00 ATOM 593 O LEU A 76 -3.281 7.605 47.123 1.00 0.00 ATOM 594 C LEU A 76 -2.100 7.906 47.272 1.00 0.00 ATOM 595 N PHE A 77 -1.036 7.147 46.728 1.00 0.00 ATOM 596 CA PHE A 77 -1.251 5.878 46.042 1.00 0.00 ATOM 597 CB PHE A 77 -1.171 6.069 44.526 1.00 0.00 ATOM 598 CG PHE A 77 -2.227 6.981 43.972 1.00 0.00 ATOM 599 CD1 PHE A 77 -1.941 8.308 43.698 1.00 0.00 ATOM 600 CD2 PHE A 77 -3.505 6.515 43.727 1.00 0.00 ATOM 601 CE1 PHE A 77 -2.913 9.148 43.189 1.00 0.00 ATOM 602 CE2 PHE A 77 -4.478 7.355 43.216 1.00 0.00 ATOM 603 CZ PHE A 77 -4.185 8.666 42.948 1.00 0.00 ATOM 604 O PHE A 77 0.975 4.984 46.042 1.00 0.00 ATOM 605 C PHE A 77 -0.155 4.935 46.523 1.00 0.00 ATOM 606 N MET A 78 -0.466 4.096 47.525 1.00 0.00 ATOM 607 CA MET A 78 0.489 3.137 48.090 1.00 0.00 ATOM 608 CB MET A 78 -0.161 2.348 49.229 1.00 0.00 ATOM 609 CG MET A 78 -0.381 3.155 50.498 1.00 0.00 ATOM 610 SD MET A 78 1.163 3.711 51.244 1.00 0.00 ATOM 611 CE MET A 78 1.826 2.160 51.845 1.00 0.00 ATOM 612 O MET A 78 2.041 1.576 47.143 1.00 0.00 ATOM 613 C MET A 78 0.941 2.122 47.049 1.00 0.00 ATOM 614 N PRO A 79 0.093 1.881 46.052 1.00 0.00 ATOM 615 CA PRO A 79 0.414 0.919 45.006 1.00 0.00 ATOM 616 CB PRO A 79 -0.858 0.807 44.202 1.00 0.00 ATOM 617 CG PRO A 79 -1.478 2.163 44.348 1.00 0.00 ATOM 618 CD PRO A 79 -1.257 2.473 45.815 1.00 0.00 ATOM 619 O PRO A 79 2.204 0.450 43.498 1.00 0.00 ATOM 620 C PRO A 79 1.639 1.291 44.185 1.00 0.00 ATOM 621 N VAL A 80 2.069 2.625 44.286 1.00 0.00 ATOM 622 CA VAL A 80 3.266 3.068 43.571 1.00 0.00 ATOM 623 CB VAL A 80 3.593 4.542 43.877 1.00 0.00 ATOM 624 CG1 VAL A 80 4.941 4.922 43.285 1.00 0.00 ATOM 625 CG2 VAL A 80 2.532 5.457 43.285 1.00 0.00 ATOM 626 O VAL A 80 5.415 2.078 43.152 1.00 0.00 ATOM 627 C VAL A 80 4.492 2.250 43.950 1.00 0.00 ATOM 628 N GLU A 81 4.510 1.745 45.177 1.00 0.00 ATOM 629 CA GLU A 81 5.652 0.974 45.621 1.00 0.00 ATOM 630 CB GLU A 81 6.000 1.317 47.070 1.00 0.00 ATOM 631 CG GLU A 81 6.465 2.751 47.274 1.00 0.00 ATOM 632 CD GLU A 81 6.800 3.054 48.720 1.00 0.00 ATOM 633 OE1 GLU A 81 6.682 2.139 49.562 1.00 0.00 ATOM 634 OE2 GLU A 81 7.182 4.207 49.012 1.00 0.00 ATOM 635 O GLU A 81 6.243 -1.331 45.860 1.00 0.00 ATOM 636 C GLU A 81 5.371 -0.517 45.555 1.00 0.00 ATOM 637 N ARG A 82 4.149 -0.892 45.183 1.00 0.00 ATOM 638 CA ARG A 82 3.792 -2.303 45.114 1.00 0.00 ATOM 639 CB ARG A 82 2.272 -2.473 45.086 1.00 0.00 ATOM 640 CG ARG A 82 1.809 -3.920 45.095 1.00 0.00 ATOM 641 CD ARG A 82 0.291 -4.015 45.088 1.00 0.00 ATOM 642 NE ARG A 82 -0.170 -5.401 45.114 1.00 0.00 ATOM 643 CZ ARG A 82 -1.439 -5.768 44.959 1.00 0.00 ATOM 644 NH1 ARG A 82 -1.765 -7.054 44.997 1.00 0.00 ATOM 645 NH2 ARG A 82 -2.376 -4.851 44.768 1.00 0.00 ATOM 646 O ARG A 82 4.006 -2.679 42.750 1.00 0.00 ATOM 647 C ARG A 82 4.314 -3.048 43.887 1.00 0.00 ATOM 648 N THR A 83 5.072 -4.114 44.114 1.00 0.00 ATOM 649 CA THR A 83 5.636 -4.879 43.004 1.00 0.00 ATOM 650 CB THR A 83 6.455 -6.082 43.507 1.00 0.00 ATOM 651 CG2 THR A 83 6.996 -6.884 42.335 1.00 0.00 ATOM 652 OG1 THR A 83 7.554 -5.618 44.301 1.00 0.00 ATOM 653 O THR A 83 4.865 -5.499 40.812 1.00 0.00 ATOM 654 C THR A 83 4.650 -5.498 42.034 1.00 0.00 ATOM 655 N ASP A 84 3.516 -5.924 42.484 1.00 0.00 ATOM 656 CA ASP A 84 2.486 -6.462 41.626 1.00 0.00 ATOM 657 CB ASP A 84 1.319 -7.072 42.403 1.00 0.00 ATOM 658 CG ASP A 84 1.695 -8.366 43.097 1.00 0.00 ATOM 659 OD1 ASP A 84 2.770 -8.919 42.783 1.00 0.00 ATOM 660 OD2 ASP A 84 0.915 -8.829 43.956 1.00 0.00 ATOM 661 O ASP A 84 1.749 -5.614 39.501 1.00 0.00 ATOM 662 C ASP A 84 1.953 -5.374 40.689 1.00 0.00 ATOM 663 N LEU A 85 1.720 -4.197 41.231 1.00 0.00 ATOM 664 CA LEU A 85 1.238 -3.063 40.446 1.00 0.00 ATOM 665 CB LEU A 85 0.865 -1.881 41.259 1.00 0.00 ATOM 666 CG LEU A 85 0.355 -0.655 40.494 1.00 0.00 ATOM 667 CD1 LEU A 85 -0.919 -1.017 39.740 1.00 0.00 ATOM 668 CD2 LEU A 85 0.042 0.472 41.493 1.00 0.00 ATOM 669 O LEU A 85 1.947 -2.476 38.248 1.00 0.00 ATOM 670 C LEU A 85 2.278 -2.735 39.396 1.00 0.00 ATOM 671 N LEU A 86 3.533 -2.739 39.803 1.00 0.00 ATOM 672 CA LEU A 86 4.630 -2.460 38.875 1.00 0.00 ATOM 673 CB LEU A 86 5.932 -2.325 39.612 1.00 0.00 ATOM 674 CG LEU A 86 6.050 -1.128 40.564 1.00 0.00 ATOM 675 CD1 LEU A 86 7.344 -1.241 41.363 1.00 0.00 ATOM 676 CD2 LEU A 86 5.928 0.205 39.860 1.00 0.00 ATOM 677 O LEU A 86 4.986 -3.263 36.644 1.00 0.00 ATOM 678 C LEU A 86 4.753 -3.560 37.809 1.00 0.00 ATOM 679 N GLU A 87 4.580 -4.820 38.199 1.00 0.00 ATOM 680 CA GLU A 87 4.656 -5.912 37.234 1.00 0.00 ATOM 681 CB GLU A 87 4.596 -7.264 37.948 1.00 0.00 ATOM 682 CG GLU A 87 5.838 -7.590 38.764 1.00 0.00 ATOM 683 CD GLU A 87 5.694 -8.877 39.554 1.00 0.00 ATOM 684 OE1 GLU A 87 4.598 -9.474 39.522 1.00 0.00 ATOM 685 OE2 GLU A 87 6.678 -9.285 40.206 1.00 0.00 ATOM 686 O GLU A 87 3.638 -6.059 35.075 1.00 0.00 ATOM 687 C GLU A 87 3.485 -5.813 36.264 1.00 0.00 ATOM 688 N LEU A 88 2.310 -5.461 36.779 1.00 0.00 ATOM 689 CA LEU A 88 1.117 -5.342 35.947 1.00 0.00 ATOM 690 CB LEU A 88 -0.093 -4.954 36.798 1.00 0.00 ATOM 691 CG LEU A 88 -1.418 -4.778 36.052 1.00 0.00 ATOM 692 CD1 LEU A 88 -1.839 -6.079 35.389 1.00 0.00 ATOM 693 CD2 LEU A 88 -2.521 -4.354 37.011 1.00 0.00 ATOM 694 O LEU A 88 1.134 -4.495 33.711 1.00 0.00 ATOM 695 C LEU A 88 1.353 -4.265 34.891 1.00 0.00 ATOM 696 N LEU A 89 1.800 -3.090 35.328 1.00 0.00 ATOM 697 CA LEU A 89 2.069 -1.990 34.417 1.00 0.00 ATOM 698 CB LEU A 89 2.610 -0.767 35.126 1.00 0.00 ATOM 699 CG LEU A 89 2.831 0.457 34.219 1.00 0.00 ATOM 700 CD1 LEU A 89 1.520 0.903 33.560 1.00 0.00 ATOM 701 CD2 LEU A 89 3.405 1.598 35.059 1.00 0.00 ATOM 702 O LEU A 89 3.002 -1.932 32.206 1.00 0.00 ATOM 703 C LEU A 89 3.121 -2.325 33.368 1.00 0.00 ATOM 704 N THR A 90 4.142 -3.045 33.794 1.00 0.00 ATOM 705 CA THR A 90 5.210 -3.428 32.877 1.00 0.00 ATOM 706 CB THR A 90 6.326 -4.220 33.583 1.00 0.00 ATOM 707 CG2 THR A 90 7.380 -4.663 32.581 1.00 0.00 ATOM 708 OG1 THR A 90 6.947 -3.395 34.576 1.00 0.00 ATOM 709 O THR A 90 4.982 -4.168 30.616 1.00 0.00 ATOM 710 C THR A 90 4.627 -4.308 31.785 1.00 0.00 ATOM 711 N GLN A 91 3.732 -5.217 32.146 1.00 0.00 ATOM 712 CA GLN A 91 3.153 -6.083 31.124 1.00 0.00 ATOM 713 CB GLN A 91 2.264 -7.150 31.766 1.00 0.00 ATOM 714 CG GLN A 91 3.026 -8.199 32.558 1.00 0.00 ATOM 715 CD GLN A 91 2.109 -9.152 33.299 1.00 0.00 ATOM 716 OE1 GLN A 91 0.892 -8.971 33.312 1.00 0.00 ATOM 717 NE2 GLN A 91 2.692 -10.171 33.919 1.00 0.00 ATOM 718 O GLN A 91 2.389 -5.497 28.927 1.00 0.00 ATOM 719 C GLN A 91 2.293 -5.293 30.132 1.00 0.00 ATOM 720 N GLN A 92 1.442 -4.411 30.650 1.00 0.00 ATOM 721 CA GLN A 92 0.589 -3.599 29.794 1.00 0.00 ATOM 722 CB GLN A 92 -0.297 -2.680 30.638 1.00 0.00 ATOM 723 CG GLN A 92 -1.389 -3.406 31.408 1.00 0.00 ATOM 724 CD GLN A 92 -2.172 -2.482 32.318 1.00 0.00 ATOM 725 OE1 GLN A 92 -1.847 -1.302 32.451 1.00 0.00 ATOM 726 NE2 GLN A 92 -3.211 -3.017 32.950 1.00 0.00 ATOM 727 O GLN A 92 1.044 -2.516 27.690 1.00 0.00 ATOM 728 C GLN A 92 1.404 -2.726 28.858 1.00 0.00 ATOM 729 N ASP A 93 2.497 -2.189 29.373 1.00 0.00 ATOM 730 CA ASP A 93 3.313 -1.319 28.549 1.00 0.00 ATOM 731 CB ASP A 93 4.451 -0.713 29.373 1.00 0.00 ATOM 732 CG ASP A 93 3.969 0.351 30.338 1.00 0.00 ATOM 733 OD1 ASP A 93 2.805 0.786 30.211 1.00 0.00 ATOM 734 OD2 ASP A 93 4.756 0.751 31.223 1.00 0.00 ATOM 735 O ASP A 93 4.113 -1.545 26.307 1.00 0.00 ATOM 736 C ASP A 93 3.908 -2.089 27.388 1.00 0.00 ATOM 737 N LYS A 94 4.185 -3.365 27.619 1.00 0.00 ATOM 738 CA LYS A 94 4.729 -4.203 26.567 1.00 0.00 ATOM 739 CB LYS A 94 5.319 -5.485 27.160 1.00 0.00 ATOM 740 CG LYS A 94 6.560 -5.265 28.008 1.00 0.00 ATOM 741 CD LYS A 94 7.104 -6.578 28.544 1.00 0.00 ATOM 742 CE LYS A 94 8.347 -6.358 29.390 1.00 0.00 ATOM 743 NZ LYS A 94 8.899 -7.638 29.911 1.00 0.00 ATOM 744 O LYS A 94 3.948 -4.650 24.341 1.00 0.00 ATOM 745 C LYS A 94 3.659 -4.522 25.533 1.00 0.00 ATOM 746 N ILE A 95 2.414 -4.652 26.009 1.00 0.00 ATOM 747 CA ILE A 95 1.315 -4.904 25.089 1.00 0.00 ATOM 748 CB ILE A 95 -0.031 -5.094 25.813 1.00 0.00 ATOM 749 CG1 ILE A 95 0.008 -6.345 26.692 1.00 0.00 ATOM 750 CG2 ILE A 95 -1.160 -5.246 24.806 1.00 0.00 ATOM 751 CD1 ILE A 95 -1.168 -6.466 27.635 1.00 0.00 ATOM 752 O ILE A 95 1.147 -3.938 22.895 1.00 0.00 ATOM 753 C ILE A 95 1.251 -3.743 24.100 1.00 0.00 ATOM 754 N ALA A 96 1.384 -2.539 24.637 1.00 0.00 ATOM 755 CA ALA A 96 1.328 -1.338 23.809 1.00 0.00 ATOM 756 CB ALA A 96 1.301 -0.082 24.665 1.00 0.00 ATOM 757 O ALA A 96 2.353 -0.923 21.685 1.00 0.00 ATOM 758 C ALA A 96 2.521 -1.181 22.873 1.00 0.00 ATOM 759 N ASN A 97 3.719 -1.294 23.383 1.00 0.00 ATOM 760 CA ASN A 97 4.909 -1.153 22.554 1.00 0.00 ATOM 761 CB ASN A 97 6.146 -0.907 23.421 1.00 0.00 ATOM 762 CG ASN A 97 6.135 0.461 24.076 1.00 0.00 ATOM 763 ND2 ASN A 97 6.893 0.603 25.156 1.00 0.00 ATOM 764 OD1 ASN A 97 5.452 1.375 23.615 1.00 0.00 ATOM 765 O ASN A 97 5.491 -2.221 20.481 1.00 0.00 ATOM 766 C ASN A 97 5.105 -2.349 21.631 1.00 0.00 ATOM 767 N LYS A 98 4.889 -3.681 22.077 1.00 0.00 ATOM 768 CA LYS A 98 5.224 -4.854 21.285 1.00 0.00 ATOM 769 CB LYS A 98 5.444 -6.054 22.209 1.00 0.00 ATOM 770 CG LYS A 98 6.709 -5.968 23.047 1.00 0.00 ATOM 771 CD LYS A 98 6.895 -7.216 23.895 1.00 0.00 ATOM 772 CE LYS A 98 8.149 -7.122 24.748 1.00 0.00 ATOM 773 NZ LYS A 98 8.336 -8.332 25.596 1.00 0.00 ATOM 774 O LYS A 98 4.383 -5.650 19.184 1.00 0.00 ATOM 775 C LYS A 98 4.109 -5.240 20.310 1.00 0.00 ATOM 776 N ALA A 99 2.860 -5.085 20.733 1.00 0.00 ATOM 777 CA ALA A 99 1.728 -5.499 19.908 1.00 0.00 ATOM 778 CB ALA A 99 0.713 -6.263 20.746 1.00 0.00 ATOM 779 O ALA A 99 0.751 -4.409 18.010 1.00 0.00 ATOM 780 C ALA A 99 0.922 -4.409 19.224 1.00 0.00 ATOM 781 N LYS A 100 0.359 -3.513 20.021 1.00 0.00 ATOM 782 CA LYS A 100 -0.456 -2.446 19.469 1.00 0.00 ATOM 783 CB LYS A 100 -1.064 -1.601 20.589 1.00 0.00 ATOM 784 CG LYS A 100 -1.969 -0.482 20.101 1.00 0.00 ATOM 785 CD LYS A 100 -2.593 0.271 21.265 1.00 0.00 ATOM 786 CE LYS A 100 -3.458 1.422 20.779 1.00 0.00 ATOM 787 NZ LYS A 100 -4.058 2.183 21.909 1.00 0.00 ATOM 788 O LYS A 100 -0.201 -1.161 17.460 1.00 0.00 ATOM 789 C LYS A 100 0.294 -1.465 18.551 1.00 0.00 ATOM 790 N ASP A 101 1.436 -0.966 18.935 1.00 0.00 ATOM 791 CA ASP A 101 2.190 -0.062 18.071 1.00 0.00 ATOM 792 CB ASP A 101 3.454 0.449 18.775 1.00 0.00 ATOM 793 CG ASP A 101 3.144 1.420 19.897 1.00 0.00 ATOM 794 OD1 ASP A 101 2.024 1.973 19.907 1.00 0.00 ATOM 795 OD2 ASP A 101 4.017 1.639 20.759 1.00 0.00 ATOM 796 O ASP A 101 2.600 -0.157 15.708 1.00 0.00 ATOM 797 C ASP A 101 2.575 -0.765 16.780 1.00 0.00 ATOM 798 N ILE A 102 2.880 -2.051 16.885 1.00 0.00 ATOM 799 CA ILE A 102 3.254 -2.830 15.717 1.00 0.00 ATOM 800 CB ILE A 102 3.820 -4.206 16.136 1.00 0.00 ATOM 801 CG1 ILE A 102 5.157 -3.991 16.848 1.00 0.00 ATOM 802 CG2 ILE A 102 3.986 -5.114 14.919 1.00 0.00 ATOM 803 CD1 ILE A 102 5.701 -5.211 17.552 1.00 0.00 ATOM 804 O ILE A 102 2.207 -2.955 13.566 1.00 0.00 ATOM 805 C ILE A 102 2.063 -3.025 14.787 1.00 0.00 ATOM 806 N SER A 103 0.891 -3.280 15.361 1.00 0.00 ATOM 807 CA SER A 103 -0.308 -3.498 14.559 1.00 0.00 ATOM 808 CB SER A 103 -1.484 -3.896 15.452 1.00 0.00 ATOM 809 OG SER A 103 -1.849 -2.840 16.323 1.00 0.00 ATOM 810 O SER A 103 -1.482 -2.397 12.783 1.00 0.00 ATOM 811 C SER A 103 -0.685 -2.284 13.716 1.00 0.00 ATOM 812 N GLY A 104 0.100 -3.683 12.000 1.00 0.00 ATOM 813 CA GLY A 104 0.417 -2.982 10.750 1.00 0.00 ATOM 814 O GLY A 104 -1.568 -1.658 10.794 1.00 0.00 ATOM 815 C GLY A 104 -0.363 -1.689 10.572 1.00 0.00 ATOM 816 N ARG A 105 0.344 -0.640 10.164 1.00 0.00 ATOM 817 CA ARG A 105 -0.236 0.668 9.927 1.00 0.00 ATOM 818 CB ARG A 105 -1.374 0.571 8.909 1.00 0.00 ATOM 819 CG ARG A 105 -0.959 -0.002 7.564 1.00 0.00 ATOM 820 CD ARG A 105 -2.152 -0.155 6.635 1.00 0.00 ATOM 821 NE ARG A 105 -1.808 -0.880 5.416 1.00 0.00 ATOM 822 CZ ARG A 105 -2.666 -1.146 4.437 1.00 0.00 ATOM 823 NH1 ARG A 105 -2.264 -1.814 3.364 1.00 0.00 ATOM 824 NH2 ARG A 105 -3.927 -0.743 4.532 1.00 0.00 ATOM 825 O ARG A 105 -1.535 2.310 11.056 1.00 0.00 ATOM 826 C ARG A 105 -0.817 1.321 11.161 1.00 0.00 ATOM 827 N VAL A 106 -0.458 0.815 12.332 1.00 0.00 ATOM 828 CA VAL A 106 -0.987 1.349 13.581 1.00 0.00 ATOM 829 CB VAL A 106 -0.710 0.401 14.762 1.00 0.00 ATOM 830 CG1 VAL A 106 0.749 0.484 15.182 1.00 0.00 ATOM 831 CG2 VAL A 106 -1.577 0.771 15.956 1.00 0.00 ATOM 832 O VAL A 106 -0.821 3.143 15.099 1.00 0.00 ATOM 833 C VAL A 106 -0.414 2.649 14.057 1.00 0.00 ATOM 834 N ILE A 107 0.558 3.277 13.293 1.00 0.00 ATOM 835 CA ILE A 107 1.224 4.466 13.785 1.00 0.00 ATOM 836 CB ILE A 107 2.294 4.924 12.661 1.00 0.00 ATOM 837 CG1 ILE A 107 3.390 3.872 12.494 1.00 0.00 ATOM 838 CG2 ILE A 107 2.908 6.279 13.024 1.00 0.00 ATOM 839 CD1 ILE A 107 4.411 4.210 11.416 1.00 0.00 ATOM 840 O ILE A 107 0.520 6.324 15.106 1.00 0.00 ATOM 841 C ILE A 107 0.296 5.622 14.131 1.00 0.00 ATOM 842 N GLY A 108 -0.732 5.865 13.317 1.00 0.00 ATOM 843 CA GLY A 108 -1.628 6.977 13.642 1.00 0.00 ATOM 844 O GLY A 108 -2.728 7.908 15.547 1.00 0.00 ATOM 845 C GLY A 108 -2.240 6.902 15.029 1.00 0.00 ATOM 846 N ARG A 109 -2.213 5.704 15.666 1.00 0.00 ATOM 847 CA ARG A 109 -2.790 5.529 16.995 1.00 0.00 ATOM 848 CB ARG A 109 -3.604 4.238 17.103 1.00 0.00 ATOM 849 CG ARG A 109 -4.854 4.218 16.238 1.00 0.00 ATOM 850 CD ARG A 109 -5.657 2.947 16.458 1.00 0.00 ATOM 851 NE ARG A 109 -6.848 2.898 15.614 1.00 0.00 ATOM 852 CZ ARG A 109 -7.679 1.863 15.551 1.00 0.00 ATOM 853 NH1 ARG A 109 -8.736 1.908 14.754 1.00 0.00 ATOM 854 NH2 ARG A 109 -7.447 0.783 16.287 1.00 0.00 ATOM 855 O ARG A 109 -2.060 5.291 19.274 1.00 0.00 ATOM 856 C ARG A 109 -1.728 5.462 18.101 1.00 0.00 ATOM 857 N GLN A 110 -0.461 5.609 17.733 1.00 0.00 ATOM 858 CA GLN A 110 0.638 5.550 18.693 1.00 0.00 ATOM 859 CB GLN A 110 1.956 5.256 17.916 1.00 0.00 ATOM 860 CG GLN A 110 2.063 3.822 17.403 1.00 0.00 ATOM 861 CD GLN A 110 3.202 3.617 16.411 1.00 0.00 ATOM 862 OE1 GLN A 110 3.698 4.565 15.802 1.00 0.00 ATOM 863 NE2 GLN A 110 3.619 2.364 16.247 1.00 0.00 ATOM 864 O GLN A 110 1.104 6.779 20.723 1.00 0.00 ATOM 865 C GLN A 110 0.753 6.835 19.529 1.00 0.00 ATOM 866 N LEU A 111 0.450 7.948 18.922 1.00 0.00 ATOM 867 CA LEU A 111 0.520 9.232 19.635 1.00 0.00 ATOM 868 CB LEU A 111 0.123 10.381 18.699 1.00 0.00 ATOM 869 CG LEU A 111 1.019 10.555 17.495 1.00 0.00 ATOM 870 CD1 LEU A 111 0.544 11.718 16.653 1.00 0.00 ATOM 871 CD2 LEU A 111 2.434 10.766 18.001 1.00 0.00 ATOM 872 O LEU A 111 -0.087 9.865 21.865 1.00 0.00 ATOM 873 C LEU A 111 -0.420 9.279 20.832 1.00 0.00 ATOM 874 N LEU A 112 -1.631 8.731 20.693 1.00 0.00 ATOM 875 CA LEU A 112 -2.577 8.727 21.801 1.00 0.00 ATOM 876 CB LEU A 112 -3.911 8.132 21.342 1.00 0.00 ATOM 877 CG LEU A 112 -4.733 8.978 20.370 1.00 0.00 ATOM 878 CD1 LEU A 112 -5.933 8.197 19.858 1.00 0.00 ATOM 879 CD2 LEU A 112 -5.241 10.239 21.050 1.00 0.00 ATOM 880 O LEU A 112 -2.088 8.294 24.119 1.00 0.00 ATOM 881 C LEU A 112 -1.967 7.915 22.950 1.00 0.00 ATOM 882 N ILE A 113 -1.315 6.831 22.591 1.00 0.00 ATOM 883 CA ILE A 113 -0.667 5.980 23.595 1.00 0.00 ATOM 884 CB ILE A 113 -0.013 4.738 22.962 1.00 0.00 ATOM 885 CG1 ILE A 113 -1.079 3.825 22.355 1.00 0.00 ATOM 886 CG2 ILE A 113 0.757 3.950 24.010 1.00 0.00 ATOM 887 CD1 ILE A 113 -0.516 2.723 21.485 1.00 0.00 ATOM 888 O ILE A 113 0.428 6.805 25.566 1.00 0.00 ATOM 889 C ILE A 113 0.403 6.784 24.338 1.00 0.00 ATOM 890 N PRO A 114 1.253 7.498 23.604 1.00 0.00 ATOM 891 CA PRO A 114 2.271 8.301 24.276 1.00 0.00 ATOM 892 CB PRO A 114 3.113 8.839 23.114 1.00 0.00 ATOM 893 CG PRO A 114 2.961 7.783 22.061 1.00 0.00 ATOM 894 CD PRO A 114 1.486 7.462 22.148 1.00 0.00 ATOM 895 O PRO A 114 2.092 9.677 26.232 1.00 0.00 ATOM 896 C PRO A 114 1.605 9.371 25.143 1.00 0.00 ATOM 897 N GLN A 115 0.499 9.947 24.672 1.00 0.00 ATOM 898 CA GLN A 115 -0.193 10.964 25.470 1.00 0.00 ATOM 899 CB GLN A 115 -1.459 11.437 24.755 1.00 0.00 ATOM 900 CG GLN A 115 -1.196 12.278 23.517 1.00 0.00 ATOM 901 CD GLN A 115 -2.467 12.632 22.771 1.00 0.00 ATOM 902 OE1 GLN A 115 -3.554 12.176 23.126 1.00 0.00 ATOM 903 NE2 GLN A 115 -2.335 13.450 21.733 1.00 0.00 ATOM 904 O GLN A 115 -0.425 11.018 27.865 1.00 0.00 ATOM 905 C GLN A 115 -0.583 10.377 26.827 1.00 0.00 ATOM 906 N ALA A 116 -1.072 9.141 26.820 1.00 0.00 ATOM 907 CA ALA A 116 -1.477 8.516 28.070 1.00 0.00 ATOM 908 CB ALA A 116 -2.192 7.202 27.799 1.00 0.00 ATOM 909 O ALA A 116 -0.443 8.226 30.212 1.00 0.00 ATOM 910 C ALA A 116 -0.305 8.221 28.988 1.00 0.00 ATOM 911 N LEU A 117 0.857 7.975 28.393 1.00 0.00 ATOM 912 CA LEU A 117 2.068 7.664 29.139 1.00 0.00 ATOM 913 CB LEU A 117 3.091 6.977 28.232 1.00 0.00 ATOM 914 CG LEU A 117 2.691 5.608 27.676 1.00 0.00 ATOM 915 CD1 LEU A 117 3.752 5.088 26.718 1.00 0.00 ATOM 916 CD2 LEU A 117 2.528 4.598 28.801 1.00 0.00 ATOM 917 O LEU A 117 3.561 8.756 30.656 1.00 0.00 ATOM 918 C LEU A 117 2.760 8.886 29.731 1.00 0.00 ATOM 919 N GLN A 118 2.471 10.056 29.172 1.00 0.00 ATOM 920 CA GLN A 118 3.139 11.293 29.581 1.00 0.00 ATOM 921 CB GLN A 118 2.411 12.509 29.007 1.00 0.00 ATOM 922 CG GLN A 118 2.614 12.706 27.513 1.00 0.00 ATOM 923 CD GLN A 118 1.834 13.887 26.968 1.00 0.00 ATOM 924 OE1 GLN A 118 1.108 14.554 27.703 1.00 0.00 ATOM 925 NE2 GLN A 118 1.985 14.148 25.675 1.00 0.00 ATOM 926 O GLN A 118 4.346 12.112 31.482 1.00 0.00 ATOM 927 C GLN A 118 3.285 11.661 31.054 1.00 0.00 ATOM 928 N VAL A 119 2.270 11.449 31.834 1.00 0.00 ATOM 929 CA VAL A 119 2.344 11.764 33.256 1.00 0.00 ATOM 930 CB VAL A 119 1.035 11.403 33.984 1.00 0.00 ATOM 931 CG1 VAL A 119 1.197 11.570 35.486 1.00 0.00 ATOM 932 CG2 VAL A 119 -0.098 12.305 33.519 1.00 0.00 ATOM 933 O VAL A 119 4.385 11.648 34.511 1.00 0.00 ATOM 934 C VAL A 119 3.446 11.032 33.993 1.00 0.00 ATOM 935 N PRO A 120 3.367 9.709 34.007 1.00 0.00 ATOM 936 CA PRO A 120 4.365 8.931 34.718 1.00 0.00 ATOM 937 CB PRO A 120 3.742 7.537 34.823 1.00 0.00 ATOM 938 CG PRO A 120 2.751 7.487 33.709 1.00 0.00 ATOM 939 CD PRO A 120 2.214 8.883 33.565 1.00 0.00 ATOM 940 O PRO A 120 6.748 8.855 34.604 1.00 0.00 ATOM 941 C PRO A 120 5.689 8.877 33.980 1.00 0.00 ATOM 942 N PHE A 121 5.633 8.857 32.628 1.00 0.00 ATOM 943 CA PHE A 121 6.889 8.793 31.865 1.00 0.00 ATOM 944 CB PHE A 121 6.604 8.523 30.386 1.00 0.00 ATOM 945 CG PHE A 121 7.841 8.428 29.539 1.00 0.00 ATOM 946 CD1 PHE A 121 8.616 7.281 29.548 1.00 0.00 ATOM 947 CD2 PHE A 121 8.229 9.484 28.733 1.00 0.00 ATOM 948 CE1 PHE A 121 9.754 7.193 28.767 1.00 0.00 ATOM 949 CE2 PHE A 121 9.366 9.396 27.954 1.00 0.00 ATOM 950 CZ PHE A 121 10.128 8.257 27.969 1.00 0.00 ATOM 951 O PHE A 121 8.955 10.034 32.012 1.00 0.00 ATOM 952 C PHE A 121 7.706 10.081 31.930 1.00 0.00 ATOM 953 N ILE A 122 6.997 11.207 31.856 1.00 0.00 ATOM 954 CA ILE A 122 7.636 12.512 32.000 1.00 0.00 ATOM 955 CB ILE A 122 6.602 13.652 31.976 1.00 0.00 ATOM 956 CG1 ILE A 122 5.965 13.766 30.589 1.00 0.00 ATOM 957 CG2 ILE A 122 7.265 14.981 32.310 1.00 0.00 ATOM 958 CD1 ILE A 122 4.755 14.672 30.543 1.00 0.00 ATOM 959 O ILE A 122 9.574 12.823 33.453 1.00 0.00 ATOM 960 C ILE A 122 8.374 12.513 33.368 1.00 0.00 ATOM 961 N ALA A 123 7.650 12.087 34.438 1.00 0.00 ATOM 962 CA ALA A 123 8.224 12.051 35.800 1.00 0.00 ATOM 963 CB ALA A 123 7.196 11.534 36.795 1.00 0.00 ATOM 964 O ALA A 123 10.453 11.514 36.527 1.00 0.00 ATOM 965 C ALA A 123 9.435 11.149 35.897 1.00 0.00 ATOM 966 N TYR A 124 9.342 9.961 35.287 1.00 0.00 ATOM 967 CA TYR A 124 10.484 9.029 35.243 1.00 0.00 ATOM 968 CB TYR A 124 10.182 8.064 33.933 1.00 0.00 ATOM 969 CG TYR A 124 11.001 6.789 33.800 1.00 0.00 ATOM 970 CD1 TYR A 124 10.594 5.626 34.472 1.00 0.00 ATOM 971 CD2 TYR A 124 12.175 6.742 33.045 1.00 0.00 ATOM 972 CE1 TYR A 124 11.339 4.429 34.393 1.00 0.00 ATOM 973 CE2 TYR A 124 12.943 5.542 32.958 1.00 0.00 ATOM 974 CZ TYR A 124 12.488 4.382 33.648 1.00 0.00 ATOM 975 OH TYR A 124 13.168 3.180 33.552 1.00 0.00 ATOM 976 O TYR A 124 12.827 9.620 35.035 1.00 0.00 ATOM 977 C TYR A 124 11.689 9.673 34.530 1.00 0.00 ATOM 978 N LEU A 125 11.461 10.332 33.409 1.00 0.00 ATOM 979 CA LEU A 125 12.549 11.001 32.681 1.00 0.00 ATOM 980 CB LEU A 125 12.031 11.570 31.358 1.00 0.00 ATOM 981 CG LEU A 125 13.065 12.266 30.469 1.00 0.00 ATOM 982 CD1 LEU A 125 14.168 11.299 30.071 1.00 0.00 ATOM 983 CD2 LEU A 125 12.413 12.794 29.201 1.00 0.00 ATOM 984 O LEU A 125 14.342 12.356 33.584 1.00 0.00 ATOM 985 C LEU A 125 13.129 12.141 33.498 1.00 0.00 ATOM 986 N GLN A 126 12.249 12.894 34.136 1.00 0.00 ATOM 987 CA GLN A 126 12.727 14.028 35.022 1.00 0.00 ATOM 988 CB GLN A 126 11.536 14.760 35.645 1.00 0.00 ATOM 989 CG GLN A 126 10.729 15.585 34.658 1.00 0.00 ATOM 990 CD GLN A 126 9.485 16.188 35.281 1.00 0.00 ATOM 991 OE1 GLN A 126 9.173 15.926 36.442 1.00 0.00 ATOM 992 NE2 GLN A 126 8.770 16.996 34.508 1.00 0.00 ATOM 993 O GLN A 126 14.669 14.054 36.406 1.00 0.00 ATOM 994 C GLN A 126 13.605 13.502 36.139 1.00 0.00 ATOM 995 N ARG A 127 13.187 12.398 36.742 1.00 0.00 ATOM 996 CA ARG A 127 13.979 11.809 37.808 1.00 0.00 ATOM 997 CB ARG A 127 13.290 10.315 37.943 1.00 0.00 ATOM 998 CG ARG A 127 13.898 9.363 38.951 1.00 0.00 ATOM 999 CD ARG A 127 13.556 7.931 38.561 1.00 0.00 ATOM 1000 NE ARG A 127 12.115 7.763 38.365 1.00 0.00 ATOM 1001 CZ ARG A 127 11.241 7.683 39.358 1.00 0.00 ATOM 1002 NH1 ARG A 127 11.670 7.747 40.618 1.00 0.00 ATOM 1003 NH2 ARG A 127 9.955 7.528 39.094 1.00 0.00 ATOM 1004 O ARG A 127 16.322 11.337 37.921 1.00 0.00 ATOM 1005 C ARG A 127 15.276 11.281 37.282 1.00 0.00 ATOM 1006 N CYS A 128 15.236 10.709 36.084 1.00 0.00 ATOM 1007 CA CYS A 128 16.466 10.168 35.479 1.00 0.00 ATOM 1008 CB CYS A 128 16.167 9.568 34.104 1.00 0.00 ATOM 1009 SG CYS A 128 15.178 8.055 34.148 1.00 0.00 ATOM 1010 O CYS A 128 18.759 10.981 35.301 1.00 0.00 ATOM 1011 C CYS A 128 17.565 11.284 35.287 1.00 0.00 ATOM 1012 N ILE A 129 17.138 12.506 34.917 1.00 0.00 ATOM 1013 CA ILE A 129 18.063 13.608 34.713 1.00 0.00 ATOM 1014 CB ILE A 129 17.349 14.846 34.141 1.00 0.00 ATOM 1015 CG1 ILE A 129 16.850 14.567 32.722 1.00 0.00 ATOM 1016 CG2 ILE A 129 18.297 16.034 34.093 1.00 0.00 ATOM 1017 CD1 ILE A 129 15.927 15.636 32.177 1.00 0.00 ATOM 1018 O ILE A 129 19.803 14.755 35.916 1.00 0.00 ATOM 1019 C ILE A 129 18.775 14.094 35.967 1.00 0.00 ATOM 1020 N ASP A 130 18.111 13.440 37.008 1.00 0.00 ATOM 1021 CA ASP A 130 18.820 13.922 38.173 1.00 0.00 ATOM 1022 CB ASP A 130 18.133 13.444 39.453 1.00 0.00 ATOM 1023 CG ASP A 130 16.823 14.162 39.715 1.00 0.00 ATOM 1024 OD1 ASP A 130 16.558 15.179 39.040 1.00 0.00 ATOM 1025 OD2 ASP A 130 16.063 13.708 40.596 1.00 0.00 ATOM 1026 O ASP A 130 21.110 13.942 38.931 1.00 0.00 ATOM 1027 C ASP A 130 20.263 13.421 38.201 1.00 0.00 ATOM 1028 N ALA A 131 20.526 12.394 37.395 1.00 0.00 ATOM 1029 CA ALA A 131 21.856 11.800 37.276 1.00 0.00 ATOM 1030 CB ALA A 131 21.752 10.345 36.848 1.00 0.00 ATOM 1031 O ALA A 131 22.199 12.699 35.074 1.00 0.00 ATOM 1032 C ALA A 131 22.619 12.608 36.227 1.00 0.00 ATOM 1033 N VAL A 132 23.752 13.213 36.610 1.00 0.00 ATOM 1034 CA VAL A 132 24.517 14.001 35.643 1.00 0.00 ATOM 1035 CB VAL A 132 25.825 14.533 36.257 1.00 0.00 ATOM 1036 CG1 VAL A 132 26.696 15.170 35.185 1.00 0.00 ATOM 1037 CG2 VAL A 132 25.527 15.582 37.319 1.00 0.00 ATOM 1038 O VAL A 132 24.914 13.751 33.294 1.00 0.00 ATOM 1039 C VAL A 132 24.911 13.209 34.399 1.00 0.00 ATOM 1040 N GLY A 133 25.230 11.930 34.567 1.00 0.00 ATOM 1041 CA GLY A 133 25.626 11.133 33.415 1.00 0.00 ATOM 1042 O GLY A 133 24.692 10.902 31.223 1.00 0.00 ATOM 1043 C GLY A 133 24.476 10.967 32.433 1.00 0.00 ATOM 1044 N LEU A 134 23.255 10.895 32.958 1.00 0.00 ATOM 1045 CA LEU A 134 22.078 10.734 32.110 1.00 0.00 ATOM 1046 CB LEU A 134 20.822 10.685 32.891 1.00 0.00 ATOM 1047 CG LEU A 134 20.658 9.334 33.542 1.00 0.00 ATOM 1048 CD1 LEU A 134 19.572 9.352 34.655 1.00 0.00 ATOM 1049 CD2 LEU A 134 20.330 8.329 32.492 1.00 0.00 ATOM 1050 O LEU A 134 21.710 11.791 29.990 1.00 0.00 ATOM 1051 C LEU A 134 21.957 11.939 31.184 1.00 0.00 ATOM 1052 N ALA A 135 22.138 13.128 31.739 1.00 0.00 ATOM 1053 CA ALA A 135 22.050 14.357 30.968 1.00 0.00 ATOM 1054 CB ALA A 135 22.205 15.574 31.867 1.00 0.00 ATOM 1055 O ALA A 135 22.886 14.737 28.758 1.00 0.00 ATOM 1056 C ALA A 135 23.143 14.386 29.904 1.00 0.00 ATOM 1057 N GLN A 136 24.362 13.993 30.285 1.00 0.00 ATOM 1058 CA GLN A 136 25.490 13.990 29.360 1.00 0.00 ATOM 1059 CB GLN A 136 26.767 13.569 30.087 1.00 0.00 ATOM 1060 CG GLN A 136 27.295 14.606 31.064 1.00 0.00 ATOM 1061 CD GLN A 136 28.483 14.104 31.862 1.00 0.00 ATOM 1062 OE1 GLN A 136 28.875 12.943 31.746 1.00 0.00 ATOM 1063 NE2 GLN A 136 29.061 14.980 32.676 1.00 0.00 ATOM 1064 O GLN A 136 25.467 13.391 27.039 1.00 0.00 ATOM 1065 C GLN A 136 25.274 13.022 28.198 1.00 0.00 ATOM 1066 N GLN A 137 24.872 11.789 28.515 1.00 0.00 ATOM 1067 CA GLN A 137 24.625 10.803 27.467 1.00 0.00 ATOM 1068 CB GLN A 137 24.153 9.485 28.087 1.00 0.00 ATOM 1069 CG GLN A 137 24.006 8.347 27.089 1.00 0.00 ATOM 1070 CD GLN A 137 25.325 7.957 26.452 1.00 0.00 ATOM 1071 OE1 GLN A 137 26.337 7.808 27.137 1.00 0.00 ATOM 1072 NE2 GLN A 137 25.318 7.791 25.135 1.00 0.00 ATOM 1073 O GLN A 137 23.709 11.134 25.275 1.00 0.00 ATOM 1074 C GLN A 137 23.567 11.300 26.487 1.00 0.00 ATOM 1075 N VAL A 138 22.513 11.912 27.016 1.00 0.00 ATOM 1076 CA VAL A 138 21.443 12.432 26.171 1.00 0.00 ATOM 1077 CB VAL A 138 20.312 13.051 27.012 1.00 0.00 ATOM 1078 CG1 VAL A 138 19.303 13.751 26.114 1.00 0.00 ATOM 1079 CG2 VAL A 138 19.585 11.973 27.802 1.00 0.00 ATOM 1080 O VAL A 138 21.628 13.492 24.034 1.00 0.00 ATOM 1081 C VAL A 138 21.948 13.513 25.221 1.00 0.00 ATOM 1082 N ILE A 139 22.731 14.461 25.734 1.00 0.00 ATOM 1083 CA ILE A 139 23.252 15.526 24.883 1.00 0.00 ATOM 1084 CB ILE A 139 24.119 16.515 25.684 1.00 0.00 ATOM 1085 CG1 ILE A 139 23.255 17.304 26.671 1.00 0.00 ATOM 1086 CG2 ILE A 139 24.805 17.500 24.751 1.00 0.00 ATOM 1087 CD1 ILE A 139 24.053 18.102 27.678 1.00 0.00 ATOM 1088 O ILE A 139 24.028 15.407 22.617 1.00 0.00 ATOM 1089 C ILE A 139 24.117 14.959 23.760 1.00 0.00 ATOM 1090 N ASN A 140 24.897 13.978 24.119 1.00 0.00 ATOM 1091 CA ASN A 140 25.773 13.342 23.138 1.00 0.00 ATOM 1092 CB ASN A 140 26.657 12.273 23.783 1.00 0.00 ATOM 1093 CG ASN A 140 27.764 12.867 24.631 1.00 0.00 ATOM 1094 ND2 ASN A 140 28.312 12.064 25.535 1.00 0.00 ATOM 1095 OD1 ASN A 140 28.121 14.035 24.472 1.00 0.00 ATOM 1096 O ASN A 140 25.182 12.850 20.866 1.00 0.00 ATOM 1097 C ASN A 140 24.904 12.701 22.060 1.00 0.00 ATOM 1098 N GLU A 141 23.825 12.091 22.483 1.00 0.00 ATOM 1099 CA GLU A 141 22.916 11.415 21.551 1.00 0.00 ATOM 1100 CB GLU A 141 21.807 10.703 22.328 1.00 0.00 ATOM 1101 CG GLU A 141 20.844 9.917 21.455 1.00 0.00 ATOM 1102 CD GLU A 141 19.780 9.198 22.262 1.00 0.00 ATOM 1103 OE1 GLU A 141 19.795 9.318 23.506 1.00 0.00 ATOM 1104 OE2 GLU A 141 18.930 8.516 21.651 1.00 0.00 ATOM 1105 O GLU A 141 22.189 12.146 19.380 1.00 0.00 ATOM 1106 C GLU A 141 22.246 12.398 20.585 1.00 0.00 ATOM 1107 N LEU A 142 21.732 13.509 21.109 1.00 0.00 ATOM 1108 CA LEU A 142 21.075 14.498 20.254 1.00 0.00 ATOM 1109 CB LEU A 142 20.521 15.650 21.097 1.00 0.00 ATOM 1110 CG LEU A 142 19.324 15.320 21.992 1.00 0.00 ATOM 1111 CD1 LEU A 142 18.994 16.494 22.900 1.00 0.00 ATOM 1112 CD2 LEU A 142 18.095 15.007 21.153 1.00 0.00 ATOM 1113 O LEU A 142 21.770 15.276 18.085 1.00 0.00 ATOM 1114 C LEU A 142 22.087 15.059 19.256 1.00 0.00 ATOM 1115 N ASP A 143 23.307 15.298 19.725 1.00 0.00 ATOM 1116 CA ASP A 143 24.353 15.825 18.858 1.00 0.00 ATOM 1117 CB ASP A 143 25.612 16.140 19.669 1.00 0.00 ATOM 1118 CG ASP A 143 25.453 17.373 20.537 1.00 0.00 ATOM 1119 OD1 ASP A 143 24.473 18.121 20.333 1.00 0.00 ATOM 1120 OD2 ASP A 143 26.307 17.592 21.421 1.00 0.00 ATOM 1121 O ASP A 143 24.906 15.205 16.609 1.00 0.00 ATOM 1122 C ASP A 143 24.717 14.827 17.764 1.00 0.00 ATOM 1123 N ASP A 144 24.828 13.557 18.135 1.00 0.00 ATOM 1124 CA ASP A 144 25.169 12.525 17.162 1.00 0.00 ATOM 1125 CB ASP A 144 25.370 11.170 17.845 1.00 0.00 ATOM 1126 CG ASP A 144 26.665 11.099 18.628 1.00 0.00 ATOM 1127 OD1 ASP A 144 27.519 11.991 18.448 1.00 0.00 ATOM 1128 OD2 ASP A 144 26.827 10.148 19.423 1.00 0.00 ATOM 1129 O ASP A 144 24.291 12.251 14.941 1.00 0.00 ATOM 1130 C ASP A 144 24.039 12.397 16.141 1.00 0.00 ATOM 1131 N LEU A 145 22.795 12.436 16.611 1.00 0.00 ATOM 1132 CA LEU A 145 21.659 12.345 15.697 1.00 0.00 ATOM 1133 CB LEU A 145 20.360 12.433 16.520 1.00 0.00 ATOM 1134 CG LEU A 145 19.110 12.355 15.637 1.00 0.00 ATOM 1135 CD1 LEU A 145 18.960 11.075 14.844 1.00 0.00 ATOM 1136 CD2 LEU A 145 17.894 12.524 16.564 1.00 0.00 ATOM 1137 O LEU A 145 21.454 13.260 13.495 1.00 0.00 ATOM 1138 C LEU A 145 21.716 13.476 14.677 1.00 0.00 ATOM 1139 N LEU A 146 22.057 14.679 15.128 1.00 0.00 ATOM 1140 CA LEU A 146 22.151 15.814 14.218 1.00 0.00 ATOM 1141 CB LEU A 146 22.486 17.092 14.963 1.00 0.00 ATOM 1142 CG LEU A 146 22.593 18.330 14.070 1.00 0.00 ATOM 1143 CD1 LEU A 146 21.267 18.609 13.380 1.00 0.00 ATOM 1144 CD2 LEU A 146 23.041 19.520 14.910 1.00 0.00 ATOM 1145 O LEU A 146 22.971 15.803 11.966 1.00 0.00 ATOM 1146 C LEU A 146 23.202 15.543 13.146 1.00 0.00 ATOM 1147 N GLU A 147 24.350 15.010 13.557 1.00 0.00 ATOM 1148 CA GLU A 147 25.424 14.711 12.617 1.00 0.00 ATOM 1149 CB GLU A 147 26.655 14.188 13.361 1.00 0.00 ATOM 1150 CG GLU A 147 27.377 15.242 14.184 1.00 0.00 ATOM 1151 CD GLU A 147 28.516 14.663 15.002 1.00 0.00 ATOM 1152 OE1 GLU A 147 28.693 13.428 14.983 1.00 0.00 ATOM 1153 OE2 GLU A 147 29.231 15.446 15.663 1.00 0.00 ATOM 1154 O GLU A 147 25.298 13.738 10.419 1.00 0.00 ATOM 1155 C GLU A 147 24.991 13.637 11.612 1.00 0.00 ATOM 1156 N ALA A 148 24.285 12.632 12.084 1.00 0.00 ATOM 1157 CA ALA A 148 23.823 11.568 11.193 1.00 0.00 ATOM 1158 CB ALA A 148 23.163 10.458 11.995 1.00 0.00 ATOM 1159 O ALA A 148 22.846 11.772 9.001 1.00 0.00 ATOM 1160 C ALA A 148 22.814 12.114 10.187 1.00 0.00 ATOM 1161 N GLY A 149 21.917 12.969 10.662 1.00 0.00 ATOM 1162 CA GLY A 149 20.939 13.584 9.787 1.00 0.00 ATOM 1163 O GLY A 149 21.353 14.353 7.546 1.00 0.00 ATOM 1164 C GLY A 149 21.669 14.422 8.732 1.00 0.00 ATOM 1165 N PHE A 150 22.647 15.208 9.171 1.00 0.00 ATOM 1166 CA PHE A 150 23.416 16.053 8.260 1.00 0.00 ATOM 1167 CB PHE A 150 24.478 16.842 9.029 1.00 0.00 ATOM 1168 CG PHE A 150 25.320 17.732 8.160 1.00 0.00 ATOM 1169 CD1 PHE A 150 24.836 18.954 7.723 1.00 0.00 ATOM 1170 CD2 PHE A 150 26.594 17.349 7.779 1.00 0.00 ATOM 1171 CE1 PHE A 150 25.611 19.773 6.924 1.00 0.00 ATOM 1172 CE2 PHE A 150 27.366 18.168 6.980 1.00 0.00 ATOM 1173 CZ PHE A 150 26.880 19.376 6.552 1.00 0.00 ATOM 1174 O PHE A 150 24.177 15.620 6.026 1.00 0.00 ATOM 1175 C PHE A 150 24.131 15.229 7.193 1.00 0.00 ATOM 1176 N ARG A 151 24.707 14.107 7.610 1.00 0.00 ATOM 1177 CA ARG A 151 25.450 13.224 6.710 1.00 0.00 ATOM 1178 CB ARG A 151 26.368 12.295 7.508 1.00 0.00 ATOM 1179 CG ARG A 151 27.495 13.012 8.234 1.00 0.00 ATOM 1180 CD ARG A 151 28.354 12.034 9.020 1.00 0.00 ATOM 1181 NE ARG A 151 29.102 11.136 8.144 1.00 0.00 ATOM 1182 CZ ARG A 151 29.860 10.133 8.574 1.00 0.00 ATOM 1183 NH1 ARG A 151 30.504 9.367 7.703 1.00 0.00 ATOM 1184 NH2 ARG A 151 29.973 9.896 9.873 1.00 0.00 ATOM 1185 O ARG A 151 25.048 11.649 4.950 1.00 0.00 ATOM 1186 C ARG A 151 24.562 12.330 5.851 1.00 0.00 ATOM 1187 N GLY A 152 23.259 12.345 6.118 1.00 0.00 ATOM 1188 CA GLY A 152 22.350 11.505 5.364 1.00 0.00 ATOM 1189 O GLY A 152 22.503 9.202 4.729 1.00 0.00 ATOM 1190 C GLY A 152 22.647 10.038 5.620 1.00 0.00 ATOM 1191 N ARG A 153 23.053 9.725 6.847 1.00 0.00 ATOM 1192 CA ARG A 153 23.390 8.355 7.225 1.00 0.00 ATOM 1193 CB ARG A 153 24.076 7.883 8.183 1.00 0.00 ATOM 1194 CG ARG A 153 25.501 7.653 7.668 1.00 0.00 ATOM 1195 CD ARG A 153 25.608 6.571 6.571 1.00 0.00 ATOM 1196 NE ARG A 153 25.698 5.236 7.173 1.00 0.00 ATOM 1197 CZ ARG A 153 25.268 4.138 6.557 1.00 0.00 ATOM 1198 NH1 ARG A 153 24.721 4.169 5.358 1.00 0.00 ATOM 1199 NH2 ARG A 153 25.394 2.969 7.192 1.00 0.00 ATOM 1200 O ARG A 153 21.041 7.823 7.169 1.00 0.00 ATOM 1201 C ARG A 153 22.197 7.400 7.174 1.00 0.00 ATOM 1202 N GLU A 154 22.489 6.104 7.103 1.00 0.00 ATOM 1203 CA GLU A 154 21.443 5.089 7.047 1.00 0.00 ATOM 1204 CB GLU A 154 21.553 4.276 5.755 1.00 0.00 ATOM 1205 CG GLU A 154 20.453 3.243 5.578 1.00 0.00 ATOM 1206 CD GLU A 154 20.595 2.458 4.287 1.00 0.00 ATOM 1207 OE1 GLU A 154 21.481 2.803 3.477 1.00 0.00 ATOM 1208 OE2 GLU A 154 19.820 1.499 4.088 1.00 0.00 ATOM 1209 O GLU A 154 21.072 4.414 9.322 1.00 0.00 ATOM 1210 C GLU A 154 21.549 4.121 8.224 1.00 0.00 ATOM 1211 N VAL A 155 22.442 3.055 7.993 1.00 0.00 ATOM 1212 CA VAL A 155 22.579 2.053 9.045 1.00 0.00 ATOM 1213 CB VAL A 155 23.580 0.953 8.650 1.00 0.00 ATOM 1214 CG1 VAL A 155 23.857 0.036 9.832 1.00 0.00 ATOM 1215 CG2 VAL A 155 23.026 0.111 7.509 1.00 0.00 ATOM 1216 O VAL A 155 22.697 2.170 11.437 1.00 0.00 ATOM 1217 C VAL A 155 23.070 2.639 10.364 1.00 0.00 ATOM 1218 N ASP A 156 23.906 3.668 10.282 1.00 0.00 ATOM 1219 CA ASP A 156 24.436 4.287 11.483 1.00 0.00 ATOM 1220 CB ASP A 156 25.384 5.432 11.122 1.00 0.00 ATOM 1221 CG ASP A 156 26.708 4.942 10.571 1.00 0.00 ATOM 1222 OD1 ASP A 156 26.986 3.729 10.684 1.00 0.00 ATOM 1223 OD2 ASP A 156 27.469 5.769 10.025 1.00 0.00 ATOM 1224 O ASP A 156 23.471 4.856 13.594 1.00 0.00 ATOM 1225 C ASP A 156 23.345 4.866 12.374 1.00 0.00 ATOM 1226 N PHE A 157 22.260 5.331 11.766 1.00 0.00 ATOM 1227 CA PHE A 157 21.161 5.906 12.532 1.00 0.00 ATOM 1228 CB PHE A 157 20.083 6.452 11.595 1.00 0.00 ATOM 1229 CG PHE A 157 18.893 7.028 12.308 1.00 0.00 ATOM 1230 CD1 PHE A 157 18.945 8.298 12.856 1.00 0.00 ATOM 1231 CD2 PHE A 157 17.723 6.300 12.433 1.00 0.00 ATOM 1232 CE1 PHE A 157 17.850 8.828 13.513 1.00 0.00 ATOM 1233 CE2 PHE A 157 16.630 6.829 13.090 1.00 0.00 ATOM 1234 CZ PHE A 157 16.689 8.088 13.628 1.00 0.00 ATOM 1235 O PHE A 157 20.332 5.083 14.636 1.00 0.00 ATOM 1236 C PHE A 157 20.517 4.855 13.438 1.00 0.00 ATOM 1237 N VAL A 158 20.184 3.716 12.855 1.00 0.00 ATOM 1238 CA VAL A 158 19.591 2.621 13.612 1.00 0.00 ATOM 1239 CB VAL A 158 19.307 1.402 12.714 1.00 0.00 ATOM 1240 CG1 VAL A 158 18.877 0.210 13.556 1.00 0.00 ATOM 1241 CG2 VAL A 158 18.197 1.718 11.723 1.00 0.00 ATOM 1242 O VAL A 158 20.126 2.033 15.888 1.00 0.00 ATOM 1243 C VAL A 158 20.529 2.171 14.731 1.00 0.00 ATOM 1244 N ALA A 159 21.786 1.939 14.377 1.00 0.00 ATOM 1245 CA ALA A 159 22.774 1.478 15.346 1.00 0.00 ATOM 1246 CB ALA A 159 24.107 1.218 14.662 1.00 0.00 ATOM 1247 O ALA A 159 23.117 2.125 17.628 1.00 0.00 ATOM 1248 C ALA A 159 22.993 2.492 16.460 1.00 0.00 ATOM 1249 N LYS A 160 23.072 3.763 16.090 1.00 0.00 ATOM 1250 CA LYS A 160 23.286 4.831 17.058 1.00 0.00 ATOM 1251 CB LYS A 160 23.461 6.178 16.354 1.00 0.00 ATOM 1252 CG LYS A 160 24.758 6.305 15.571 1.00 0.00 ATOM 1253 CD LYS A 160 24.869 7.665 14.903 1.00 0.00 ATOM 1254 CE LYS A 160 26.150 7.781 14.092 1.00 0.00 ATOM 1255 NZ LYS A 160 26.259 9.100 13.412 1.00 0.00 ATOM 1256 O LYS A 160 22.329 5.112 19.239 1.00 0.00 ATOM 1257 C LYS A 160 22.121 4.950 18.036 1.00 0.00 ATOM 1258 N MET A 161 20.894 4.863 17.527 1.00 0.00 ATOM 1259 CA MET A 161 19.725 4.965 18.387 1.00 0.00 ATOM 1260 CB MET A 161 18.448 5.040 17.547 1.00 0.00 ATOM 1261 CG MET A 161 18.298 6.333 16.762 1.00 0.00 ATOM 1262 SD MET A 161 18.232 7.789 17.823 1.00 0.00 ATOM 1263 CE MET A 161 16.652 7.549 18.629 1.00 0.00 ATOM 1264 O MET A 161 19.345 3.899 20.506 1.00 0.00 ATOM 1265 C MET A 161 19.622 3.751 19.314 1.00 0.00 ATOM 1266 N ILE A 162 19.855 2.556 18.778 1.00 0.00 ATOM 1267 CA ILE A 162 19.803 1.346 19.598 1.00 0.00 ATOM 1268 CB ILE A 162 20.051 0.082 18.755 1.00 0.00 ATOM 1269 CG1 ILE A 162 18.891 -0.150 17.784 1.00 0.00 ATOM 1270 CG2 ILE A 162 20.179 -1.140 19.653 1.00 0.00 ATOM 1271 CD1 ILE A 162 19.170 -1.207 16.740 1.00 0.00 ATOM 1272 O ILE A 162 20.610 1.065 21.840 1.00 0.00 ATOM 1273 C ILE A 162 20.866 1.423 20.691 1.00 0.00 ATOM 1274 N ASN A 163 22.062 1.937 20.341 1.00 0.00 ATOM 1275 CA ASN A 163 23.145 2.066 21.307 1.00 0.00 ATOM 1276 CB ASN A 163 24.419 2.567 20.624 1.00 0.00 ATOM 1277 CG ASN A 163 25.079 1.503 19.770 1.00 0.00 ATOM 1278 ND2 ASN A 163 25.925 1.932 18.840 1.00 0.00 ATOM 1279 OD1 ASN A 163 24.832 0.310 19.947 1.00 0.00 ATOM 1280 O ASN A 163 23.011 2.831 23.577 1.00 0.00 ATOM 1281 C ASN A 163 22.757 3.063 22.395 1.00 0.00 ATOM 1282 N GLU A 164 22.138 4.174 22.006 1.00 0.00 ATOM 1283 CA GLU A 164 21.720 5.160 22.994 1.00 0.00 ATOM 1284 CB GLU A 164 21.100 6.379 22.307 1.00 0.00 ATOM 1285 CG GLU A 164 22.099 7.245 21.558 1.00 0.00 ATOM 1286 CD GLU A 164 23.193 7.782 22.459 1.00 0.00 ATOM 1287 OE1 GLU A 164 22.863 8.380 23.504 1.00 0.00 ATOM 1288 OE2 GLU A 164 24.382 7.604 22.120 1.00 0.00 ATOM 1289 O GLU A 164 20.710 4.779 25.142 1.00 0.00 ATOM 1290 C GLU A 164 20.682 4.546 23.937 1.00 0.00 ATOM 1291 N LEU A 165 19.760 3.767 23.381 1.00 0.00 ATOM 1292 CA LEU A 165 18.750 3.136 24.215 1.00 0.00 ATOM 1293 CB LEU A 165 17.783 2.315 23.359 1.00 0.00 ATOM 1294 CG LEU A 165 16.844 3.107 22.447 1.00 0.00 ATOM 1295 CD1 LEU A 165 16.073 2.174 21.528 1.00 0.00 ATOM 1296 CD2 LEU A 165 15.840 3.901 23.270 1.00 0.00 ATOM 1297 O LEU A 165 19.156 2.308 26.454 1.00 0.00 ATOM 1298 C LEU A 165 19.454 2.243 25.259 1.00 0.00 ATOM 1299 N ASP A 166 20.364 1.458 24.805 1.00 0.00 ATOM 1300 CA ASP A 166 21.095 0.548 25.688 1.00 0.00 ATOM 1301 CB ASP A 166 22.070 -0.329 24.899 1.00 0.00 ATOM 1302 CG ASP A 166 21.362 -1.360 24.042 1.00 0.00 ATOM 1303 OD1 ASP A 166 20.145 -1.563 24.239 1.00 0.00 ATOM 1304 OD2 ASP A 166 22.024 -1.966 23.173 1.00 0.00 ATOM 1305 O ASP A 166 21.809 0.925 27.948 1.00 0.00 ATOM 1306 C ASP A 166 21.896 1.268 26.769 1.00 0.00 ATOM 1307 N ILE A 167 22.672 2.269 26.370 1.00 0.00 ATOM 1308 CA ILE A 167 23.499 2.987 27.325 1.00 0.00 ATOM 1309 CB ILE A 167 24.472 3.949 26.617 1.00 0.00 ATOM 1310 CG1 ILE A 167 25.516 3.161 25.822 1.00 0.00 ATOM 1311 CG2 ILE A 167 25.196 4.819 27.634 1.00 0.00 ATOM 1312 CD1 ILE A 167 26.345 4.018 24.890 1.00 0.00 ATOM 1313 O ILE A 167 22.851 3.687 29.536 1.00 0.00 ATOM 1314 C ILE A 167 22.645 3.773 28.323 1.00 0.00 ATOM 1315 N ILE A 168 21.701 4.549 27.817 1.00 0.00 ATOM 1316 CA ILE A 168 20.833 5.331 28.687 1.00 0.00 ATOM 1317 CB ILE A 168 19.936 6.288 27.845 1.00 0.00 ATOM 1318 CG1 ILE A 168 20.800 7.352 27.157 1.00 0.00 ATOM 1319 CG2 ILE A 168 18.869 6.913 28.753 1.00 0.00 ATOM 1320 CD1 ILE A 168 19.981 8.151 26.103 1.00 0.00 ATOM 1321 O ILE A 168 19.820 4.675 30.763 1.00 0.00 ATOM 1322 C ILE A 168 20.060 4.379 29.595 1.00 0.00 ATOM 1323 N GLU A 169 19.684 3.226 29.049 1.00 0.00 ATOM 1324 CA GLU A 169 18.964 2.238 29.832 1.00 0.00 ATOM 1325 CB GLU A 169 18.573 1.044 28.959 1.00 0.00 ATOM 1326 CG GLU A 169 17.759 -0.015 29.685 1.00 0.00 ATOM 1327 CD GLU A 169 17.343 -1.154 28.776 1.00 0.00 ATOM 1328 OE1 GLU A 169 17.674 -1.106 27.573 1.00 0.00 ATOM 1329 OE2 GLU A 169 16.684 -2.094 29.266 1.00 0.00 ATOM 1330 O GLU A 169 19.324 1.569 32.108 1.00 0.00 ATOM 1331 C GLU A 169 19.823 1.802 31.007 1.00 0.00 ATOM 1332 N GLU A 170 21.094 1.684 30.740 1.00 0.00 ATOM 1333 CA GLU A 170 22.030 1.297 31.779 1.00 0.00 ATOM 1334 CB GLU A 170 23.431 1.093 31.200 1.00 0.00 ATOM 1335 CG GLU A 170 23.547 -0.096 30.261 1.00 0.00 ATOM 1336 CD GLU A 170 24.913 -0.195 29.611 1.00 0.00 ATOM 1337 OE1 GLU A 170 25.747 0.707 29.840 1.00 0.00 ATOM 1338 OE2 GLU A 170 25.151 -1.175 28.873 1.00 0.00 ATOM 1339 O GLU A 170 22.066 2.015 34.071 1.00 0.00 ATOM 1340 C GLU A 170 22.101 2.343 32.884 1.00 0.00 ATOM 1341 N ASP A 171 22.205 3.604 32.492 1.00 0.00 ATOM 1342 CA ASP A 171 22.269 4.681 33.466 1.00 0.00 ATOM 1343 CB ASP A 171 22.403 6.034 32.762 1.00 0.00 ATOM 1344 CG ASP A 171 23.779 6.240 32.157 1.00 0.00 ATOM 1345 OD1 ASP A 171 24.695 5.456 32.482 1.00 0.00 ATOM 1346 OD2 ASP A 171 23.940 7.187 31.359 1.00 0.00 ATOM 1347 O ASP A 171 21.049 4.786 35.538 1.00 0.00 ATOM 1348 C ASP A 171 20.995 4.692 34.309 1.00 0.00 ATOM 1349 N THR A 172 19.848 4.578 33.650 1.00 0.00 ATOM 1350 CA THR A 172 18.585 4.572 34.371 1.00 0.00 ATOM 1351 CB THR A 172 17.386 4.518 33.407 1.00 0.00 ATOM 1352 CG2 THR A 172 16.078 4.473 34.184 1.00 0.00 ATOM 1353 OG1 THR A 172 17.387 5.682 32.571 1.00 0.00 ATOM 1354 O THR A 172 17.953 3.507 36.426 1.00 0.00 ATOM 1355 C THR A 172 18.421 3.372 35.294 1.00 0.00 ATOM 1356 N ASP A 173 18.839 2.197 34.828 1.00 0.00 ATOM 1357 CA ASP A 173 18.711 0.993 35.630 1.00 0.00 ATOM 1358 CB ASP A 173 19.192 -0.198 34.810 1.00 0.00 ATOM 1359 CG ASP A 173 18.723 -1.514 35.377 1.00 0.00 ATOM 1360 OD1 ASP A 173 19.103 -1.856 36.528 1.00 0.00 ATOM 1361 OD2 ASP A 173 17.964 -2.203 34.654 1.00 0.00 ATOM 1362 O ASP A 173 19.076 0.715 37.979 1.00 0.00 ATOM 1363 C ASP A 173 19.535 1.101 36.901 1.00 0.00 ATOM 1364 N ASP A 174 20.740 1.644 36.786 1.00 0.00 ATOM 1365 CA ASP A 174 21.601 1.786 37.952 1.00 0.00 ATOM 1366 CB ASP A 174 22.996 2.253 37.534 1.00 0.00 ATOM 1367 CG ASP A 174 23.791 1.165 36.839 1.00 0.00 ATOM 1368 OD1 ASP A 174 23.369 -0.009 36.897 1.00 0.00 ATOM 1369 OD2 ASP A 174 24.837 1.486 36.236 1.00 0.00 ATOM 1370 O ASP A 174 21.166 2.612 40.157 1.00 0.00 ATOM 1371 C ASP A 174 20.972 2.758 38.955 1.00 0.00 ATOM 1372 N LEU A 175 20.306 3.782 38.451 1.00 0.00 ATOM 1373 CA LEU A 175 19.612 4.730 39.320 1.00 0.00 ATOM 1374 CB LEU A 175 19.279 6.012 38.520 1.00 0.00 ATOM 1375 CG LEU A 175 20.440 6.810 37.930 1.00 0.00 ATOM 1376 CD1 LEU A 175 19.900 7.995 37.141 1.00 0.00 ATOM 1377 CD2 LEU A 175 21.349 7.277 39.047 1.00 0.00 ATOM 1378 O LEU A 175 18.167 4.158 41.158 1.00 0.00 ATOM 1379 C LEU A 175 18.400 4.049 39.955 1.00 0.00 ATOM 1380 N GLN A 176 17.621 3.333 39.143 1.00 0.00 ATOM 1381 CA GLN A 176 16.428 2.656 39.631 1.00 0.00 ATOM 1382 CB GLN A 176 15.717 1.986 38.438 1.00 0.00 ATOM 1383 CG GLN A 176 14.236 1.703 38.646 1.00 0.00 ATOM 1384 CD GLN A 176 13.604 1.046 37.430 1.00 0.00 ATOM 1385 OE1 GLN A 176 12.388 0.851 37.375 1.00 0.00 ATOM 1386 NE2 GLN A 176 14.431 0.698 36.448 1.00 0.00 ATOM 1387 O GLN A 176 15.963 1.437 41.646 1.00 0.00 ATOM 1388 C GLN A 176 16.734 1.606 40.702 1.00 0.00 ATOM 1389 N ILE A 177 17.832 0.900 40.541 1.00 0.00 ATOM 1390 CA ILE A 177 18.225 -0.106 41.530 1.00 0.00 ATOM 1391 CB ILE A 177 19.553 -0.786 41.148 1.00 0.00 ATOM 1392 CG1 ILE A 177 19.380 -1.611 39.871 1.00 0.00 ATOM 1393 CG2 ILE A 177 20.017 -1.713 42.260 1.00 0.00 ATOM 1394 CD1 ILE A 177 20.685 -2.096 39.276 1.00 0.00 ATOM 1395 O ILE A 177 17.969 -0.034 43.928 1.00 0.00 ATOM 1396 C ILE A 177 18.388 0.528 42.905 1.00 0.00 ATOM 1397 N GLN A 178 18.996 1.705 42.936 1.00 0.00 ATOM 1398 CA GLN A 178 19.202 2.393 44.202 1.00 0.00 ATOM 1399 CB GLN A 178 20.086 3.627 44.004 1.00 0.00 ATOM 1400 CG GLN A 178 21.534 3.307 43.674 1.00 0.00 ATOM 1401 CD GLN A 178 22.364 4.551 43.422 1.00 0.00 ATOM 1402 OE1 GLN A 178 21.848 5.669 43.454 1.00 0.00 ATOM 1403 NE2 GLN A 178 23.653 4.360 43.171 1.00 0.00 ATOM 1404 O GLN A 178 17.710 2.742 46.043 1.00 0.00 ATOM 1405 C GLN A 178 17.870 2.805 44.823 1.00 0.00 ATOM 1406 N LEU A 179 16.924 3.260 43.982 1.00 0.00 ATOM 1407 CA LEU A 179 15.598 3.648 44.462 1.00 0.00 ATOM 1408 CB LEU A 179 14.719 4.091 43.290 1.00 0.00 ATOM 1409 CG LEU A 179 15.135 5.381 42.582 1.00 0.00 ATOM 1410 CD1 LEU A 179 14.292 5.606 41.335 1.00 0.00 ATOM 1411 CD2 LEU A 179 14.952 6.581 43.500 1.00 0.00 ATOM 1412 O LEU A 179 14.341 2.652 46.282 1.00 0.00 ATOM 1413 C LEU A 179 14.907 2.484 45.199 1.00 0.00 ATOM 1414 N ARG A 180 14.979 1.316 44.588 1.00 0.00 ATOM 1415 CA ARG A 180 14.383 0.110 45.205 1.00 0.00 ATOM 1416 CB ARG A 180 14.578 -1.108 44.299 1.00 0.00 ATOM 1417 CG ARG A 180 13.738 -1.082 43.033 1.00 0.00 ATOM 1418 CD ARG A 180 14.036 -2.282 42.149 1.00 0.00 ATOM 1419 NE ARG A 180 13.256 -2.257 40.914 1.00 0.00 ATOM 1420 CZ ARG A 180 13.378 -3.149 39.936 1.00 0.00 ATOM 1421 NH1 ARG A 180 12.626 -3.047 38.848 1.00 0.00 ATOM 1422 NH2 ARG A 180 14.254 -4.139 40.048 1.00 0.00 ATOM 1423 O ARG A 180 14.382 -0.408 47.577 1.00 0.00 ATOM 1424 C ARG A 180 15.055 -0.121 46.524 1.00 0.00 ATOM 1425 N ARG A 181 16.365 0.014 46.682 1.00 0.00 ATOM 1426 CA ARG A 181 17.066 -0.113 47.928 1.00 0.00 ATOM 1427 CB ARG A 181 18.578 -0.088 47.693 1.00 0.00 ATOM 1428 CG ARG A 181 19.122 -1.334 47.014 1.00 0.00 ATOM 1429 CD ARG A 181 20.613 -1.208 46.742 1.00 0.00 ATOM 1430 NE ARG A 181 21.151 -2.397 46.084 1.00 0.00 ATOM 1431 CZ ARG A 181 22.406 -2.515 45.666 1.00 0.00 ATOM 1432 NH1 ARG A 181 22.807 -3.633 45.078 1.00 0.00 ATOM 1433 NH2 ARG A 181 23.258 -1.514 45.836 1.00 0.00 ATOM 1434 O ARG A 181 16.514 0.783 50.065 1.00 0.00 ATOM 1435 C ARG A 181 16.703 1.026 48.863 1.00 0.00 ATOM 1436 N GLN A 182 16.613 2.259 48.407 1.00 0.00 ATOM 1437 CA GLN A 182 16.308 3.380 49.270 1.00 0.00 ATOM 1438 CB GLN A 182 16.304 4.685 48.472 1.00 0.00 ATOM 1439 CG GLN A 182 17.680 5.135 48.011 1.00 0.00 ATOM 1440 CD GLN A 182 17.624 6.367 47.129 1.00 0.00 ATOM 1441 OE1 GLN A 182 16.546 6.845 46.779 1.00 0.00 ATOM 1442 NE2 GLN A 182 18.793 6.886 46.764 1.00 0.00 ATOM 1443 O GLN A 182 14.800 3.493 51.090 1.00 0.00 ATOM 1444 C GLN A 182 14.923 3.170 49.897 1.00 0.00 ATOM 1445 N LEU A 183 13.918 2.718 49.168 1.00 0.00 ATOM 1446 CA LEU A 183 12.599 2.438 49.787 1.00 0.00 ATOM 1447 CB LEU A 183 11.637 1.848 48.754 1.00 0.00 ATOM 1448 CG LEU A 183 11.160 2.797 47.653 1.00 0.00 ATOM 1449 CD1 LEU A 183 10.362 2.042 46.601 1.00 0.00 ATOM 1450 CD2 LEU A 183 10.272 3.887 48.232 1.00 0.00 ATOM 1451 O LEU A 183 12.133 1.658 52.033 1.00 0.00 ATOM 1452 C LEU A 183 12.722 1.456 50.967 1.00 0.00 ATOM 1453 N PHE A 184 13.538 0.407 50.790 1.00 0.00 ATOM 1454 CA PHE A 184 13.751 -0.566 51.847 1.00 0.00 ATOM 1455 CB PHE A 184 14.699 -1.678 51.393 1.00 0.00 ATOM 1456 CG PHE A 184 15.000 -2.692 52.458 1.00 0.00 ATOM 1457 CD1 PHE A 184 14.094 -3.696 52.753 1.00 0.00 ATOM 1458 CD2 PHE A 184 16.187 -2.641 53.167 1.00 0.00 ATOM 1459 CE1 PHE A 184 14.371 -4.630 53.734 1.00 0.00 ATOM 1460 CE2 PHE A 184 16.464 -3.574 54.149 1.00 0.00 ATOM 1461 CZ PHE A 184 15.562 -4.565 54.434 1.00 0.00 ATOM 1462 O PHE A 184 13.938 -0.175 54.211 1.00 0.00 ATOM 1463 C PHE A 184 14.363 0.078 53.090 1.00 0.00 ATOM 1464 N ALA A 185 15.386 0.893 52.879 1.00 0.00 ATOM 1465 CA ALA A 185 16.067 1.552 53.971 1.00 0.00 ATOM 1466 CB ALA A 185 17.199 2.420 53.444 1.00 0.00 ATOM 1467 O ALA A 185 15.049 2.428 55.959 1.00 0.00 ATOM 1468 C ALA A 185 15.081 2.429 54.728 1.00 0.00 ATOM 1469 N LEU A 186 14.256 3.159 53.990 1.00 0.00 ATOM 1470 CA LEU A 186 13.292 4.033 54.627 1.00 0.00 ATOM 1471 CB LEU A 186 12.586 4.901 53.584 1.00 0.00 ATOM 1472 CG LEU A 186 13.447 5.955 52.882 1.00 0.00 ATOM 1473 CD1 LEU A 186 12.664 6.634 51.770 1.00 0.00 ATOM 1474 CD2 LEU A 186 13.900 7.022 53.867 1.00 0.00 ATOM 1475 O LEU A 186 11.820 3.602 56.498 1.00 0.00 ATOM 1476 C LEU A 186 12.246 3.228 55.401 1.00 0.00 ATOM 1477 N GLU A 187 11.842 2.061 54.870 1.00 0.00 ATOM 1478 CA GLU A 187 10.890 1.171 55.552 1.00 0.00 ATOM 1479 CB GLU A 187 10.610 -0.106 54.758 1.00 0.00 ATOM 1480 CG GLU A 187 9.819 0.119 53.480 1.00 0.00 ATOM 1481 CD GLU A 187 9.667 -1.145 52.658 1.00 0.00 ATOM 1482 OE1 GLU A 187 10.243 -2.182 53.051 1.00 0.00 ATOM 1483 OE2 GLU A 187 8.972 -1.101 51.622 1.00 0.00 ATOM 1484 O GLU A 187 10.589 0.481 57.819 1.00 0.00 ATOM 1485 C GLU A 187 11.395 0.703 56.912 1.00 0.00 ATOM 1486 N SER A 188 12.821 0.643 57.080 1.00 0.00 ATOM 1487 CA SER A 188 13.391 0.146 58.326 1.00 0.00 ATOM 1488 CB SER A 188 14.902 -0.039 58.174 1.00 0.00 ATOM 1489 OG SER A 188 15.538 1.190 57.867 1.00 0.00 ATOM 1490 O SER A 188 13.197 0.605 60.649 1.00 0.00 ATOM 1491 C SER A 188 13.134 1.082 59.511 1.00 0.00 ATOM 1492 N GLU A 189 12.789 2.398 59.259 1.00 0.00 ATOM 1493 CA GLU A 189 12.356 3.323 60.291 1.00 0.00 ATOM 1494 CB GLU A 189 12.739 4.744 59.877 1.00 0.00 ATOM 1495 CG GLU A 189 14.232 4.949 59.670 1.00 0.00 ATOM 1496 CD GLU A 189 14.569 6.354 59.211 1.00 0.00 ATOM 1497 OE1 GLU A 189 13.633 7.161 59.033 1.00 0.00 ATOM 1498 OE2 GLU A 189 15.770 6.648 59.033 1.00 0.00 ATOM 1499 O GLU A 189 10.418 3.761 61.588 1.00 0.00 ATOM 1500 C GLU A 189 10.872 3.283 60.548 1.00 0.00 ATOM 1501 N LEU A 190 10.369 2.963 59.227 1.00 0.00 ATOM 1502 CA LEU A 190 8.921 2.932 59.206 1.00 0.00 ATOM 1503 CB LEU A 190 8.404 3.039 57.770 1.00 0.00 ATOM 1504 CG LEU A 190 8.805 4.295 56.997 1.00 0.00 ATOM 1505 CD1 LEU A 190 8.250 4.256 55.580 1.00 0.00 ATOM 1506 CD2 LEU A 190 8.271 5.544 57.682 1.00 0.00 ATOM 1507 O LEU A 190 7.476 1.071 58.965 1.00 0.00 ATOM 1508 C LEU A 190 8.117 1.771 59.734 1.00 0.00 ATOM 1509 N ASN A 191 8.053 1.604 61.030 1.00 0.00 ATOM 1510 CA ASN A 191 7.210 0.593 61.672 1.00 0.00 ATOM 1511 CB ASN A 191 7.499 0.530 63.173 1.00 0.00 ATOM 1512 CG ASN A 191 8.849 -0.084 63.481 1.00 0.00 ATOM 1513 ND2 ASN A 191 9.345 0.156 64.690 1.00 0.00 ATOM 1514 OD1 ASN A 191 9.439 -0.765 62.643 1.00 0.00 ATOM 1515 O ASN A 191 5.286 1.992 61.123 1.00 0.00 ATOM 1516 C ASN A 191 5.731 0.910 61.551 1.00 0.00 ATOM 1517 N PRO A 192 4.834 -0.093 61.831 1.00 0.00 ATOM 1518 CA PRO A 192 3.410 0.076 61.644 1.00 0.00 ATOM 1519 CB PRO A 192 2.810 -1.287 62.058 1.00 0.00 ATOM 1520 CG PRO A 192 3.935 -2.217 61.694 1.00 0.00 ATOM 1521 CD PRO A 192 5.199 -1.497 62.110 1.00 0.00 ATOM 1522 O PRO A 192 1.866 1.883 61.885 1.00 0.00 ATOM 1523 C PRO A 192 2.792 1.264 62.426 1.00 0.00 ATOM 1524 N VAL A 193 3.293 1.578 63.625 1.00 0.00 ATOM 1525 CA VAL A 193 2.836 2.732 64.400 1.00 0.00 ATOM 1526 CB VAL A 193 3.607 2.865 65.726 1.00 0.00 ATOM 1527 CG1 VAL A 193 3.249 4.169 66.420 1.00 0.00 ATOM 1528 CG2 VAL A 193 3.265 1.714 66.659 1.00 0.00 ATOM 1529 O VAL A 193 2.189 4.841 63.352 1.00 0.00 ATOM 1530 C VAL A 193 3.041 3.980 63.557 1.00 0.00 ATOM 1531 N ASP A 194 4.235 4.124 62.993 1.00 0.00 ATOM 1532 CA ASP A 194 4.576 5.252 62.115 1.00 0.00 ATOM 1533 CB ASP A 194 6.066 5.197 61.772 1.00 0.00 ATOM 1534 CG ASP A 194 6.949 5.528 62.957 1.00 0.00 ATOM 1535 OD1 ASP A 194 6.422 6.035 63.969 1.00 0.00 ATOM 1536 OD2 ASP A 194 8.171 5.278 62.876 1.00 0.00 ATOM 1537 O ASP A 194 3.287 6.353 60.434 1.00 0.00 ATOM 1538 C ASP A 194 3.750 5.284 60.835 1.00 0.00 ATOM 1539 N VAL A 195 3.577 4.122 60.209 1.00 0.00 ATOM 1540 CA VAL A 195 2.786 4.032 58.982 1.00 0.00 ATOM 1541 CB VAL A 195 2.688 2.575 58.494 1.00 0.00 ATOM 1542 CG1 VAL A 195 1.664 2.454 57.376 1.00 0.00 ATOM 1543 CG2 VAL A 195 4.034 2.100 57.966 1.00 0.00 ATOM 1544 O VAL A 195 0.836 5.286 58.477 1.00 0.00 ATOM 1545 C VAL A 195 1.376 4.527 59.258 1.00 0.00 ATOM 1546 N MET A 196 0.791 4.079 60.375 1.00 0.00 ATOM 1547 CA MET A 196 -0.553 4.527 60.748 1.00 0.00 ATOM 1548 CB MET A 196 -0.987 3.881 62.065 1.00 0.00 ATOM 1549 CG MET A 196 -1.245 2.387 61.968 1.00 0.00 ATOM 1550 SD MET A 196 -2.571 1.981 60.815 1.00 0.00 ATOM 1551 CE MET A 196 -3.991 2.633 61.690 1.00 0.00 ATOM 1552 O MET A 196 -1.513 6.697 60.382 1.00 0.00 ATOM 1553 C MET A 196 -0.603 6.031 60.921 1.00 0.00 ATOM 1554 N PHE A 197 0.383 6.636 61.582 1.00 0.00 ATOM 1555 CA PHE A 197 0.382 8.091 61.723 1.00 0.00 ATOM 1556 CB PHE A 197 1.558 8.546 62.591 1.00 0.00 ATOM 1557 CG PHE A 197 1.630 10.035 62.779 1.00 0.00 ATOM 1558 CD1 PHE A 197 0.807 10.674 63.690 1.00 0.00 ATOM 1559 CD2 PHE A 197 2.522 10.797 62.044 1.00 0.00 ATOM 1560 CE1 PHE A 197 0.876 12.043 63.862 1.00 0.00 ATOM 1561 CE2 PHE A 197 2.590 12.166 62.216 1.00 0.00 ATOM 1562 CZ PHE A 197 1.772 12.790 63.121 1.00 0.00 ATOM 1563 O PHE A 197 -0.052 9.841 60.125 1.00 0.00 ATOM 1564 C PHE A 197 0.504 8.774 60.361 1.00 0.00 ATOM 1565 N LEU A 198 1.286 8.168 59.420 1.00 0.00 ATOM 1566 CA LEU A 198 1.420 8.817 58.093 1.00 0.00 ATOM 1567 CB LEU A 198 2.509 8.047 57.251 1.00 0.00 ATOM 1568 CG LEU A 198 3.997 8.099 57.634 1.00 0.00 ATOM 1569 CD1 LEU A 198 4.827 7.157 56.740 1.00 0.00 ATOM 1570 CD2 LEU A 198 4.491 9.521 57.526 1.00 0.00 ATOM 1571 O LEU A 198 -0.225 9.856 56.684 1.00 0.00 ATOM 1572 C LEU A 198 0.080 8.878 57.366 1.00 0.00 ATOM 1573 N TYR A 199 -0.732 7.813 57.509 1.00 0.00 ATOM 1574 CA TYR A 199 -2.032 7.763 56.854 1.00 0.00 ATOM 1575 CB TYR A 199 -2.658 6.366 57.029 1.00 0.00 ATOM 1576 CG TYR A 199 -2.214 5.397 55.953 1.00 0.00 ATOM 1577 CD1 TYR A 199 -0.902 4.922 55.923 1.00 0.00 ATOM 1578 CD2 TYR A 199 -3.046 4.951 54.946 1.00 0.00 ATOM 1579 CE1 TYR A 199 -0.515 4.044 54.937 1.00 0.00 ATOM 1580 CE2 TYR A 199 -2.644 4.072 53.938 1.00 0.00 ATOM 1581 CZ TYR A 199 -1.357 3.612 53.947 1.00 0.00 ATOM 1582 OH TYR A 199 -0.916 2.744 52.963 1.00 0.00 ATOM 1583 O TYR A 199 -3.613 9.543 56.652 1.00 0.00 ATOM 1584 C TYR A 199 -2.861 8.943 57.398 1.00 0.00 ATOM 1585 N LYS A 200 -2.717 9.280 58.678 1.00 0.00 ATOM 1586 CA LYS A 200 -3.370 10.491 59.225 1.00 0.00 ATOM 1587 CB LYS A 200 -3.163 10.574 60.739 1.00 0.00 ATOM 1588 CG LYS A 200 -3.936 9.529 61.528 1.00 0.00 ATOM 1589 CD LYS A 200 -3.690 9.671 63.021 1.00 0.00 ATOM 1590 CE LYS A 200 -4.437 8.605 63.807 1.00 0.00 ATOM 1591 NZ LYS A 200 -4.186 8.718 65.271 1.00 0.00 ATOM 1592 O LYS A 200 -3.589 12.582 58.067 1.00 0.00 ATOM 1593 C LYS A 200 -2.826 11.750 58.545 1.00 0.00 ATOM 1594 N THR A 201 -1.521 11.834 58.433 1.00 0.00 ATOM 1595 CA THR A 201 -0.870 12.964 57.778 1.00 0.00 ATOM 1596 CB THR A 201 0.664 12.913 57.919 1.00 0.00 ATOM 1597 CG2 THR A 201 1.307 14.058 57.152 1.00 0.00 ATOM 1598 OG1 THR A 201 1.023 13.020 59.301 1.00 0.00 ATOM 1599 O THR A 201 -1.409 13.983 55.679 1.00 0.00 ATOM 1600 C THR A 201 -1.166 12.922 56.283 1.00 0.00 ATOM 1601 N ILE A 202 -1.097 11.686 55.688 1.00 0.00 ATOM 1602 CA ILE A 202 -1.444 11.520 54.264 1.00 0.00 ATOM 1603 CB ILE A 202 -1.241 10.024 53.865 1.00 0.00 ATOM 1604 CG1 ILE A 202 0.223 9.604 53.918 1.00 0.00 ATOM 1605 CG2 ILE A 202 -1.836 9.696 52.502 1.00 0.00 ATOM 1606 CD1 ILE A 202 0.481 8.114 53.843 1.00 0.00 ATOM 1607 O ILE A 202 -3.095 12.759 53.008 1.00 0.00 ATOM 1608 C ILE A 202 -2.855 12.052 53.993 1.00 0.00 ATOM 1609 N GLU A 203 -3.790 11.710 54.874 1.00 0.00 ATOM 1610 CA GLU A 203 -5.172 12.151 54.711 1.00 0.00 ATOM 1611 CB GLU A 203 -6.069 11.501 55.765 1.00 0.00 ATOM 1612 CG GLU A 203 -7.543 11.846 55.624 1.00 0.00 ATOM 1613 CD GLU A 203 -8.408 11.138 56.648 1.00 0.00 ATOM 1614 OE1 GLU A 203 -7.855 10.368 57.462 1.00 0.00 ATOM 1615 OE2 GLU A 203 -9.639 11.352 56.637 1.00 0.00 ATOM 1616 O GLU A 203 -6.084 14.284 54.079 1.00 0.00 ATOM 1617 C GLU A 203 -5.337 13.665 54.847 1.00 0.00 ATOM 1618 N TRP A 204 -4.653 14.276 55.807 1.00 0.00 ATOM 1619 CA TRP A 204 -4.779 15.722 55.945 1.00 0.00 ATOM 1620 CB TRP A 204 -3.414 16.229 56.775 1.00 0.00 ATOM 1621 CG TRP A 204 -3.475 17.546 57.506 1.00 0.00 ATOM 1622 CD1 TRP A 204 -4.429 17.937 58.403 1.00 0.00 ATOM 1623 CD2 TRP A 204 -2.541 18.635 57.420 1.00 0.00 ATOM 1624 CE2 TRP A 204 -3.001 19.648 58.293 1.00 0.00 ATOM 1625 CE3 TRP A 204 -1.362 18.852 56.695 1.00 0.00 ATOM 1626 NE1 TRP A 204 -4.154 19.193 58.876 1.00 0.00 ATOM 1627 CZ2 TRP A 204 -2.325 20.865 58.458 1.00 0.00 ATOM 1628 CZ3 TRP A 204 -0.686 20.066 56.860 1.00 0.00 ATOM 1629 CH2 TRP A 204 -1.173 21.055 57.737 1.00 0.00 ATOM 1630 O TRP A 204 -4.918 17.305 54.131 1.00 0.00 ATOM 1631 C TRP A 204 -4.277 16.399 54.668 1.00 0.00 ATOM 1632 N VAL A 205 -3.112 15.958 54.203 1.00 0.00 ATOM 1633 CA VAL A 205 -2.526 16.513 52.983 1.00 0.00 ATOM 1634 CB VAL A 205 -1.194 15.836 52.610 1.00 0.00 ATOM 1635 CG1 VAL A 205 -0.702 16.337 51.260 1.00 0.00 ATOM 1636 CG2 VAL A 205 -0.130 16.141 53.652 1.00 0.00 ATOM 1637 O VAL A 205 -3.707 17.310 51.048 1.00 0.00 ATOM 1638 C VAL A 205 -3.508 16.374 51.821 1.00 0.00 ATOM 1639 N GLY A 206 -4.142 15.191 51.688 1.00 0.00 ATOM 1640 CA GLY A 206 -5.105 14.979 50.622 1.00 0.00 ATOM 1641 O GLY A 206 -6.842 16.379 49.753 1.00 0.00 ATOM 1642 C GLY A 206 -6.312 15.905 50.757 1.00 0.00 ATOM 1643 N GLY A 207 -6.747 16.140 51.991 1.00 0.00 ATOM 1644 CA GLY A 207 -7.884 17.024 52.250 1.00 0.00 ATOM 1645 O GLY A 207 -8.328 19.143 51.208 1.00 0.00 ATOM 1646 C GLY A 207 -7.525 18.450 51.839 1.00 0.00 ATOM 1647 N LEU A 208 -6.322 18.888 52.207 1.00 0.00 ATOM 1648 CA LEU A 208 -5.874 20.233 51.867 1.00 0.00 ATOM 1649 CB LEU A 208 -4.465 20.484 52.409 1.00 0.00 ATOM 1650 CG LEU A 208 -4.335 20.592 53.930 1.00 0.00 ATOM 1651 CD1 LEU A 208 -2.872 20.657 54.341 1.00 0.00 ATOM 1652 CD2 LEU A 208 -5.027 21.846 54.441 1.00 0.00 ATOM 1653 O LEU A 208 -6.310 21.404 49.811 1.00 0.00 ATOM 1654 C LEU A 208 -5.857 20.390 50.343 1.00 0.00 ATOM 1655 N ALA A 209 -5.332 19.382 49.647 1.00 0.00 ATOM 1656 CA ALA A 209 -5.288 19.421 48.188 1.00 0.00 ATOM 1657 CB ALA A 209 -4.647 18.153 47.644 1.00 0.00 ATOM 1658 O ALA A 209 -6.938 20.287 46.681 1.00 0.00 ATOM 1659 C ALA A 209 -6.707 19.561 47.649 1.00 0.00 ATOM 1660 N ASP A 210 -7.664 18.877 48.255 1.00 0.00 ATOM 1661 CA ASP A 210 -9.058 18.976 47.827 1.00 0.00 ATOM 1662 CB ASP A 210 -9.917 17.952 48.571 1.00 0.00 ATOM 1663 CG ASP A 210 -9.665 16.531 48.106 1.00 0.00 ATOM 1664 OD1 ASP A 210 -9.014 16.357 47.053 1.00 0.00 ATOM 1665 OD2 ASP A 210 -10.116 15.591 48.794 1.00 0.00 ATOM 1666 O ASP A 210 -10.317 20.918 47.205 1.00 0.00 ATOM 1667 C ASP A 210 -9.586 20.392 48.040 1.00 0.00 ATOM 1668 N LEU A 211 -9.237 21.010 49.175 1.00 0.00 ATOM 1669 CA LEU A 211 -9.687 22.366 49.491 1.00 0.00 ATOM 1670 CB LEU A 211 -9.212 22.783 50.885 1.00 0.00 ATOM 1671 CG LEU A 211 -9.835 22.035 52.064 1.00 0.00 ATOM 1672 CD1 LEU A 211 -9.150 22.419 53.366 1.00 0.00 ATOM 1673 CD2 LEU A 211 -11.315 22.367 52.190 1.00 0.00 ATOM 1674 O LEU A 211 -9.852 24.290 48.076 1.00 0.00 ATOM 1675 C LEU A 211 -9.149 23.364 48.470 1.00 0.00 ATOM 1676 N ALA A 212 -7.886 23.151 48.065 1.00 0.00 ATOM 1677 CA ALA A 212 -7.267 24.064 47.085 1.00 0.00 ATOM 1678 CB ALA A 212 -5.761 24.117 47.288 1.00 0.00 ATOM 1679 O ALA A 212 -6.715 23.211 44.904 1.00 0.00 ATOM 1680 C ALA A 212 -7.599 23.603 45.668 1.00 0.00 ATOM 1681 N GLU A 213 -8.839 23.680 45.311 1.00 0.00 ATOM 1682 CA GLU A 213 -9.295 23.265 43.985 1.00 0.00 ATOM 1683 CB GLU A 213 -10.817 23.111 43.952 1.00 0.00 ATOM 1684 CG GLU A 213 -11.342 21.957 44.792 1.00 0.00 ATOM 1685 CD GLU A 213 -12.856 21.879 44.792 1.00 0.00 ATOM 1686 OE1 GLU A 213 -13.495 22.735 44.145 1.00 0.00 ATOM 1687 OE2 GLU A 213 -13.403 20.960 45.439 1.00 0.00 ATOM 1688 O GLU A 213 -8.466 23.933 41.830 1.00 0.00 ATOM 1689 C GLU A 213 -8.830 24.290 42.951 1.00 0.00 ATOM 1690 N ARG A 214 -8.877 25.572 43.336 1.00 0.00 ATOM 1691 CA ARG A 214 -8.402 26.664 42.498 1.00 0.00 ATOM 1692 CB ARG A 214 -8.545 27.996 43.165 1.00 0.00 ATOM 1693 CG ARG A 214 -8.203 29.197 42.302 1.00 0.00 ATOM 1694 CD ARG A 214 -8.145 30.492 43.090 1.00 0.00 ATOM 1695 NE ARG A 214 -7.004 30.499 43.986 1.00 0.00 ATOM 1696 CZ ARG A 214 -7.002 30.889 45.268 1.00 0.00 ATOM 1697 NH1 ARG A 214 -5.881 30.817 45.953 1.00 0.00 ATOM 1698 NH2 ARG A 214 -8.108 31.272 45.874 1.00 0.00 ATOM 1699 O ARG A 214 -6.455 26.681 41.088 1.00 0.00 ATOM 1700 C ARG A 214 -6.905 26.500 42.220 1.00 0.00 ATOM 1701 N VAL A 215 -6.251 26.156 43.242 1.00 0.00 ATOM 1702 CA VAL A 215 -4.810 25.918 43.134 1.00 0.00 ATOM 1703 CB VAL A 215 -4.181 25.635 44.511 1.00 0.00 ATOM 1704 CG1 VAL A 215 -2.733 25.195 44.356 1.00 0.00 ATOM 1705 CG2 VAL A 215 -4.213 26.883 45.379 1.00 0.00 ATOM 1706 O VAL A 215 -3.672 24.795 41.346 1.00 0.00 ATOM 1707 C VAL A 215 -4.521 24.715 42.235 1.00 0.00 ATOM 1708 N GLY A 216 -5.275 23.627 42.484 1.00 0.00 ATOM 1709 CA GLY A 216 -5.099 22.400 41.713 1.00 0.00 ATOM 1710 O GLY A 216 -4.664 22.057 39.398 1.00 0.00 ATOM 1711 C GLY A 216 -5.399 22.569 40.256 1.00 0.00 ATOM 1712 N SER A 217 -6.500 23.259 39.930 1.00 0.00 ATOM 1713 CA SER A 217 -6.816 23.506 38.519 1.00 0.00 ATOM 1714 CB SER A 217 -8.208 24.066 38.349 1.00 0.00 ATOM 1715 OG SER A 217 -8.341 25.395 38.767 1.00 0.00 ATOM 1716 O SER A 217 -5.443 24.129 36.682 1.00 0.00 ATOM 1717 C SER A 217 -5.783 24.367 37.850 1.00 0.00 ATOM 1718 N ARG A 218 -5.261 25.373 38.571 1.00 0.00 ATOM 1719 CA ARG A 218 -4.200 26.211 37.987 1.00 0.00 ATOM 1720 CB ARG A 218 -3.935 27.401 38.883 1.00 0.00 ATOM 1721 CG ARG A 218 -5.048 28.433 38.853 1.00 0.00 ATOM 1722 CD ARG A 218 -4.891 29.493 39.925 1.00 0.00 ATOM 1723 NE ARG A 218 -3.744 30.344 39.660 1.00 0.00 ATOM 1724 CZ ARG A 218 -3.243 31.237 40.482 1.00 0.00 ATOM 1725 NH1 ARG A 218 -3.729 31.416 41.689 1.00 0.00 ATOM 1726 NH2 ARG A 218 -2.187 31.943 40.111 1.00 0.00 ATOM 1727 O ARG A 218 -2.306 25.554 36.678 1.00 0.00 ATOM 1728 C ARG A 218 -2.926 25.412 37.735 1.00 0.00 ATOM 1729 N LEU A 219 -2.531 24.554 38.696 1.00 0.00 ATOM 1730 CA LEU A 219 -1.346 23.746 38.479 1.00 0.00 ATOM 1731 CB LEU A 219 -1.033 22.943 39.746 1.00 0.00 ATOM 1732 CG LEU A 219 -0.557 23.764 40.945 1.00 0.00 ATOM 1733 CD1 LEU A 219 -0.571 22.885 42.178 1.00 0.00 ATOM 1734 CD2 LEU A 219 0.823 24.353 40.730 1.00 0.00 ATOM 1735 O LEU A 219 -0.662 22.718 36.417 1.00 0.00 ATOM 1736 C LEU A 219 -1.531 22.821 37.289 1.00 0.00 ATOM 1737 N GLU A 220 -2.675 22.160 37.200 1.00 0.00 ATOM 1738 CA GLU A 220 -2.965 21.244 36.093 1.00 0.00 ATOM 1739 CB GLU A 220 -4.241 20.449 36.379 1.00 0.00 ATOM 1740 CG GLU A 220 -4.101 19.431 37.498 1.00 0.00 ATOM 1741 CD GLU A 220 -5.405 18.729 37.814 1.00 0.00 ATOM 1742 OE1 GLU A 220 -6.435 19.082 37.201 1.00 0.00 ATOM 1743 OE2 GLU A 220 -5.401 17.825 38.677 1.00 0.00 ATOM 1744 O GLU A 220 -2.677 21.484 33.716 1.00 0.00 ATOM 1745 C GLU A 220 -3.139 21.961 34.755 1.00 0.00 ATOM 1746 N LEU A 221 -3.814 23.097 34.780 1.00 0.00 ATOM 1747 CA LEU A 221 -4.066 23.899 33.588 1.00 0.00 ATOM 1748 CB LEU A 221 -4.973 25.115 33.990 1.00 0.00 ATOM 1749 CG LEU A 221 -5.255 26.131 32.873 1.00 0.00 ATOM 1750 CD1 LEU A 221 -5.941 25.437 31.672 1.00 0.00 ATOM 1751 CD2 LEU A 221 -6.156 27.238 33.425 1.00 0.00 ATOM 1752 O LEU A 221 -2.656 24.315 31.684 1.00 0.00 ATOM 1753 C LEU A 221 -2.804 24.398 32.902 1.00 0.00 ATOM 1754 N MET A 222 -1.877 24.908 33.689 1.00 0.00 ATOM 1755 CA MET A 222 -0.623 25.420 33.143 1.00 0.00 ATOM 1756 CB MET A 222 0.169 26.042 34.340 1.00 0.00 ATOM 1757 CG MET A 222 -0.382 27.347 34.793 1.00 0.00 ATOM 1758 SD MET A 222 0.603 28.075 36.146 1.00 0.00 ATOM 1759 CE MET A 222 2.002 28.241 35.317 1.00 0.00 ATOM 1760 O MET A 222 0.853 24.551 31.472 1.00 0.00 ATOM 1761 C MET A 222 0.224 24.333 32.504 1.00 0.00 ATOM 1762 N LEU A 223 0.264 23.170 33.117 1.00 0.00 ATOM 1763 CA LEU A 223 1.052 22.075 32.587 1.00 0.00 ATOM 1764 CB LEU A 223 1.200 20.937 33.619 1.00 0.00 ATOM 1765 CG LEU A 223 2.030 19.724 33.174 1.00 0.00 ATOM 1766 CD1 LEU A 223 3.477 20.131 32.968 1.00 0.00 ATOM 1767 CD2 LEU A 223 1.937 18.606 34.204 1.00 0.00 ATOM 1768 O LEU A 223 1.174 21.268 30.336 1.00 0.00 ATOM 1769 C LEU A 223 0.444 21.572 31.285 1.00 0.00 ATOM 1770 N ALA A 224 -0.870 21.479 31.245 1.00 0.00 ATOM 1771 CA ALA A 224 -1.542 21.029 30.022 1.00 0.00 ATOM 1772 CB ALA A 224 -3.020 20.836 30.274 1.00 0.00 ATOM 1773 O ALA A 224 -1.050 21.540 27.691 1.00 0.00 ATOM 1774 C ALA A 224 -1.314 21.976 28.832 1.00 0.00 ATOM 1775 N ARG A 225 -1.367 23.277 29.094 1.00 0.00 ATOM 1776 CA ARG A 225 -1.113 24.268 28.061 1.00 0.00 ATOM 1777 CB ARG A 225 -1.327 25.681 28.608 1.00 0.00 ATOM 1778 CG ARG A 225 -2.783 26.028 28.875 1.00 0.00 ATOM 1779 CD ARG A 225 -2.917 27.414 29.484 1.00 0.00 ATOM 1780 NE ARG A 225 -4.308 27.753 29.774 1.00 0.00 ATOM 1781 CZ ARG A 225 -4.694 28.874 30.375 1.00 0.00 ATOM 1782 NH1 ARG A 225 -5.983 29.097 30.597 1.00 0.00 ATOM 1783 NH2 ARG A 225 -3.792 29.769 30.752 1.00 0.00 ATOM 1784 O ARG A 225 0.624 24.307 26.357 1.00 0.00 ATOM 1785 C ARG A 225 0.324 24.173 27.549 1.00 0.00 ATOM 1786 N VAL A 226 1.301 24.001 28.455 1.00 0.00 ATOM 1787 CA VAL A 226 2.695 23.867 28.073 1.00 0.00 ATOM 1788 CB VAL A 226 3.512 25.192 28.373 1.00 0.00 ATOM 1789 CG1 VAL A 226 2.843 26.424 27.828 1.00 0.00 ATOM 1790 CG2 VAL A 226 3.736 25.377 29.815 1.00 0.00 ATOM 1791 O VAL A 226 2.778 22.166 29.740 1.00 0.00 ATOM 1792 C VAL A 226 3.331 22.662 28.755 1.00 0.00 ENDMDL EXPDTA 2iiuA MODEL 2 REMARK 44 REMARK 44 model 2 is called 2iiuA ATOM 1 N SER 13 10.068 20.701 6.159 1.00 0.00 ATOM 2 CA SER 13 9.907 19.224 6.206 1.00 0.00 ATOM 3 CB SER 13 11.079 18.560 6.948 1.00 0.00 ATOM 4 O SER 13 8.182 19.696 7.767 1.00 0.00 ATOM 5 C SER 13 8.612 18.910 6.931 1.00 0.00 ATOM 6 N PRO 14 7.961 17.784 6.575 1.00 0.00 ATOM 7 CA PRO 14 6.736 17.313 7.269 1.00 0.00 ATOM 8 CB PRO 14 6.346 16.020 6.542 1.00 0.00 ATOM 9 CG PRO 14 7.432 15.748 5.516 1.00 0.00 ATOM 10 CD PRO 14 8.343 16.942 5.421 1.00 0.00 ATOM 11 O PRO 14 6.082 16.827 9.502 1.00 0.00 ATOM 12 C PRO 14 7.002 16.947 8.715 1.00 0.00 ATOM 13 N ILE 15 8.261 16.712 9.041 1.00 0.00 ATOM 14 CA ILE 15 8.624 16.376 10.391 1.00 0.00 ATOM 15 CB ILE 15 9.945 15.524 10.408 1.00 0.00 ATOM 16 CG1 ILE 15 10.140 14.790 11.735 1.00 0.00 ATOM 17 CG2 ILE 15 11.131 16.365 10.143 1.00 0.00 ATOM 18 O ILE 15 8.641 17.537 12.490 1.00 0.00 ATOM 19 C ILE 15 8.728 17.648 11.281 1.00 0.00 ATOM 20 N LYS 16 8.838 18.846 10.691 1.00 0.00 ATOM 21 CA LYS 16 9.041 20.076 11.500 1.00 0.00 ATOM 22 CB LYS 16 9.237 21.332 10.636 1.00 0.00 ATOM 23 O LYS 16 8.335 20.637 13.685 1.00 0.00 ATOM 24 C LYS 16 7.985 20.330 12.582 1.00 0.00 ATOM 25 N PRO 17 6.685 20.238 12.252 1.00 0.00 ATOM 26 CA PRO 17 5.664 20.355 13.301 1.00 0.00 ATOM 27 CB PRO 17 4.355 20.070 12.554 1.00 0.00 ATOM 28 CG PRO 17 4.641 20.436 11.132 1.00 0.00 ATOM 29 CD PRO 17 6.097 20.075 10.910 1.00 0.00 ATOM 30 O PRO 17 5.600 19.618 15.622 1.00 0.00 ATOM 31 C PRO 17 5.851 19.317 14.447 1.00 0.00 ATOM 32 N LEU 18 6.309 18.121 14.105 1.00 0.00 ATOM 33 CA LEU 18 6.578 17.074 15.099 1.00 0.00 ATOM 34 CB LEU 18 6.716 15.701 14.415 1.00 0.00 ATOM 35 CG LEU 18 5.257 15.322 14.179 1.00 0.00 ATOM 36 CD1 LEU 18 4.890 15.020 12.777 1.00 0.00 ATOM 37 CD2 LEU 18 4.816 14.272 15.168 1.00 0.00 ATOM 38 O LEU 18 7.737 17.139 17.178 1.00 0.00 ATOM 39 C LEU 18 7.767 17.384 15.958 1.00 0.00 ATOM 40 N GLN 19 8.784 17.983 15.350 1.00 0.00 ATOM 41 CA GLN 19 9.964 18.380 16.095 1.00 0.00 ATOM 42 CB GLN 19 11.045 18.869 15.179 1.00 0.00 ATOM 43 CG GLN 19 11.434 17.861 14.125 1.00 0.00 ATOM 44 CD GLN 19 12.399 18.411 13.067 1.00 0.00 ATOM 45 OE1 GLN 19 12.928 17.648 12.265 1.00 0.00 ATOM 46 NE2 GLN 19 12.655 19.717 13.092 1.00 0.00 ATOM 47 O GLN 19 10.049 19.371 18.253 1.00 0.00 ATOM 48 C GLN 19 9.608 19.459 17.111 1.00 0.00 ATOM 49 N GLU 20 8.795 20.434 16.690 1.00 0.00 ATOM 50 CA GLU 20 8.320 21.521 17.552 1.00 0.00 ATOM 51 CB GLU 20 7.444 22.463 16.735 1.00 0.00 ATOM 52 CG GLU 20 7.217 23.834 17.322 1.00 0.00 ATOM 53 O GLU 20 7.707 21.343 19.880 1.00 0.00 ATOM 54 C GLU 20 7.521 20.956 18.727 1.00 0.00 ATOM 55 N HIS 21 6.608 20.046 18.449 1.00 0.00 ATOM 56 CA HIS 21 5.852 19.402 19.538 1.00 0.00 ATOM 57 CB HIS 21 4.846 18.419 18.940 1.00 0.00 ATOM 58 CG HIS 21 4.005 17.709 19.956 1.00 0.00 ATOM 59 CD2 HIS 21 2.919 18.127 20.645 1.00 0.00 ATOM 60 ND1 HIS 21 4.266 16.424 20.388 1.00 0.00 ATOM 61 CE1 HIS 21 3.386 16.096 21.313 1.00 0.00 ATOM 62 NE2 HIS 21 2.548 17.111 21.481 1.00 0.00 ATOM 63 O HIS 21 6.733 18.766 21.723 1.00 0.00 ATOM 64 C HIS 21 6.807 18.651 20.508 1.00 0.00 ATOM 65 N MET 22 7.746 17.904 19.968 1.00 0.00 ATOM 66 CA MET 22 8.682 17.167 20.786 1.00 0.00 ATOM 67 CB MET 22 9.556 16.268 19.903 1.00 0.00 ATOM 68 CG MET 22 10.528 15.293 20.642 1.00 0.00 ATOM 69 SD MET 22 9.693 13.944 21.746 1.00 0.00 ATOM 70 CE MET 22 10.206 14.534 23.424 1.00 0.00 ATOM 71 O MET 22 9.790 17.831 22.822 1.00 0.00 ATOM 72 C MET 22 9.531 18.121 21.633 1.00 0.00 ATOM 73 N ASP 23 9.939 19.251 21.058 1.00 0.00 ATOM 74 CA ASP 23 10.684 20.244 21.830 1.00 0.00 ATOM 75 CB ASP 23 11.142 21.421 20.977 1.00 0.00 ATOM 76 CG ASP 23 12.197 21.037 19.929 1.00 0.00 ATOM 77 OD1 ASP 23 12.830 19.965 20.037 1.00 0.00 ATOM 78 OD2 ASP 23 12.376 21.819 18.968 1.00 0.00 ATOM 79 O ASP 23 10.361 20.847 24.114 1.00 0.00 ATOM 80 C ASP 23 9.851 20.728 23.022 1.00 0.00 ATOM 81 N LYS 24 8.564 20.987 22.806 1.00 0.00 ATOM 82 CA LYS 24 7.670 21.419 23.890 1.00 0.00 ATOM 83 CB LYS 24 6.283 21.755 23.334 1.00 0.00 ATOM 84 CG LYS 24 5.305 22.434 24.321 1.00 0.00 ATOM 85 CD LYS 24 5.838 23.685 24.967 1.00 0.00 ATOM 86 CE LYS 24 6.054 24.809 24.004 1.00 0.00 ATOM 87 NZ LYS 24 6.702 25.918 24.752 1.00 0.00 ATOM 88 O LYS 24 7.447 20.594 26.156 1.00 0.00 ATOM 89 C LYS 24 7.508 20.336 24.965 1.00 0.00 ATOM 90 N VAL 25 7.370 19.107 24.526 1.00 0.00 ATOM 91 CA VAL 25 7.227 17.972 25.472 1.00 0.00 ATOM 92 CB VAL 25 6.814 16.690 24.713 1.00 0.00 ATOM 93 CG1 VAL 25 7.050 15.467 25.509 1.00 0.00 ATOM 94 CG2 VAL 25 5.336 16.798 24.265 1.00 0.00 ATOM 95 O VAL 25 8.481 17.494 27.507 1.00 0.00 ATOM 96 C VAL 25 8.523 17.775 26.298 1.00 0.00 ATOM 97 N TYR 26 9.677 17.954 25.670 1.00 0.00 ATOM 98 CA TYR 26 10.906 17.907 26.406 1.00 0.00 ATOM 99 CB TYR 26 12.127 17.972 25.496 1.00 0.00 ATOM 100 CG TYR 26 13.443 18.008 26.284 1.00 0.00 ATOM 101 CD1 TYR 26 13.897 16.883 26.936 1.00 0.00 ATOM 102 CD2 TYR 26 14.185 19.162 26.392 1.00 0.00 ATOM 103 CE1 TYR 26 15.038 16.889 27.666 1.00 0.00 ATOM 104 CE2 TYR 26 15.356 19.186 27.135 1.00 0.00 ATOM 105 CZ TYR 26 15.788 18.035 27.748 1.00 0.00 ATOM 106 OH TYR 26 16.920 18.011 28.521 1.00 0.00 ATOM 107 O TYR 26 11.336 18.785 28.567 1.00 0.00 ATOM 108 C TYR 26 10.956 19.036 27.449 1.00 0.00 ATOM 109 N ASP 27 10.643 20.270 27.072 1.00 0.00 ATOM 110 CA ASP 27 10.628 21.385 27.994 1.00 0.00 ATOM 111 CB ASP 27 10.077 22.593 27.286 1.00 0.00 ATOM 112 CG ASP 27 11.042 23.154 26.242 1.00 0.00 ATOM 113 OD1 ASP 27 12.203 22.708 26.212 1.00 0.00 ATOM 114 OD2 ASP 27 10.634 24.047 25.455 1.00 0.00 ATOM 115 O ASP 27 10.056 21.332 30.341 1.00 0.00 ATOM 116 C ASP 27 9.727 21.073 29.190 1.00 0.00 ATOM 117 N CYS 28 8.555 20.533 28.903 1.00 0.00 ATOM 118 CA CYS 28 7.587 20.212 29.957 1.00 0.00 ATOM 119 CB CYS 28 6.322 19.710 29.266 1.00 0.00 ATOM 120 SG CYS 28 5.073 19.124 30.321 1.00 0.00 ATOM 121 O CYS 28 8.088 19.309 32.213 1.00 0.00 ATOM 122 C CYS 28 8.141 19.166 30.969 1.00 0.00 ATOM 123 N ALA 29 8.726 18.106 30.434 1.00 0.00 ATOM 124 CA ALA 29 9.304 17.083 31.300 1.00 0.00 ATOM 125 CB ALA 29 9.662 15.862 30.548 1.00 0.00 ATOM 126 O ALA 29 10.742 17.138 33.220 1.00 0.00 ATOM 127 C ALA 29 10.526 17.574 32.077 1.00 0.00 ATOM 128 N SER 30 11.341 18.423 31.459 1.00 0.00 ATOM 129 CA SER 30 12.528 18.973 32.101 1.00 0.00 ATOM 130 CB SER 30 13.368 19.819 31.132 1.00 0.00 ATOM 131 OG SER 30 13.722 19.026 30.017 1.00 0.00 ATOM 132 O SER 30 13.052 19.931 34.218 1.00 0.00 ATOM 133 C SER 30 12.204 19.818 33.327 1.00 0.00 ATOM 134 N LEU 31 11.031 20.452 33.349 1.00 0.00 ATOM 135 CA LEU 31 10.630 21.275 34.490 1.00 0.00 ATOM 136 CB LEU 31 9.345 22.034 34.172 1.00 0.00 ATOM 137 CG LEU 31 9.515 23.255 33.267 1.00 0.00 ATOM 138 CD1 LEU 31 8.160 23.636 32.678 1.00 0.00 ATOM 139 CD2 LEU 31 10.207 24.427 33.963 1.00 0.00 ATOM 140 O LEU 31 10.360 20.985 36.868 1.00 0.00 ATOM 141 C LEU 31 10.447 20.438 35.773 1.00 0.00 ATOM 142 N LEU 32 10.381 19.113 35.641 1.00 0.00 ATOM 143 CA LEU 32 10.253 18.243 36.795 1.00 0.00 ATOM 144 CB LEU 32 10.017 16.790 36.369 1.00 0.00 ATOM 145 CG LEU 32 8.615 16.433 35.853 1.00 0.00 ATOM 146 CD1 LEU 32 8.543 15.009 35.313 1.00 0.00 ATOM 147 CD2 LEU 32 7.598 16.571 36.965 1.00 0.00 ATOM 148 O LEU 32 11.387 18.086 38.910 1.00 0.00 ATOM 149 C LEU 32 11.480 18.318 37.705 1.00 0.00 ATOM 150 N VAL 33 12.651 18.619 37.149 1.00 0.00 ATOM 151 CA VAL 33 13.839 18.678 38.002 1.00 0.00 ATOM 152 CB VAL 33 15.164 18.692 37.204 1.00 0.00 ATOM 153 CG1 VAL 33 16.374 19.024 38.124 1.00 0.00 ATOM 154 CG2 VAL 33 15.363 17.361 36.510 1.00 0.00 ATOM 155 O VAL 33 13.782 19.657 40.166 1.00 0.00 ATOM 156 C VAL 33 13.727 19.869 38.965 1.00 0.00 ATOM 157 N PRO 34 13.577 21.116 38.457 1.00 0.00 ATOM 158 CA PRO 34 13.409 22.205 39.435 1.00 0.00 ATOM 159 CB PRO 34 13.436 23.462 38.595 1.00 0.00 ATOM 160 CG PRO 34 13.238 23.020 37.171 1.00 0.00 ATOM 161 CD PRO 34 13.663 21.612 37.075 1.00 0.00 ATOM 162 O PRO 34 12.136 22.554 41.423 1.00 0.00 ATOM 163 C PRO 34 12.146 22.096 40.285 1.00 0.00 ATOM 164 N PHE 35 11.108 21.447 39.775 1.00 0.00 ATOM 165 CA PHE 35 9.893 21.229 40.540 1.00 0.00 ATOM 166 CB PHE 35 8.860 20.493 39.685 1.00 0.00 ATOM 167 CG PHE 35 7.710 19.973 40.471 1.00 0.00 ATOM 168 CD1 PHE 35 6.674 20.821 40.864 1.00 0.00 ATOM 169 CD2 PHE 35 7.654 18.626 40.833 1.00 0.00 ATOM 170 CE1 PHE 35 5.597 20.341 41.606 1.00 0.00 ATOM 171 CE2 PHE 35 6.607 18.143 41.596 1.00 0.00 ATOM 172 CZ PHE 35 5.558 19.002 41.968 1.00 0.00 ATOM 173 O PHE 35 9.844 20.771 42.881 1.00 0.00 ATOM 174 C PHE 35 10.200 20.411 41.783 1.00 0.00 ATOM 175 N PHE 36 10.846 19.282 41.592 1.00 0.00 ATOM 176 CA PHE 36 11.238 18.427 42.697 1.00 0.00 ATOM 177 CB PHE 36 11.736 17.064 42.201 1.00 0.00 ATOM 178 CG PHE 36 10.612 16.055 41.980 1.00 0.00 ATOM 179 CD1 PHE 36 9.969 15.488 43.081 1.00 0.00 ATOM 180 CD2 PHE 36 10.196 15.703 40.713 1.00 0.00 ATOM 181 CE1 PHE 36 8.915 14.596 42.925 1.00 0.00 ATOM 182 CE2 PHE 36 9.154 14.777 40.519 1.00 0.00 ATOM 183 CZ PHE 36 8.511 14.214 41.620 1.00 0.00 ATOM 184 O PHE 36 12.252 18.861 44.819 1.00 0.00 ATOM 185 C PHE 36 12.284 19.062 43.598 1.00 0.00 ATOM 186 N GLU 37 13.210 19.824 43.007 1.00 0.00 ATOM 187 CA GLU 37 14.219 20.524 43.817 1.00 0.00 ATOM 188 CB GLU 37 15.286 21.241 42.967 1.00 0.00 ATOM 189 CG GLU 37 16.253 20.255 42.296 1.00 0.00 ATOM 190 CD GLU 37 17.221 20.915 41.288 1.00 0.00 ATOM 191 OE1 GLU 37 16.891 21.996 40.718 1.00 0.00 ATOM 192 OE2 GLU 37 18.320 20.339 41.053 1.00 0.00 ATOM 193 O GLU 37 13.905 21.608 45.923 1.00 0.00 ATOM 194 C GLU 37 13.519 21.490 44.776 1.00 0.00 ATOM 195 N ALA 38 12.475 22.163 44.306 1.00 0.00 ATOM 196 CA ALA 38 11.716 23.065 45.151 1.00 0.00 ATOM 197 CB ALA 38 10.707 23.836 44.308 1.00 0.00 ATOM 198 O ALA 38 11.000 22.773 47.404 1.00 0.00 ATOM 199 C ALA 38 10.997 22.320 46.268 1.00 0.00 ATOM 200 N THR 39 10.387 21.171 45.964 1.00 0.00 ATOM 201 CA THR 39 9.696 20.423 47.020 1.00 0.00 ATOM 202 CB THR 39 9.005 19.141 46.509 1.00 0.00 ATOM 203 CG2 THR 39 8.038 19.445 45.416 1.00 0.00 ATOM 204 OG1 THR 39 9.985 18.203 46.065 1.00 0.00 ATOM 205 O THR 39 10.378 20.047 49.303 1.00 0.00 ATOM 206 C THR 39 10.686 19.997 48.121 1.00 0.00 ATOM 207 N ILE 40 11.872 19.580 47.709 1.00 0.00 ATOM 208 CA ILE 40 12.923 19.112 48.606 1.00 0.00 ATOM 209 CB ILE 40 14.106 18.561 47.782 1.00 0.00 ATOM 210 CG1 ILE 40 13.735 17.213 47.163 1.00 0.00 ATOM 211 CG2 ILE 40 15.320 18.409 48.635 1.00 0.00 ATOM 212 CD1 ILE 40 14.764 16.727 46.139 1.00 0.00 ATOM 213 O ILE 40 13.680 20.010 50.719 1.00 0.00 ATOM 214 C ILE 40 13.412 20.235 49.549 1.00 0.00 ATOM 215 N THR 41 13.518 21.463 49.062 1.00 0.00 ATOM 216 CA THR 41 13.879 22.542 49.963 1.00 0.00 ATOM 217 CB THR 41 14.581 23.724 49.221 1.00 0.00 ATOM 218 CG2 THR 41 15.946 23.264 48.670 1.00 0.00 ATOM 219 OG1 THR 41 13.773 24.219 48.129 1.00 0.00 ATOM 220 O THR 41 12.747 24.032 51.425 1.00 0.00 ATOM 221 C THR 41 12.664 23.044 50.755 1.00 0.00 ATOM 222 N GLY 42 11.530 22.363 50.690 1.00 0.00 ATOM 223 CA GLY 42 10.327 22.823 51.382 1.00 0.00 ATOM 224 O GLY 42 8.860 24.699 51.564 1.00 0.00 ATOM 225 C GLY 42 9.676 24.105 50.857 1.00 0.00 ATOM 226 N ASN 43 10.023 24.560 49.648 1.00 0.00 ATOM 227 CA ASN 43 9.382 25.767 49.106 1.00 0.00 ATOM 228 CB ASN 43 10.358 26.651 48.328 1.00 0.00 ATOM 229 CG ASN 43 9.841 28.083 48.152 1.00 0.00 ATOM 230 ND2 ASN 43 10.751 29.043 48.252 1.00 0.00 ATOM 231 OD1 ASN 43 8.649 28.321 47.936 1.00 0.00 ATOM 232 O ASN 43 8.352 25.267 47.010 1.00 0.00 ATOM 233 C ASN 43 8.221 25.348 48.225 1.00 0.00 ATOM 234 N TRP 44 7.096 25.059 48.868 1.00 0.00 ATOM 235 CA TRP 44 5.880 24.635 48.206 1.00 0.00 ATOM 236 CB TRP 44 4.907 24.027 49.210 1.00 0.00 ATOM 237 CG TRP 44 5.474 22.760 49.717 1.00 0.00 ATOM 238 CD1 TRP 44 6.176 22.579 50.885 1.00 0.00 ATOM 239 CD2 TRP 44 5.496 21.504 49.041 1.00 0.00 ATOM 240 CE2 TRP 44 6.209 20.602 49.857 1.00 0.00 ATOM 241 CE3 TRP 44 4.978 21.048 47.830 1.00 0.00 ATOM 242 NE1 TRP 44 6.605 21.284 50.976 1.00 0.00 ATOM 243 CZ2 TRP 44 6.390 19.257 49.508 1.00 0.00 ATOM 244 CZ3 TRP 44 5.173 19.733 47.486 1.00 0.00 ATOM 245 CH2 TRP 44 5.869 18.847 48.321 1.00 0.00 ATOM 246 O TRP 44 4.568 25.345 46.345 1.00 0.00 ATOM 247 C TRP 44 5.221 25.692 47.333 1.00 0.00 ATOM 248 N ASP 45 5.399 26.962 47.676 1.00 0.00 ATOM 249 CA ASP 45 4.869 28.030 46.841 1.00 0.00 ATOM 250 CB ASP 45 5.101 29.424 47.454 1.00 0.00 ATOM 251 CG ASP 45 4.208 29.696 48.658 1.00 0.00 ATOM 252 OD1 ASP 45 3.432 28.790 49.055 1.00 0.00 ATOM 253 OD2 ASP 45 4.276 30.826 49.205 1.00 0.00 ATOM 254 O ASP 45 4.937 28.164 44.432 1.00 0.00 ATOM 255 C ASP 45 5.566 27.984 45.475 1.00 0.00 ATOM 256 N ASP 46 6.876 27.777 45.489 1.00 0.00 ATOM 257 CA ASP 46 7.616 27.691 44.257 1.00 0.00 ATOM 258 CB ASP 46 9.127 27.654 44.502 1.00 0.00 ATOM 259 CG ASP 46 9.692 28.998 44.946 1.00 0.00 ATOM 260 OD1 ASP 46 9.049 30.045 44.696 1.00 0.00 ATOM 261 OD2 ASP 46 10.785 29.003 45.560 1.00 0.00 ATOM 262 O ASP 46 7.139 26.488 42.263 1.00 0.00 ATOM 263 C ASP 46 7.252 26.440 43.478 1.00 0.00 ATOM 264 N ALA 47 7.084 25.323 44.173 1.00 0.00 ATOM 265 CA ALA 47 6.726 24.075 43.511 1.00 0.00 ATOM 266 CB ALA 47 6.682 22.964 44.485 1.00 0.00 ATOM 267 O ALA 47 5.201 23.724 41.721 1.00 0.00 ATOM 268 C ALA 47 5.385 24.227 42.812 1.00 0.00 ATOM 269 N VAL 48 4.458 24.923 43.455 1.00 0.00 ATOM 270 CA VAL 48 3.145 25.222 42.887 1.00 0.00 ATOM 271 CB VAL 48 2.255 25.952 43.935 1.00 0.00 ATOM 272 CG1 VAL 48 1.050 26.616 43.288 1.00 0.00 ATOM 273 CG2 VAL 48 1.841 25.007 45.046 1.00 0.00 ATOM 274 O VAL 48 2.658 25.804 40.599 1.00 0.00 ATOM 275 C VAL 48 3.305 26.083 41.617 1.00 0.00 ATOM 276 N GLN 49 4.167 27.099 41.665 1.00 0.00 ATOM 277 CA GLN 49 4.402 27.901 40.467 1.00 0.00 ATOM 278 CB GLN 49 5.280 29.106 40.759 1.00 0.00 ATOM 279 CG GLN 49 5.179 30.153 39.645 1.00 0.00 ATOM 280 CD GLN 49 6.137 31.281 39.793 1.00 0.00 ATOM 281 OE1 GLN 49 7.337 31.074 40.007 1.00 0.00 ATOM 282 NE2 GLN 49 5.630 32.501 39.645 1.00 0.00 ATOM 283 O GLN 49 4.675 27.162 38.192 1.00 0.00 ATOM 284 C GLN 49 5.055 27.053 39.349 1.00 0.00 ATOM 285 N ILE 50 6.037 26.207 39.675 1.00 0.00 ATOM 286 CA ILE 50 6.672 25.385 38.628 1.00 0.00 ATOM 287 CB ILE 50 7.935 24.680 39.134 1.00 0.00 ATOM 288 CG1 ILE 50 8.973 25.713 39.529 1.00 0.00 ATOM 289 CG2 ILE 50 8.509 23.789 38.037 1.00 0.00 ATOM 290 CD1 ILE 50 10.188 25.144 40.267 1.00 0.00 ATOM 291 O ILE 50 5.689 23.981 36.865 1.00 0.00 ATOM 292 C ILE 50 5.657 24.363 38.036 1.00 0.00 ATOM 293 N ARG 51 4.736 23.915 38.851 1.00 0.00 ATOM 294 CA ARG 51 3.678 23.074 38.351 1.00 0.00 ATOM 295 CB ARG 51 2.969 22.394 39.528 1.00 0.00 ATOM 296 CG ARG 51 1.508 22.139 39.432 1.00 0.00 ATOM 297 CD ARG 51 1.098 21.006 38.718 1.00 0.00 ATOM 298 NE ARG 51 -0.347 20.881 38.922 1.00 0.00 ATOM 299 CZ ARG 51 -1.112 19.978 38.311 1.00 0.00 ATOM 300 NH1 ARG 51 -0.584 19.140 37.435 1.00 0.00 ATOM 301 NH2 ARG 51 -2.413 19.921 38.574 1.00 0.00 ATOM 302 O ARG 51 2.288 23.196 36.410 1.00 0.00 ATOM 303 C ARG 51 2.763 23.820 37.378 1.00 0.00 ATOM 304 N LYS 52 2.566 25.135 37.564 1.00 0.00 ATOM 305 CA LYS 52 1.801 25.905 36.591 1.00 0.00 ATOM 306 CB LYS 52 1.440 27.294 37.128 1.00 0.00 ATOM 307 CG LYS 52 0.495 27.240 38.318 1.00 0.00 ATOM 308 CD LYS 52 0.088 28.610 38.867 1.00 0.00 ATOM 309 CE LYS 52 -0.832 28.390 40.096 1.00 0.00 ATOM 310 O LYS 52 2.011 26.101 34.199 1.00 0.00 ATOM 311 C LYS 52 2.585 26.011 35.269 1.00 0.00 ATOM 312 N GLN 53 3.901 26.080 35.361 1.00 0.00 ATOM 313 CA GLN 53 4.742 26.129 34.188 1.00 0.00 ATOM 314 CB GLN 53 6.190 26.419 34.621 1.00 0.00 ATOM 315 CG GLN 53 6.377 27.788 35.272 1.00 0.00 ATOM 316 CD GLN 53 7.788 28.027 35.854 1.00 0.00 ATOM 317 OE1 GLN 53 8.620 27.136 35.845 1.00 0.00 ATOM 318 NE2 GLN 53 8.047 29.253 36.346 1.00 0.00 ATOM 319 O GLN 53 4.452 24.669 32.272 1.00 0.00 ATOM 320 C GLN 53 4.606 24.757 33.465 1.00 0.00 ATOM 321 N ILE 54 4.655 23.673 34.212 1.00 0.00 ATOM 322 CA ILE 54 4.479 22.339 33.620 1.00 0.00 ATOM 323 CB ILE 54 4.665 21.187 34.688 1.00 0.00 ATOM 324 CG1 ILE 54 6.121 21.086 35.161 1.00 0.00 ATOM 325 CG2 ILE 54 4.262 19.802 34.156 1.00 0.00 ATOM 326 CD1 ILE 54 6.290 20.201 36.363 1.00 0.00 ATOM 327 O ILE 54 3.024 21.770 31.778 1.00 0.00 ATOM 328 C ILE 54 3.105 22.254 32.922 1.00 0.00 ATOM 329 N SER 55 2.052 22.759 33.562 1.00 0.00 ATOM 330 CA SER 55 0.711 22.738 32.962 1.00 0.00 ATOM 331 CB SER 55 -0.379 23.196 33.928 1.00 0.00 ATOM 332 OG SER 55 -0.553 22.261 34.965 1.00 0.00 ATOM 333 O SER 55 -0.109 23.219 30.812 1.00 0.00 ATOM 334 C SER 55 0.619 23.596 31.731 1.00 0.00 ATOM 335 N LEU 56 1.282 24.767 31.741 1.00 0.00 ATOM 336 CA LEU 56 1.282 25.613 30.594 1.00 0.00 ATOM 337 CB LEU 56 2.090 26.860 30.870 1.00 0.00 ATOM 338 CG LEU 56 2.244 27.788 29.690 1.00 0.00 ATOM 339 CD1 LEU 56 0.879 28.204 29.157 1.00 0.00 ATOM 340 CD2 LEU 56 3.100 28.989 30.069 1.00 0.00 ATOM 341 O LEU 56 1.392 24.917 28.354 1.00 0.00 ATOM 342 C LEU 56 1.927 24.906 29.426 1.00 0.00 ATOM 343 N ALA 57 3.101 24.311 29.630 1.00 0.00 ATOM 344 CA ALA 57 3.819 23.647 28.534 1.00 0.00 ATOM 345 CB ALA 57 5.195 23.162 28.983 1.00 0.00 ATOM 346 O ALA 57 3.081 22.180 26.800 1.00 0.00 ATOM 347 C ALA 57 3.018 22.476 27.970 1.00 0.00 ATOM 348 N GLU 58 2.259 21.815 28.826 1.00 0.00 ATOM 349 CA GLU 58 1.380 20.741 28.419 1.00 0.00 ATOM 350 CB GLU 58 0.882 19.988 29.667 1.00 0.00 ATOM 351 CG GLU 58 0.123 18.662 29.409 1.00 0.00 ATOM 352 CD GLU 58 -1.317 18.809 28.912 1.00 0.00 ATOM 353 OE1 GLU 58 -2.006 19.842 29.181 1.00 0.00 ATOM 354 OE2 GLU 58 -1.788 17.843 28.243 1.00 0.00 ATOM 355 O GLU 58 -0.135 20.681 26.575 1.00 0.00 ATOM 356 C GLU 58 0.221 21.280 27.580 1.00 0.00 ATOM 357 N LYS 59 -0.345 22.414 27.977 1.00 0.00 ATOM 358 CA LYS 59 -1.440 23.037 27.279 1.00 0.00 ATOM 359 CB LYS 59 -1.943 24.248 28.099 1.00 0.00 ATOM 360 CG LYS 59 -3.121 25.067 27.526 1.00 0.00 ATOM 361 CD LYS 59 -3.210 26.513 28.194 1.00 0.00 ATOM 362 O LYS 59 -1.630 23.224 24.894 1.00 0.00 ATOM 363 C LYS 59 -0.937 23.454 25.886 1.00 0.00 ATOM 364 N GLN 60 0.252 24.063 25.828 1.00 0.00 ATOM 365 CA GLN 60 0.868 24.508 24.581 1.00 0.00 ATOM 366 CB GLN 60 2.199 25.222 24.861 1.00 0.00 ATOM 367 CG GLN 60 2.062 26.566 25.588 1.00 0.00 ATOM 368 CD GLN 60 3.375 27.250 26.021 1.00 0.00 ATOM 369 OE1 GLN 60 4.376 26.592 26.280 1.00 0.00 ATOM 370 NE2 GLN 60 3.341 28.597 26.171 1.00 0.00 ATOM 371 O GLN 60 0.781 23.331 22.504 1.00 0.00 ATOM 372 C GLN 60 1.104 23.303 23.665 1.00 0.00 ATOM 373 N GLY 61 1.654 22.228 24.215 1.00 0.00 ATOM 374 CA GLY 61 1.867 20.984 23.475 1.00 0.00 ATOM 375 O GLY 61 0.480 20.091 21.726 1.00 0.00 ATOM 376 C GLY 61 0.550 20.458 22.889 1.00 0.00 ATOM 377 N ASP 62 -0.498 20.491 23.682 1.00 0.00 ATOM 378 CA ASP 62 -1.806 20.126 23.218 1.00 0.00 ATOM 379 CB ASP 62 -2.818 20.359 24.302 1.00 0.00 ATOM 380 CG ASP 62 -3.396 19.130 24.798 1.00 0.00 ATOM 381 OD1 ASP 62 -4.277 18.598 24.063 1.00 0.00 ATOM 382 OD2 ASP 62 -3.023 18.745 25.932 1.00 0.00 ATOM 383 O ASP 62 -2.896 20.370 21.121 1.00 0.00 ATOM 384 C ASP 62 -2.293 20.931 22.040 1.00 0.00 ATOM 385 N SER 63 -2.086 22.253 22.076 1.00 0.00 ATOM 386 CA SER 63 -2.524 23.073 20.998 1.00 0.00 ATOM 387 CB SER 63 -2.409 24.556 21.371 1.00 0.00 ATOM 388 OG SER 63 -3.185 24.729 22.534 1.00 0.00 ATOM 389 O SER 63 -2.339 22.768 18.670 1.00 0.00 ATOM 390 C SER 63 -1.764 22.757 19.728 1.00 0.00 ATOM 391 N LEU 64 -0.465 22.504 19.828 1.00 0.00 ATOM 392 CA LEU 64 0.310 22.084 18.648 1.00 0.00 ATOM 393 CB LEU 64 1.794 21.901 18.976 1.00 0.00 ATOM 394 CG LEU 64 2.583 23.118 19.450 1.00 0.00 ATOM 395 CD1 LEU 64 3.996 22.735 19.886 1.00 0.00 ATOM 396 CD2 LEU 64 2.633 24.177 18.380 1.00 0.00 ATOM 397 O LEU 64 -0.282 20.528 16.946 1.00 0.00 ATOM 398 C LEU 64 -0.202 20.751 18.132 1.00 0.00 ATOM 399 N LYS 65 -0.511 19.853 19.049 1.00 0.00 ATOM 400 CA LYS 65 -1.044 18.510 18.710 1.00 0.00 ATOM 401 CB LYS 65 -1.278 17.724 20.006 1.00 0.00 ATOM 402 CG LYS 65 -1.871 16.322 19.860 1.00 0.00 ATOM 403 CD LYS 65 -2.360 15.848 21.261 1.00 0.00 ATOM 404 CE LYS 65 -2.883 14.420 21.260 1.00 0.00 ATOM 405 NZ LYS 65 -3.502 14.059 22.597 1.00 0.00 ATOM 406 O LYS 65 -2.536 18.072 16.849 1.00 0.00 ATOM 407 C LYS 65 -2.348 18.656 17.915 1.00 0.00 ATOM 408 N ARG 66 -3.234 19.485 18.413 1.00 0.00 ATOM 409 CA ARG 66 -4.494 19.730 17.762 1.00 0.00 ATOM 410 CB ARG 66 -5.277 20.751 18.581 1.00 0.00 ATOM 411 CG ARG 66 -6.638 21.030 18.029 1.00 0.00 ATOM 412 CD ARG 66 -7.255 22.264 18.648 1.00 0.00 ATOM 413 NE ARG 66 -8.506 22.527 17.956 1.00 0.00 ATOM 414 CZ ARG 66 -9.700 22.055 18.293 1.00 0.00 ATOM 415 NH1 ARG 66 -9.863 21.285 19.364 1.00 0.00 ATOM 416 NH2 ARG 66 -10.746 22.374 17.548 1.00 0.00 ATOM 417 O ARG 66 -4.959 19.747 15.397 1.00 0.00 ATOM 418 C ARG 66 -4.317 20.242 16.325 1.00 0.00 ATOM 419 N GLU 67 -3.470 21.256 16.142 1.00 0.00 ATOM 420 CA GLU 67 -3.296 21.859 14.814 1.00 0.00 ATOM 421 CB GLU 67 -2.378 23.095 14.883 1.00 0.00 ATOM 422 O GLU 67 -3.203 20.705 12.716 1.00 0.00 ATOM 423 C GLU 67 -2.750 20.806 13.843 1.00 0.00 ATOM 424 N ILE 68 -1.785 20.020 14.295 1.00 0.00 ATOM 425 CA ILE 68 -1.249 18.922 13.474 1.00 0.00 ATOM 426 CB ILE 68 -0.107 18.150 14.167 1.00 0.00 ATOM 427 CG1 ILE 68 1.123 19.057 14.262 1.00 0.00 ATOM 428 CG2 ILE 68 0.221 16.879 13.345 1.00 0.00 ATOM 429 CD1 ILE 68 2.260 18.579 15.216 1.00 0.00 ATOM 430 O ILE 68 -2.498 17.597 11.904 1.00 0.00 ATOM 431 C ILE 68 -2.338 17.935 13.097 1.00 0.00 ATOM 432 N ARG 69 -3.132 17.513 14.066 1.00 0.00 ATOM 433 CA ARG 69 -4.207 16.557 13.764 1.00 0.00 ATOM 434 CB ARG 69 -4.923 16.115 15.008 1.00 0.00 ATOM 435 CG ARG 69 -4.028 15.322 15.896 1.00 0.00 ATOM 436 CD ARG 69 -4.520 15.367 17.332 1.00 0.00 ATOM 437 NE ARG 69 -5.710 14.548 17.533 1.00 0.00 ATOM 438 CZ ARG 69 -6.374 14.478 18.688 1.00 0.00 ATOM 439 NH1 ARG 69 -6.054 15.249 19.722 1.00 0.00 ATOM 440 NH2 ARG 69 -7.405 13.663 18.795 1.00 0.00 ATOM 441 O ARG 69 -5.823 16.291 12.073 1.00 0.00 ATOM 442 C ARG 69 -5.227 17.069 12.784 1.00 0.00 ATOM 443 N LEU 70 -5.453 18.367 12.759 1.00 0.00 ATOM 444 CA LEU 70 -6.413 18.909 11.866 1.00 0.00 ATOM 445 CB LEU 70 -7.176 20.060 12.541 1.00 0.00 ATOM 446 CG LEU 70 -7.999 19.741 13.792 1.00 0.00 ATOM 447 CD1 LEU 70 -8.662 21.015 14.301 1.00 0.00 ATOM 448 CD2 LEU 70 -9.050 18.639 13.473 1.00 0.00 ATOM 449 O LEU 70 -6.538 19.868 9.717 1.00 0.00 ATOM 450 C LEU 70 -5.805 19.399 10.544 1.00 0.00 ATOM 451 N THR 71 -4.492 19.286 10.336 1.00 0.00 ATOM 452 CA THR 71 -3.847 19.794 9.109 1.00 0.00 ATOM 453 CB THR 71 -3.007 21.084 9.423 1.00 0.00 ATOM 454 CG2 THR 71 -3.886 22.217 9.980 1.00 0.00 ATOM 455 OG1 THR 71 -1.993 20.781 10.394 1.00 0.00 ATOM 456 O THR 71 -2.804 17.619 8.707 1.00 0.00 ATOM 457 C THR 71 -2.916 18.819 8.381 1.00 0.00 ATOM 458 N GLY 75 -0.935 15.567 4.201 1.00 0.00 ATOM 459 CA GLY 75 -1.561 16.595 3.374 1.00 0.00 ATOM 460 O GLY 75 -3.052 15.865 1.663 1.00 0.00 ATOM 461 C GLY 75 -1.888 16.104 1.975 1.00 0.00 ATOM 462 N LEU 76 -0.867 15.985 1.122 1.00 0.00 ATOM 463 CA LEU 76 -1.035 15.484 -0.254 1.00 0.00 ATOM 464 CB LEU 76 -1.225 16.626 -1.259 1.00 0.00 ATOM 465 O LEU 76 0.286 13.488 -0.121 1.00 0.00 ATOM 466 C LEU 76 0.180 14.628 -0.603 1.00 0.00 ATOM 467 N PHE 77 1.086 15.141 -1.436 1.00 0.00 ATOM 468 CA PHE 77 2.316 14.406 -1.730 1.00 0.00 ATOM 469 CB PHE 77 3.100 15.051 -2.863 1.00 0.00 ATOM 470 CG PHE 77 2.444 14.931 -4.205 1.00 0.00 ATOM 471 CD1 PHE 77 2.251 13.688 -4.792 1.00 0.00 ATOM 472 CD2 PHE 77 2.076 16.062 -4.917 1.00 0.00 ATOM 473 CE1 PHE 77 1.667 13.566 -6.045 1.00 0.00 ATOM 474 CE2 PHE 77 1.499 15.948 -6.176 1.00 0.00 ATOM 475 CZ PHE 77 1.296 14.691 -6.738 1.00 0.00 ATOM 476 O PHE 77 3.533 15.412 0.104 1.00 0.00 ATOM 477 C PHE 77 3.145 14.368 -0.429 1.00 0.00 ATOM 478 N MET 78 3.426 13.157 0.054 1.00 0.00 ATOM 479 CA MET 78 4.056 12.947 1.364 1.00 0.00 ATOM 480 CB MET 78 2.987 12.334 2.269 1.00 0.00 ATOM 481 CG MET 78 1.919 13.268 2.712 1.00 0.00 ATOM 482 SD MET 78 2.642 14.258 4.158 1.00 0.00 ATOM 483 CE MET 78 2.602 12.946 5.535 1.00 0.00 ATOM 484 O MET 78 5.129 10.842 0.981 1.00 0.00 ATOM 485 C MET 78 5.256 11.992 1.398 1.00 0.00 ATOM 486 N PRO 79 6.407 12.443 1.946 1.00 0.00 ATOM 487 CA PRO 79 7.598 11.597 2.122 1.00 0.00 ATOM 488 CB PRO 79 8.684 12.619 2.427 1.00 0.00 ATOM 489 CG PRO 79 7.982 13.677 3.129 1.00 0.00 ATOM 490 CD PRO 79 6.660 13.812 2.435 1.00 0.00 ATOM 491 O PRO 79 8.432 9.771 3.419 1.00 0.00 ATOM 492 C PRO 79 7.535 10.588 3.288 1.00 0.00 ATOM 493 N VAL 80 6.515 10.702 4.140 1.00 0.00 ATOM 494 CA VAL 80 6.235 9.840 5.316 1.00 0.00 ATOM 495 CB VAL 80 6.694 10.551 6.634 1.00 0.00 ATOM 496 CG1 VAL 80 8.191 10.780 6.634 1.00 0.00 ATOM 497 CG2 VAL 80 5.981 11.881 6.827 1.00 0.00 ATOM 498 O VAL 80 3.935 10.307 4.841 1.00 0.00 ATOM 499 C VAL 80 4.710 9.569 5.402 1.00 0.00 ATOM 500 N GLU 81 4.279 8.521 6.086 1.00 0.00 ATOM 501 CA GLU 81 2.847 8.240 6.248 1.00 0.00 ATOM 502 CB GLU 81 2.606 6.802 6.703 1.00 0.00 ATOM 503 CG GLU 81 2.825 5.796 5.655 1.00 0.00 ATOM 504 CD GLU 81 1.638 5.693 4.754 1.00 0.00 ATOM 505 OE1 GLU 81 0.494 5.697 5.277 1.00 0.00 ATOM 506 OE2 GLU 81 1.849 5.596 3.531 1.00 0.00 ATOM 507 O GLU 81 2.740 9.348 8.371 1.00 0.00 ATOM 508 C GLU 81 2.202 9.137 7.282 1.00 0.00 ATOM 509 N ARG 82 1.024 9.631 6.925 1.00 0.00 ATOM 510 CA ARG 82 0.200 10.433 7.794 1.00 0.00 ATOM 511 CB ARG 82 -1.177 10.715 7.116 1.00 0.00 ATOM 512 CG ARG 82 -1.252 11.888 6.145 1.00 0.00 ATOM 513 CD ARG 82 -2.702 12.147 5.550 1.00 0.00 ATOM 514 NE ARG 82 -3.029 11.340 4.381 1.00 0.00 ATOM 515 O ARG 82 0.001 10.234 10.146 1.00 0.00 ATOM 516 C ARG 82 -0.051 9.669 9.081 1.00 0.00 ATOM 517 N THR 83 -0.374 8.397 8.981 1.00 0.00 ATOM 518 CA THR 83 -0.683 7.639 10.189 1.00 0.00 ATOM 519 CB THR 83 -1.337 6.344 9.867 1.00 0.00 ATOM 520 CG2 THR 83 -2.728 6.588 9.207 1.00 0.00 ATOM 521 OG1 THR 83 -0.491 5.608 8.983 1.00 0.00 ATOM 522 O THR 83 0.369 7.534 12.267 1.00 0.00 ATOM 523 C THR 83 0.528 7.467 11.091 1.00 0.00 ATOM 524 N ASP 84 1.727 7.327 10.540 1.00 0.00 ATOM 525 CA ASP 84 2.924 7.274 11.359 1.00 0.00 ATOM 526 CB ASP 84 4.172 6.976 10.511 1.00 0.00 ATOM 527 CG ASP 84 4.235 5.536 10.084 1.00 0.00 ATOM 528 OD1 ASP 84 3.619 4.717 10.788 1.00 0.00 ATOM 529 OD2 ASP 84 4.822 5.202 9.029 1.00 0.00 ATOM 530 O ASP 84 3.398 8.538 13.312 1.00 0.00 ATOM 531 C ASP 84 3.091 8.570 12.122 1.00 0.00 ATOM 532 N LEU 85 2.834 9.706 11.477 1.00 0.00 ATOM 533 CA LEU 85 3.012 10.990 12.172 1.00 0.00 ATOM 534 CB LEU 85 2.914 12.211 11.242 1.00 0.00 ATOM 535 CG LEU 85 3.961 12.198 10.110 1.00 0.00 ATOM 536 CD1 LEU 85 3.609 13.207 9.008 1.00 0.00 ATOM 537 CD2 LEU 85 5.359 12.413 10.628 1.00 0.00 ATOM 538 O LEU 85 2.395 11.613 14.324 1.00 0.00 ATOM 539 C LEU 85 2.043 11.120 13.283 1.00 0.00 ATOM 540 N LEU 86 0.814 10.666 13.070 1.00 0.00 ATOM 541 CA LEU 86 -0.193 10.718 14.136 1.00 0.00 ATOM 542 CB LEU 86 -1.587 10.336 13.597 1.00 0.00 ATOM 543 CG LEU 86 -2.239 11.357 12.667 1.00 0.00 ATOM 544 CD1 LEU 86 -3.568 10.820 12.163 1.00 0.00 ATOM 545 CD2 LEU 86 -2.429 12.694 13.384 1.00 0.00 ATOM 546 O LEU 86 0.108 10.228 16.470 1.00 0.00 ATOM 547 C LEU 86 0.183 9.811 15.318 1.00 0.00 ATOM 548 N GLU 87 0.617 8.594 15.022 1.00 0.00 ATOM 549 CA GLU 87 1.043 7.684 16.089 1.00 0.00 ATOM 550 CB GLU 87 1.290 6.302 15.519 1.00 0.00 ATOM 551 CG GLU 87 -0.005 5.762 14.943 1.00 0.00 ATOM 552 CD GLU 87 -0.075 4.262 14.862 1.00 0.00 ATOM 553 OE1 GLU 87 -0.290 3.682 15.933 1.00 0.00 ATOM 554 OE2 GLU 87 0.001 3.681 13.735 1.00 0.00 ATOM 555 O GLU 87 2.348 8.138 18.050 1.00 0.00 ATOM 556 C GLU 87 2.278 8.237 16.839 1.00 0.00 ATOM 557 N LEU 88 3.201 8.864 16.117 1.00 0.00 ATOM 558 CA LEU 88 4.353 9.472 16.730 1.00 0.00 ATOM 559 CB LEU 88 5.275 10.025 15.627 1.00 0.00 ATOM 560 CG LEU 88 6.539 10.746 16.083 1.00 0.00 ATOM 561 CD1 LEU 88 7.410 9.783 16.870 1.00 0.00 ATOM 562 CD2 LEU 88 7.306 11.310 14.868 1.00 0.00 ATOM 563 O LEU 88 4.271 10.589 18.848 1.00 0.00 ATOM 564 C LEU 88 3.886 10.561 17.685 1.00 0.00 ATOM 565 N LEU 89 3.013 11.428 17.201 1.00 0.00 ATOM 566 CA LEU 89 2.461 12.524 18.009 1.00 0.00 ATOM 567 CB LEU 89 1.412 13.277 17.157 1.00 0.00 ATOM 568 CG LEU 89 0.801 14.555 17.695 1.00 0.00 ATOM 569 CD1 LEU 89 1.857 15.577 17.936 1.00 0.00 ATOM 570 CD2 LEU 89 -0.226 15.063 16.668 1.00 0.00 ATOM 571 O LEU 89 1.893 12.643 20.324 1.00 0.00 ATOM 572 C LEU 89 1.793 12.040 19.270 1.00 0.00 ATOM 573 N THR 90 1.057 10.945 19.150 1.00 0.00 ATOM 574 CA THR 90 0.377 10.361 20.298 1.00 0.00 ATOM 575 CB THR 90 -0.426 9.151 19.859 1.00 0.00 ATOM 576 CG2 THR 90 -1.086 8.447 21.014 1.00 0.00 ATOM 577 OG1 THR 90 -1.420 9.612 18.990 1.00 0.00 ATOM 578 O THR 90 1.140 10.220 22.536 1.00 0.00 ATOM 579 C THR 90 1.368 9.953 21.361 1.00 0.00 ATOM 580 N GLN 91 2.458 9.294 20.967 1.00 0.00 ATOM 581 CA GLN 91 3.469 8.884 21.939 1.00 0.00 ATOM 582 CB GLN 91 4.511 7.970 21.278 1.00 0.00 ATOM 583 CG GLN 91 3.950 6.621 20.852 1.00 0.00 ATOM 584 CD GLN 91 3.213 5.904 22.015 1.00 0.00 ATOM 585 OE1 GLN 91 3.695 5.889 23.163 1.00 0.00 ATOM 586 NE2 GLN 91 2.015 5.384 21.728 1.00 0.00 ATOM 587 O GLN 91 4.382 10.062 23.796 1.00 0.00 ATOM 588 C GLN 91 4.144 10.068 22.592 1.00 0.00 ATOM 589 N GLN 92 4.473 11.078 21.797 1.00 0.00 ATOM 590 CA GLN 92 5.076 12.290 22.319 1.00 0.00 ATOM 591 CB GLN 92 5.370 13.236 21.140 1.00 0.00 ATOM 592 CG GLN 92 6.513 12.705 20.215 1.00 0.00 ATOM 593 CD GLN 92 6.910 13.617 19.060 1.00 0.00 ATOM 594 OE1 GLN 92 6.367 14.719 18.868 1.00 0.00 ATOM 595 NE2 GLN 92 7.889 13.164 18.292 1.00 0.00 ATOM 596 O GLN 92 4.732 13.409 24.415 1.00 0.00 ATOM 597 C GLN 92 4.219 12.984 23.360 1.00 0.00 ATOM 598 N ASP 93 2.922 13.133 23.111 1.00 0.00 ATOM 599 CA ASP 93 2.107 13.933 24.035 1.00 0.00 ATOM 600 CB ASP 93 0.794 14.367 23.360 1.00 0.00 ATOM 601 CG ASP 93 0.251 15.715 23.873 1.00 0.00 ATOM 602 OD1 ASP 93 0.742 16.832 23.492 1.00 0.00 ATOM 603 OD2 ASP 93 -0.764 15.648 24.594 1.00 0.00 ATOM 604 O ASP 93 1.753 13.763 26.408 1.00 0.00 ATOM 605 C ASP 93 1.930 13.154 25.365 1.00 0.00 ATOM 606 N LYS 94 1.995 11.818 25.347 1.00 0.00 ATOM 607 CA LYS 94 1.975 11.059 26.615 1.00 0.00 ATOM 608 CB LYS 94 2.122 9.566 26.358 1.00 0.00 ATOM 609 CG LYS 94 0.870 8.895 25.754 1.00 0.00 ATOM 610 CD LYS 94 1.145 7.425 25.498 1.00 0.00 ATOM 611 CE LYS 94 -0.093 6.686 24.872 1.00 0.00 ATOM 612 O LYS 94 2.820 11.479 28.809 1.00 0.00 ATOM 613 C LYS 94 3.064 11.492 27.604 1.00 0.00 ATOM 614 N ILE 95 4.232 11.888 27.102 1.00 0.00 ATOM 615 CA ILE 95 5.332 12.305 27.957 1.00 0.00 ATOM 616 CB ILE 95 6.641 12.489 27.147 1.00 0.00 ATOM 617 CG1 ILE 95 7.133 11.149 26.561 1.00 0.00 ATOM 618 CG2 ILE 95 7.736 13.113 28.000 1.00 0.00 ATOM 619 CD1 ILE 95 8.176 11.327 25.463 1.00 0.00 ATOM 620 O ILE 95 5.115 13.640 29.968 1.00 0.00 ATOM 621 C ILE 95 4.943 13.562 28.735 1.00 0.00 ATOM 622 N ALA 96 4.415 14.547 28.037 1.00 0.00 ATOM 623 CA ALA 96 3.948 15.763 28.703 1.00 0.00 ATOM 624 CB ALA 96 3.509 16.750 27.687 1.00 0.00 ATOM 625 O ALA 96 2.828 15.979 30.805 1.00 0.00 ATOM 626 C ALA 96 2.816 15.464 29.705 1.00 0.00 ATOM 627 N ASN 97 1.835 14.660 29.326 1.00 0.00 ATOM 628 CA ASN 97 0.778 14.301 30.252 1.00 0.00 ATOM 629 CB ASN 97 -0.213 13.305 29.594 1.00 0.00 ATOM 630 CG ASN 97 -1.055 13.928 28.492 1.00 0.00 ATOM 631 ND2 ASN 97 -1.690 13.086 27.627 1.00 0.00 ATOM 632 OD1 ASN 97 -1.123 15.136 28.394 1.00 0.00 ATOM 633 O ASN 97 0.818 13.778 32.627 1.00 0.00 ATOM 634 C ASN 97 1.324 13.604 31.532 1.00 0.00 ATOM 635 N LYS 98 2.331 12.765 31.363 1.00 0.00 ATOM 636 CA LYS 98 2.967 12.093 32.490 1.00 0.00 ATOM 637 CB LYS 98 4.031 11.104 31.948 1.00 0.00 ATOM 638 CG LYS 98 4.846 10.265 32.959 1.00 0.00 ATOM 639 CD LYS 98 3.986 9.398 33.839 1.00 0.00 ATOM 640 CE LYS 98 3.468 8.161 33.153 1.00 0.00 ATOM 641 NZ LYS 98 2.618 7.366 34.124 1.00 0.00 ATOM 642 O LYS 98 3.436 13.093 34.624 1.00 0.00 ATOM 643 C LYS 98 3.609 13.152 33.427 1.00 0.00 ATOM 644 N ALA 99 4.340 14.114 32.877 1.00 0.00 ATOM 645 CA ALA 99 4.949 15.113 33.696 1.00 0.00 ATOM 646 CB ALA 99 5.820 16.035 32.853 1.00 0.00 ATOM 647 O ALA 99 4.054 16.142 35.676 1.00 0.00 ATOM 648 C ALA 99 3.893 15.899 34.476 1.00 0.00 ATOM 649 N LYS 100 2.827 16.318 33.810 1.00 0.00 ATOM 650 CA LYS 100 1.749 17.065 34.474 1.00 0.00 ATOM 651 CB LYS 100 0.711 17.447 33.446 1.00 0.00 ATOM 652 CG LYS 100 -0.365 18.329 34.015 1.00 0.00 ATOM 653 CD LYS 100 -1.441 18.572 33.006 1.00 0.00 ATOM 654 CE LYS 100 -2.478 19.518 33.613 1.00 0.00 ATOM 655 NZ LYS 100 -3.674 19.636 32.721 1.00 0.00 ATOM 656 O LYS 100 0.827 16.710 36.694 1.00 0.00 ATOM 657 C LYS 100 1.084 16.225 35.586 1.00 0.00 ATOM 658 N ASP 101 0.821 14.957 35.292 1.00 0.00 ATOM 659 CA ASP 101 0.248 14.063 36.274 1.00 0.00 ATOM 660 CB ASP 101 -0.017 12.658 35.652 1.00 0.00 ATOM 661 CG ASP 101 -1.271 12.632 34.756 1.00 0.00 ATOM 662 OD1 ASP 101 -2.010 13.644 34.680 1.00 0.00 ATOM 663 OD2 ASP 101 -1.518 11.590 34.118 1.00 0.00 ATOM 664 O ASP 101 0.651 13.914 38.642 1.00 0.00 ATOM 665 C ASP 101 1.133 13.878 37.522 1.00 0.00 ATOM 666 N ILE 102 2.406 13.593 37.313 1.00 0.00 ATOM 667 CA ILE 102 3.327 13.417 38.408 1.00 0.00 ATOM 668 CB ILE 102 4.752 13.183 37.893 1.00 0.00 ATOM 669 CG1 ILE 102 4.827 11.840 37.165 1.00 0.00 ATOM 670 CG2 ILE 102 5.768 13.270 39.077 1.00 0.00 ATOM 671 CD1 ILE 102 6.154 11.507 36.561 1.00 0.00 ATOM 672 O ILE 102 3.248 14.598 40.510 1.00 0.00 ATOM 673 C ILE 102 3.360 14.678 39.293 1.00 0.00 ATOM 674 N SER 103 3.534 15.836 38.675 1.00 0.00 ATOM 675 CA SER 103 3.611 17.065 39.446 1.00 0.00 ATOM 676 CB SER 103 3.948 18.277 38.544 1.00 0.00 ATOM 677 OG SER 103 3.069 18.347 37.430 1.00 0.00 ATOM 678 O SER 103 2.435 17.796 41.392 1.00 0.00 ATOM 679 C SER 103 2.347 17.338 40.248 1.00 0.00 ATOM 680 N GLY 104 1.185 17.049 39.661 1.00 0.00 ATOM 681 CA GLY 104 -0.102 17.225 40.343 1.00 0.00 ATOM 682 O GLY 104 -0.645 16.763 42.583 1.00 0.00 ATOM 683 C GLY 104 -0.232 16.318 41.535 1.00 0.00 ATOM 684 N ARG 105 0.122 15.033 41.386 1.00 0.00 ATOM 685 CA ARG 105 0.005 14.089 42.498 1.00 0.00 ATOM 686 CB ARG 105 0.200 12.644 41.971 1.00 0.00 ATOM 687 CG ARG 105 -1.095 12.116 41.160 1.00 0.00 ATOM 688 CD ARG 105 -2.178 11.513 42.123 1.00 0.00 ATOM 689 NE ARG 105 -2.321 10.025 42.057 1.00 0.00 ATOM 690 CZ ARG 105 -2.674 9.270 43.087 1.00 0.00 ATOM 691 NH1 ARG 105 -2.867 9.844 44.269 1.00 0.00 ATOM 692 NH2 ARG 105 -2.818 7.916 42.967 1.00 0.00 ATOM 693 O ARG 105 0.587 14.410 44.849 1.00 0.00 ATOM 694 C ARG 105 0.937 14.493 43.654 1.00 0.00 ATOM 695 N VAL 106 2.112 15.004 43.312 1.00 0.00 ATOM 696 CA VAL 106 3.091 15.404 44.324 1.00 0.00 ATOM 697 CB VAL 106 4.462 15.626 43.665 1.00 0.00 ATOM 698 CG1 VAL 106 5.429 16.288 44.621 1.00 0.00 ATOM 699 CG2 VAL 106 5.013 14.279 43.219 1.00 0.00 ATOM 700 O VAL 106 2.654 16.713 46.315 1.00 0.00 ATOM 701 C VAL 106 2.591 16.642 45.098 1.00 0.00 ATOM 702 N ILE 107 2.088 17.624 44.384 1.00 0.00 ATOM 703 CA ILE 107 1.481 18.780 45.052 1.00 0.00 ATOM 704 CB ILE 107 1.029 19.832 44.022 1.00 0.00 ATOM 705 CG1 ILE 107 2.247 20.491 43.416 1.00 0.00 ATOM 706 CG2 ILE 107 0.141 20.880 44.665 1.00 0.00 ATOM 707 CD1 ILE 107 3.094 21.330 44.365 1.00 0.00 ATOM 708 O ILE 107 0.117 18.816 47.020 1.00 0.00 ATOM 709 C ILE 107 0.279 18.364 45.902 1.00 0.00 ATOM 710 N GLY 108 -0.551 17.484 45.376 1.00 0.00 ATOM 711 CA GLY 108 -1.728 17.037 46.105 1.00 0.00 ATOM 712 O GLY 108 -2.249 16.422 48.347 1.00 0.00 ATOM 713 C GLY 108 -1.446 16.324 47.433 1.00 0.00 ATOM 714 N ARG 109 -0.340 15.589 47.549 1.00 0.00 ATOM 715 CA ARG 109 -0.037 14.935 48.801 1.00 0.00 ATOM 716 CB ARG 109 0.516 13.534 48.543 1.00 0.00 ATOM 717 CG ARG 109 -0.409 12.595 47.817 1.00 0.00 ATOM 718 CD ARG 109 0.108 11.161 47.870 1.00 0.00 ATOM 719 NE ARG 109 0.225 10.622 49.219 1.00 0.00 ATOM 720 CZ ARG 109 -0.753 10.039 49.885 1.00 0.00 ATOM 721 NH1 ARG 109 -1.935 9.942 49.340 1.00 0.00 ATOM 722 NH2 ARG 109 -0.551 9.590 51.115 1.00 0.00 ATOM 723 O ARG 109 1.314 15.298 50.683 1.00 0.00 ATOM 724 C ARG 109 1.016 15.686 49.573 1.00 0.00 ATOM 725 N GLN 110 1.566 16.758 48.999 1.00 0.00 ATOM 726 CA GLN 110 2.757 17.450 49.553 1.00 0.00 ATOM 727 CB GLN 110 2.454 18.336 50.759 1.00 0.00 ATOM 728 CG GLN 110 1.698 19.576 50.358 1.00 0.00 ATOM 729 CD GLN 110 1.960 20.763 51.269 1.00 0.00 ATOM 730 OE1 GLN 110 1.823 21.896 50.830 1.00 0.00 ATOM 731 NE2 GLN 110 2.371 20.514 52.529 1.00 0.00 ATOM 732 O GLN 110 4.285 16.345 50.991 1.00 0.00 ATOM 733 C GLN 110 3.815 16.419 49.883 1.00 0.00 ATOM 734 N LEU 111 4.143 15.607 48.891 1.00 0.00 ATOM 735 CA LEU 111 5.104 14.539 49.033 1.00 0.00 ATOM 736 CB LEU 111 5.211 13.777 47.702 1.00 0.00 ATOM 737 CG LEU 111 6.305 12.689 47.640 1.00 0.00 ATOM 738 CD1 LEU 111 6.040 11.662 48.714 1.00 0.00 ATOM 739 CD2 LEU 111 6.442 12.007 46.298 1.00 0.00 ATOM 740 O LEU 111 7.099 15.771 48.686 1.00 0.00 ATOM 741 C LEU 111 6.488 15.013 49.418 1.00 0.00 ATOM 742 N LEU 112 6.990 14.545 50.554 1.00 0.00 ATOM 743 CA LEU 112 8.358 14.838 50.975 1.00 0.00 ATOM 744 CB LEU 112 8.389 15.236 52.450 1.00 0.00 ATOM 745 CG LEU 112 9.691 15.882 52.973 1.00 0.00 ATOM 746 O LEU 112 9.024 12.516 51.206 1.00 0.00 ATOM 747 C LEU 112 9.237 13.590 50.672 1.00 0.00 ATOM 748 N ILE 113 10.189 13.715 49.764 1.00 0.00 ATOM 749 CA ILE 113 11.128 12.647 49.512 1.00 0.00 ATOM 750 CB ILE 113 12.031 12.959 48.276 1.00 0.00 ATOM 751 CG1 ILE 113 11.235 13.334 47.004 1.00 0.00 ATOM 752 CG2 ILE 113 12.963 11.804 47.999 1.00 0.00 ATOM 753 CD1 ILE 113 10.653 12.198 46.216 1.00 0.00 ATOM 754 O ILE 113 12.570 13.655 51.131 1.00 0.00 ATOM 755 C ILE 113 12.035 12.619 50.753 1.00 0.00 ATOM 756 N PRO 114 12.178 11.463 51.423 1.00 0.00 ATOM 757 CA PRO 114 13.101 11.357 52.571 1.00 0.00 ATOM 758 CB PRO 114 13.075 9.883 52.872 1.00 0.00 ATOM 759 CG PRO 114 11.664 9.490 52.477 1.00 0.00 ATOM 760 CD PRO 114 11.432 10.208 51.212 1.00 0.00 ATOM 761 O PRO 114 15.026 11.656 51.136 1.00 0.00 ATOM 762 C PRO 114 14.526 11.839 52.245 1.00 0.00 ATOM 763 N GLN 115 15.149 12.467 53.231 1.00 0.00 ATOM 764 CA GLN 115 16.473 13.079 53.113 1.00 0.00 ATOM 765 CB GLN 115 16.982 13.404 54.543 1.00 0.00 ATOM 766 CG GLN 115 18.388 13.980 54.626 1.00 0.00 ATOM 767 CD GLN 115 18.468 15.373 54.034 1.00 0.00 ATOM 768 OE1 GLN 115 17.526 16.168 54.157 1.00 0.00 ATOM 769 NE2 GLN 115 19.602 15.689 53.408 1.00 0.00 ATOM 770 O GLN 115 18.109 12.717 51.411 1.00 0.00 ATOM 771 C GLN 115 17.497 12.250 52.357 1.00 0.00 ATOM 772 N ALA 116 17.644 11.008 52.771 1.00 0.00 ATOM 773 CA ALA 116 18.607 10.072 52.208 1.00 0.00 ATOM 774 CB ALA 116 18.559 8.785 53.041 1.00 0.00 ATOM 775 O ALA 116 19.292 9.320 50.069 1.00 0.00 ATOM 776 C ALA 116 18.369 9.734 50.761 1.00 0.00 ATOM 777 N LEU 117 17.128 9.882 50.305 1.00 0.00 ATOM 778 CA LEU 117 16.777 9.569 48.933 1.00 0.00 ATOM 779 CB LEU 117 15.336 9.073 48.893 1.00 0.00 ATOM 780 CG LEU 117 14.950 7.814 49.686 1.00 0.00 ATOM 781 CD1 LEU 117 13.555 7.416 49.299 1.00 0.00 ATOM 782 CD2 LEU 117 15.880 6.685 49.392 1.00 0.00 ATOM 783 O LEU 117 16.731 10.617 46.805 1.00 0.00 ATOM 784 C LEU 117 16.847 10.775 48.012 1.00 0.00 ATOM 785 N GLN 118 17.035 11.974 48.569 1.00 0.00 ATOM 786 CA GLN 118 16.929 13.184 47.771 1.00 0.00 ATOM 787 CB GLN 118 16.994 14.411 48.679 1.00 0.00 ATOM 788 CG GLN 118 15.782 14.514 49.604 1.00 0.00 ATOM 789 CD GLN 118 15.775 15.735 50.521 1.00 0.00 ATOM 790 OE1 GLN 118 16.742 16.511 50.598 1.00 0.00 ATOM 791 NE2 GLN 118 14.657 15.927 51.190 1.00 0.00 ATOM 792 O GLN 118 17.533 13.373 45.468 1.00 0.00 ATOM 793 C GLN 118 17.928 13.266 46.622 1.00 0.00 ATOM 794 N VAL 119 19.209 13.148 46.932 1.00 0.00 ATOM 795 CA VAL 119 20.246 13.231 45.929 1.00 0.00 ATOM 796 CB VAL 119 21.678 13.289 46.578 1.00 0.00 ATOM 797 CG1 VAL 119 22.809 12.967 45.542 1.00 0.00 ATOM 798 CG2 VAL 119 21.902 14.685 47.247 1.00 0.00 ATOM 799 O VAL 119 20.078 12.510 43.660 1.00 0.00 ATOM 800 C VAL 119 20.082 12.166 44.845 1.00 0.00 ATOM 801 N PRO 120 19.990 10.890 45.234 1.00 0.00 ATOM 802 CA PRO 120 19.774 9.826 44.238 1.00 0.00 ATOM 803 CB PRO 120 19.770 8.530 45.070 1.00 0.00 ATOM 804 CG PRO 120 19.696 8.951 46.528 1.00 0.00 ATOM 805 CD PRO 120 20.235 10.363 46.596 1.00 0.00 ATOM 806 O PRO 120 18.462 9.483 42.297 1.00 0.00 ATOM 807 C PRO 120 18.486 9.916 43.441 1.00 0.00 ATOM 808 N PHE 121 17.418 10.417 44.054 1.00 0.00 ATOM 809 CA PHE 121 16.153 10.582 43.347 1.00 0.00 ATOM 810 CB PHE 121 15.037 10.995 44.279 1.00 0.00 ATOM 811 CG PHE 121 13.736 11.199 43.583 1.00 0.00 ATOM 812 CD1 PHE 121 12.898 10.138 43.353 1.00 0.00 ATOM 813 CD2 PHE 121 13.359 12.453 43.138 1.00 0.00 ATOM 814 CE1 PHE 121 11.684 10.321 42.670 1.00 0.00 ATOM 815 CE2 PHE 121 12.148 12.647 42.469 1.00 0.00 ATOM 816 CZ PHE 121 11.310 11.583 42.233 1.00 0.00 ATOM 817 O PHE 121 15.922 11.379 41.121 1.00 0.00 ATOM 818 C PHE 121 16.336 11.617 42.247 1.00 0.00 ATOM 819 N ILE 122 16.941 12.755 42.566 1.00 0.00 ATOM 820 CA ILE 122 17.170 13.769 41.555 1.00 0.00 ATOM 821 CB ILE 122 17.729 15.080 42.174 1.00 0.00 ATOM 822 CG1 ILE 122 16.668 15.699 43.095 1.00 0.00 ATOM 823 CG2 ILE 122 18.119 16.092 41.087 1.00 0.00 ATOM 824 CD1 ILE 122 15.334 16.063 42.354 1.00 0.00 ATOM 825 O ILE 122 17.786 13.504 39.217 1.00 0.00 ATOM 826 C ILE 122 18.055 13.229 40.402 1.00 0.00 ATOM 827 N ALA 123 19.083 12.456 40.732 1.00 0.00 ATOM 828 CA ALA 123 19.961 11.911 39.689 1.00 0.00 ATOM 829 CB ALA 123 21.291 11.249 40.304 1.00 0.00 ATOM 830 O ALA 123 19.420 10.893 37.578 1.00 0.00 ATOM 831 C ALA 123 19.199 10.915 38.797 1.00 0.00 ATOM 832 N TYR 124 18.338 10.097 39.401 1.00 0.00 ATOM 833 CA TYR 124 17.467 9.164 38.659 1.00 0.00 ATOM 834 CB TYR 124 16.711 8.262 39.645 1.00 0.00 ATOM 835 CG TYR 124 15.601 7.390 39.045 1.00 0.00 ATOM 836 CD1 TYR 124 15.897 6.350 38.157 1.00 0.00 ATOM 837 CD2 TYR 124 14.273 7.557 39.429 1.00 0.00 ATOM 838 CE1 TYR 124 14.878 5.544 37.615 1.00 0.00 ATOM 839 CE2 TYR 124 13.251 6.752 38.884 1.00 0.00 ATOM 840 CZ TYR 124 13.573 5.756 37.992 1.00 0.00 ATOM 841 OH TYR 124 12.588 4.951 37.503 1.00 0.00 ATOM 842 O TYR 124 16.293 9.585 36.557 1.00 0.00 ATOM 843 C TYR 124 16.472 9.921 37.742 1.00 0.00 ATOM 844 N LEU 125 15.828 10.936 38.295 1.00 0.00 ATOM 845 CA LEU 125 14.919 11.776 37.539 1.00 0.00 ATOM 846 CB LEU 125 14.388 12.866 38.439 1.00 0.00 ATOM 847 CG LEU 125 13.528 13.975 37.852 1.00 0.00 ATOM 848 CD1 LEU 125 12.290 13.417 37.151 1.00 0.00 ATOM 849 CD2 LEU 125 13.141 14.948 38.958 1.00 0.00 ATOM 850 O LEU 125 15.051 12.390 35.257 1.00 0.00 ATOM 851 C LEU 125 15.586 12.399 36.359 1.00 0.00 ATOM 852 N GLN 126 16.755 12.971 36.588 1.00 0.00 ATOM 853 CA GLN 126 17.508 13.642 35.549 1.00 0.00 ATOM 854 CB GLN 126 18.751 14.270 36.174 1.00 0.00 ATOM 855 CG GLN 126 19.629 15.036 35.185 1.00 0.00 ATOM 856 CD GLN 126 18.903 16.178 34.512 1.00 0.00 ATOM 857 OE1 GLN 126 18.736 17.218 35.106 1.00 0.00 ATOM 858 NE2 GLN 126 18.490 15.990 33.240 1.00 0.00 ATOM 859 O GLN 126 17.760 13.003 33.233 1.00 0.00 ATOM 860 C GLN 126 17.881 12.678 34.416 1.00 0.00 ATOM 861 N ARG 127 18.303 11.472 34.780 1.00 0.00 ATOM 862 CA ARG 127 18.657 10.476 33.791 1.00 0.00 ATOM 863 CB ARG 127 19.327 9.298 34.464 1.00 0.00 ATOM 864 CG ARG 127 20.318 8.596 33.599 1.00 0.00 ATOM 865 CD ARG 127 21.591 9.416 33.503 1.00 0.00 ATOM 866 NE ARG 127 22.480 8.802 32.548 1.00 0.00 ATOM 867 CZ ARG 127 22.627 9.157 31.273 1.00 0.00 ATOM 868 NH1 ARG 127 21.973 10.187 30.748 1.00 0.00 ATOM 869 NH2 ARG 127 23.478 8.479 30.520 1.00 0.00 ATOM 870 O ARG 127 17.473 9.740 31.804 1.00 0.00 ATOM 871 C ARG 127 17.395 10.004 32.990 1.00 0.00 ATOM 872 N CYS 128 16.250 9.873 33.644 1.00 0.00 ATOM 873 CA CYS 128 14.987 9.585 32.923 1.00 0.00 ATOM 874 CB CYS 128 13.837 9.324 33.928 1.00 0.00 ATOM 875 SG CYS 128 14.119 7.821 34.873 1.00 0.00 ATOM 876 O CYS 128 14.127 10.500 30.866 1.00 0.00 ATOM 877 C CYS 128 14.621 10.721 31.954 1.00 0.00 ATOM 878 N ILE 129 14.838 11.945 32.371 1.00 0.00 ATOM 879 CA ILE 129 14.646 13.080 31.492 1.00 0.00 ATOM 880 CB ILE 129 14.712 14.359 32.332 1.00 0.00 ATOM 881 CG1 ILE 129 13.341 14.531 33.005 1.00 0.00 ATOM 882 CG2 ILE 129 15.056 15.568 31.479 1.00 0.00 ATOM 883 CD1 ILE 129 13.353 15.505 34.108 1.00 0.00 ATOM 884 O ILE 129 15.292 13.538 29.191 1.00 0.00 ATOM 885 C ILE 129 15.640 13.078 30.299 1.00 0.00 ATOM 886 N ASP 130 16.865 12.578 30.529 1.00 0.00 ATOM 887 CA ASP 130 17.855 12.457 29.472 1.00 0.00 ATOM 888 CB ASP 130 19.189 11.945 30.024 1.00 0.00 ATOM 889 CG ASP 130 19.891 12.936 30.987 1.00 0.00 ATOM 890 OD1 ASP 130 19.583 14.156 30.994 1.00 0.00 ATOM 891 OD2 ASP 130 20.814 12.484 31.719 1.00 0.00 ATOM 892 O ASP 130 17.640 11.654 27.216 1.00 0.00 ATOM 893 C ASP 130 17.337 11.498 28.389 1.00 0.00 ATOM 894 N ALA 131 16.544 10.500 28.789 1.00 0.00 ATOM 895 CA ALA 131 15.936 9.590 27.850 1.00 0.00 ATOM 896 CB ALA 131 15.269 8.458 28.583 1.00 0.00 ATOM 897 O ALA 131 14.875 10.093 25.747 1.00 0.00 ATOM 898 C ALA 131 14.941 10.341 26.947 1.00 0.00 ATOM 899 N VAL 132 14.203 11.283 27.519 1.00 0.00 ATOM 900 CA VAL 132 13.329 12.146 26.734 1.00 0.00 ATOM 901 CB VAL 132 12.430 13.076 27.640 1.00 0.00 ATOM 902 CG1 VAL 132 11.432 13.877 26.784 1.00 0.00 ATOM 903 CG2 VAL 132 11.727 12.283 28.732 1.00 0.00 ATOM 904 O VAL 132 13.816 13.272 24.666 1.00 0.00 ATOM 905 C VAL 132 14.202 13.019 25.801 1.00 0.00 ATOM 906 N GLY 133 15.331 13.514 26.324 1.00 0.00 ATOM 907 CA GLY 133 16.316 14.310 25.563 1.00 0.00 ATOM 908 O GLY 133 16.971 14.062 23.319 1.00 0.00 ATOM 909 C GLY 133 16.810 13.523 24.352 1.00 0.00 ATOM 910 N LEU 134 17.032 12.225 24.494 1.00 0.00 ATOM 911 CA LEU 134 17.421 11.391 23.377 1.00 0.00 ATOM 912 CB LEU 134 17.770 9.966 23.842 1.00 0.00 ATOM 913 CG LEU 134 18.108 9.019 22.669 1.00 0.00 ATOM 914 CD1 LEU 134 19.297 9.578 21.873 1.00 0.00 ATOM 915 CD2 LEU 134 18.353 7.562 23.134 1.00 0.00 ATOM 916 O LEU 134 16.591 11.460 21.129 1.00 0.00 ATOM 917 C LEU 134 16.313 11.344 22.321 1.00 0.00 ATOM 918 N ALA 135 15.060 11.199 22.745 1.00 0.00 ATOM 919 CA ALA 135 13.957 11.238 21.796 1.00 0.00 ATOM 920 CB ALA 135 12.618 10.992 22.487 1.00 0.00 ATOM 921 O ALA 135 13.802 12.555 19.790 1.00 0.00 ATOM 922 C ALA 135 13.928 12.551 21.013 1.00 0.00 ATOM 923 N GLN 136 14.041 13.664 21.714 1.00 0.00 ATOM 924 CA GLN 136 14.107 14.965 21.063 1.00 0.00 ATOM 925 CB GLN 136 14.295 16.093 22.109 1.00 0.00 ATOM 926 CG GLN 136 14.561 17.489 21.480 1.00 0.00 ATOM 927 CD GLN 136 14.971 18.524 22.463 1.00 0.00 ATOM 928 OE1 GLN 136 15.830 18.279 23.328 1.00 0.00 ATOM 929 NE2 GLN 136 14.380 19.728 22.343 1.00 0.00 ATOM 930 O GLN 136 15.114 15.473 18.961 1.00 0.00 ATOM 931 C GLN 136 15.266 14.989 20.076 1.00 0.00 ATOM 932 N GLN 137 16.412 14.462 20.484 1.00 0.00 ATOM 933 CA GLN 137 17.598 14.440 19.629 1.00 0.00 ATOM 934 CB GLN 137 18.839 13.939 20.399 1.00 0.00 ATOM 935 CG GLN 137 20.157 14.128 19.642 1.00 0.00 ATOM 936 CD GLN 137 21.396 13.479 20.311 1.00 0.00 ATOM 937 OE1 GLN 137 22.392 13.210 19.632 1.00 0.00 ATOM 938 NE2 GLN 137 21.323 13.219 21.619 1.00 0.00 ATOM 939 O GLN 137 17.759 14.009 17.307 1.00 0.00 ATOM 940 C GLN 137 17.386 13.591 18.380 1.00 0.00 ATOM 941 N VAL 138 16.798 12.402 18.512 1.00 0.00 ATOM 942 CA VAL 138 16.587 11.556 17.339 1.00 0.00 ATOM 943 CB VAL 138 16.169 10.090 17.665 1.00 0.00 ATOM 944 CG1 VAL 138 17.240 9.388 18.423 1.00 0.00 ATOM 945 CG2 VAL 138 14.855 9.981 18.458 1.00 0.00 ATOM 946 O VAL 138 15.714 11.986 15.124 1.00 0.00 ATOM 947 C VAL 138 15.579 12.171 16.338 1.00 0.00 ATOM 948 N ILE 139 14.561 12.866 16.844 1.00 0.00 ATOM 949 CA ILE 139 13.555 13.483 15.987 1.00 0.00 ATOM 950 CB ILE 139 12.333 14.025 16.827 1.00 0.00 ATOM 951 CG1 ILE 139 11.491 12.878 17.403 1.00 0.00 ATOM 952 CG2 ILE 139 11.369 14.788 15.990 1.00 0.00 ATOM 953 O ILE 139 13.934 14.719 13.944 1.00 0.00 ATOM 954 C ILE 139 14.227 14.568 15.136 1.00 0.00 ATOM 955 N ASN 140 15.130 15.309 15.760 1.00 0.00 ATOM 956 CA ASN 140 15.882 16.374 15.104 1.00 0.00 ATOM 957 CB ASN 140 16.711 17.170 16.133 1.00 0.00 ATOM 958 CG ASN 140 15.876 18.078 17.003 1.00 0.00 ATOM 959 ND2 ASN 140 16.417 18.399 18.193 1.00 0.00 ATOM 960 OD1 ASN 140 14.777 18.528 16.612 1.00 0.00 ATOM 961 O ASN 140 17.010 16.389 13.025 1.00 0.00 ATOM 962 C ASN 140 16.878 15.853 14.097 1.00 0.00 ATOM 963 N GLU 141 17.596 14.806 14.465 1.00 0.00 ATOM 964 CA GLU 141 18.581 14.192 13.583 1.00 0.00 ATOM 965 CB GLU 141 19.325 13.046 14.284 1.00 0.00 ATOM 966 CG GLU 141 20.123 13.382 15.553 1.00 0.00 ATOM 967 CD GLU 141 21.528 13.919 15.302 1.00 0.00 ATOM 968 OE1 GLU 141 22.026 13.852 14.153 1.00 0.00 ATOM 969 OE2 GLU 141 22.141 14.395 16.284 1.00 0.00 ATOM 970 O GLU 141 18.600 13.309 11.366 1.00 0.00 ATOM 971 C GLU 141 17.911 13.594 12.350 1.00 0.00 ATOM 972 N LEU 142 16.588 13.399 12.407 1.00 0.00 ATOM 973 CA LEU 142 15.825 12.809 11.306 1.00 0.00 ATOM 974 CB LEU 142 14.433 12.369 11.758 1.00 0.00 ATOM 975 CG LEU 142 13.787 11.333 10.821 1.00 0.00 ATOM 976 CD1 LEU 142 14.688 10.101 10.663 1.00 0.00 ATOM 977 CD2 LEU 142 12.383 10.923 11.298 1.00 0.00 ATOM 978 O LEU 142 15.510 13.273 9.003 1.00 0.00 ATOM 979 C LEU 142 15.694 13.743 10.113 1.00 0.00 ATOM 980 N ASP 143 15.742 15.054 10.321 1.00 0.00 ATOM 981 CA ASP 143 15.757 15.973 9.168 1.00 0.00 ATOM 982 CB ASP 143 15.995 17.418 9.614 1.00 0.00 ATOM 983 CG ASP 143 14.725 18.149 9.980 1.00 0.00 ATOM 984 OD1 ASP 143 13.661 17.878 9.363 1.00 0.00 ATOM 985 OD2 ASP 143 14.826 19.044 10.851 1.00 0.00 ATOM 986 O ASP 143 16.712 15.525 7.002 1.00 0.00 ATOM 987 C ASP 143 16.893 15.613 8.221 1.00 0.00 ATOM 988 N ASP 144 18.074 15.420 8.801 1.00 0.00 ATOM 989 CA ASP 144 19.245 15.035 8.039 1.00 0.00 ATOM 990 CB ASP 144 20.414 14.759 8.981 1.00 0.00 ATOM 991 O ASP 144 19.285 13.764 6.005 1.00 0.00 ATOM 992 C ASP 144 18.959 13.797 7.185 1.00 0.00 ATOM 993 N LEU 145 18.309 12.798 7.767 1.00 0.00 ATOM 994 CA LEU 145 18.016 11.560 7.048 1.00 0.00 ATOM 995 CB LEU 145 17.570 10.476 8.027 1.00 0.00 ATOM 996 CG LEU 145 17.758 9.054 7.510 1.00 0.00 ATOM 997 CD1 LEU 145 19.228 8.768 7.226 1.00 0.00 ATOM 998 CD2 LEU 145 17.244 8.082 8.525 1.00 0.00 ATOM 999 O LEU 145 16.903 11.067 4.970 1.00 0.00 ATOM 1000 C LEU 145 16.952 11.793 5.967 1.00 0.00 ATOM 1001 N LEU 146 16.103 12.801 6.179 1.00 0.00 ATOM 1002 CA LEU 146 15.097 13.195 5.202 1.00 0.00 ATOM 1003 CB LEU 146 13.945 13.931 5.894 1.00 0.00 ATOM 1004 O LEU 146 15.190 14.192 3.003 1.00 0.00 ATOM 1005 C LEU 146 15.744 14.065 4.092 1.00 0.00 ATOM 1006 N GLU 147 16.914 14.648 4.371 1.00 0.00 ATOM 1007 CA GLU 147 17.659 15.460 3.391 1.00 0.00 ATOM 1008 CB GLU 147 18.028 16.825 3.997 1.00 0.00 ATOM 1009 O GLU 147 18.888 13.796 2.123 1.00 0.00 ATOM 1010 C GLU 147 18.937 14.746 2.913 1.00 0.00 ATOM 1011 N ARG 151 19.803 6.476 1.207 1.00 0.00 ATOM 1012 CA ARG 151 19.764 5.046 0.920 1.00 0.00 ATOM 1013 O ARG 151 19.354 4.003 3.058 1.00 0.00 ATOM 1014 C ARG 151 20.163 4.216 2.151 1.00 0.00 ATOM 1015 N GLY 152 21.419 3.781 2.207 1.00 0.00 ATOM 1016 CA GLY 152 21.890 2.932 3.309 1.00 0.00 ATOM 1017 O GLY 152 22.031 2.848 5.706 1.00 0.00 ATOM 1018 C GLY 152 21.977 3.565 4.687 1.00 0.00 ATOM 1019 N ARG 153 21.960 4.895 4.739 1.00 0.00 ATOM 1020 CA ARG 153 22.118 5.626 6.010 1.00 0.00 ATOM 1021 CB ARG 153 22.087 7.143 5.735 1.00 0.00 ATOM 1022 CG ARG 153 23.312 7.664 4.960 1.00 0.00 ATOM 1023 CD ARG 153 23.293 9.191 4.817 1.00 0.00 ATOM 1024 O ARG 153 21.516 5.408 8.330 1.00 0.00 ATOM 1025 C ARG 153 21.153 5.261 7.168 1.00 0.00 ATOM 1026 N GLU 154 19.959 4.772 6.847 1.00 0.00 ATOM 1027 CA GLU 154 18.951 4.419 7.858 1.00 0.00 ATOM 1028 CB GLU 154 17.622 4.017 7.180 1.00 0.00 ATOM 1029 CG GLU 154 17.703 2.905 6.100 1.00 0.00 ATOM 1030 CD GLU 154 16.341 2.244 5.832 1.00 0.00 ATOM 1031 O GLU 154 19.069 3.482 10.077 1.00 0.00 ATOM 1032 C GLU 154 19.394 3.366 8.893 1.00 0.00 ATOM 1033 N VAL 155 20.162 2.371 8.460 1.00 0.00 ATOM 1034 CA VAL 155 20.672 1.338 9.360 1.00 0.00 ATOM 1035 CB VAL 155 21.299 0.180 8.554 1.00 0.00 ATOM 1036 CG1 VAL 155 21.996 -0.828 9.461 1.00 0.00 ATOM 1037 CG2 VAL 155 20.207 -0.523 7.747 1.00 0.00 ATOM 1038 O VAL 155 21.619 1.596 11.571 1.00 0.00 ATOM 1039 C VAL 155 21.667 1.923 10.377 1.00 0.00 ATOM 1040 N ASP 156 22.569 2.786 9.902 1.00 0.00 ATOM 1041 CA ASP 156 23.538 3.431 10.783 1.00 0.00 ATOM 1042 CB ASP 156 24.537 4.280 9.983 1.00 0.00 ATOM 1043 CG ASP 156 25.663 4.859 10.868 1.00 0.00 ATOM 1044 O ASP 156 23.179 4.321 12.975 1.00 0.00 ATOM 1045 C ASP 156 22.809 4.303 11.816 1.00 0.00 ATOM 1046 N PHE 157 21.773 5.012 11.376 1.00 0.00 ATOM 1047 CA PHE 157 20.946 5.857 12.240 1.00 0.00 ATOM 1048 CB PHE 157 19.837 6.499 11.387 1.00 0.00 ATOM 1049 CG PHE 157 18.958 7.463 12.132 1.00 0.00 ATOM 1050 CD1 PHE 157 17.851 7.025 12.801 1.00 0.00 ATOM 1051 CD2 PHE 157 19.240 8.812 12.138 1.00 0.00 ATOM 1052 CE1 PHE 157 17.050 7.897 13.481 1.00 0.00 ATOM 1053 CE2 PHE 157 18.440 9.699 12.814 1.00 0.00 ATOM 1054 CZ PHE 157 17.341 9.231 13.489 1.00 0.00 ATOM 1055 O PHE 157 20.382 5.466 14.567 1.00 0.00 ATOM 1056 C PHE 157 20.317 5.059 13.403 1.00 0.00 ATOM 1057 N VAL 158 19.693 3.935 13.063 1.00 0.00 ATOM 1058 CA VAL 158 19.077 3.063 14.039 1.00 0.00 ATOM 1059 CB VAL 158 18.212 1.975 13.347 1.00 0.00 ATOM 1060 CG1 VAL 158 17.787 0.883 14.344 1.00 0.00 ATOM 1061 CG2 VAL 158 17.027 2.638 12.698 1.00 0.00 ATOM 1062 O VAL 158 19.914 2.325 16.139 1.00 0.00 ATOM 1063 C VAL 158 20.124 2.442 14.924 1.00 0.00 ATOM 1064 N ALA 159 21.248 2.010 14.347 1.00 0.00 ATOM 1065 CA ALA 159 22.332 1.456 15.174 1.00 0.00 ATOM 1066 CB ALA 159 23.509 1.111 14.309 1.00 0.00 ATOM 1067 O ALA 159 23.003 2.049 17.401 1.00 0.00 ATOM 1068 C ALA 159 22.770 2.443 16.266 1.00 0.00 ATOM 1069 N LYS 160 22.918 3.712 15.889 1.00 0.00 ATOM 1070 CA LYS 160 23.369 4.772 16.798 1.00 0.00 ATOM 1071 CB LYS 160 23.609 6.100 16.040 1.00 0.00 ATOM 1072 CG LYS 160 24.850 6.115 15.094 1.00 0.00 ATOM 1073 CD LYS 160 24.967 7.450 14.297 1.00 0.00 ATOM 1074 CE LYS 160 26.147 7.463 13.269 1.00 0.00 ATOM 1075 O LYS 160 22.671 5.113 19.067 1.00 0.00 ATOM 1076 C LYS 160 22.348 5.001 17.885 1.00 0.00 ATOM 1077 N MET 161 21.096 5.069 17.471 1.00 0.00 ATOM 1078 CA MET 161 19.975 5.256 18.401 1.00 0.00 ATOM 1079 CB MET 161 18.669 5.259 17.621 1.00 0.00 ATOM 1080 CG MET 161 17.478 5.686 18.409 1.00 0.00 ATOM 1081 SD MET 161 15.855 5.727 17.270 1.00 0.00 ATOM 1082 CE MET 161 15.369 3.749 17.375 1.00 0.00 ATOM 1083 O MET 161 19.808 4.408 20.631 1.00 0.00 ATOM 1084 C MET 161 19.951 4.148 19.452 1.00 0.00 ATOM 1085 N ILE 162 20.091 2.911 19.007 1.00 0.00 ATOM 1086 CA ILE 162 20.166 1.766 19.894 1.00 0.00 ATOM 1087 CB ILE 162 20.330 0.451 19.088 1.00 0.00 ATOM 1088 CG1 ILE 162 19.047 0.118 18.320 1.00 0.00 ATOM 1089 CG2 ILE 162 20.626 -0.716 20.024 1.00 0.00 ATOM 1090 CD1 ILE 162 19.180 -1.172 17.468 1.00 0.00 ATOM 1091 O ILE 162 21.187 1.721 22.048 1.00 0.00 ATOM 1092 C ILE 162 21.343 1.909 20.858 1.00 0.00 ATOM 1093 N ASN 163 22.514 2.271 20.351 1.00 0.00 ATOM 1094 CA ASN 163 23.688 2.408 21.218 1.00 0.00 ATOM 1095 CB ASN 163 24.954 2.693 20.394 1.00 0.00 ATOM 1096 CG ASN 163 25.348 1.519 19.482 1.00 0.00 ATOM 1097 ND2 ASN 163 25.937 1.823 18.327 1.00 0.00 ATOM 1098 OD1 ASN 163 25.099 0.372 19.803 1.00 0.00 ATOM 1099 O ASN 163 23.854 3.324 23.423 1.00 0.00 ATOM 1100 C ASN 163 23.487 3.498 22.279 1.00 0.00 ATOM 1101 N GLU 164 22.920 4.625 21.872 1.00 0.00 ATOM 1102 CA GLU 164 22.677 5.750 22.768 1.00 0.00 ATOM 1103 CB GLU 164 22.144 6.945 21.961 1.00 0.00 ATOM 1104 CG GLU 164 23.160 7.684 21.106 1.00 0.00 ATOM 1105 CD GLU 164 23.889 8.771 21.851 1.00 0.00 ATOM 1106 O GLU 164 21.874 5.713 25.057 1.00 0.00 ATOM 1107 C GLU 164 21.673 5.386 23.877 1.00 0.00 ATOM 1108 N LEU 165 20.622 4.684 23.498 1.00 0.00 ATOM 1109 CA LEU 165 19.635 4.236 24.465 1.00 0.00 ATOM 1110 CB LEU 165 18.401 3.685 23.743 1.00 0.00 ATOM 1111 CG LEU 165 17.242 3.254 24.657 1.00 0.00 ATOM 1112 CD1 LEU 165 16.717 4.390 25.574 1.00 0.00 ATOM 1113 CD2 LEU 165 16.101 2.656 23.842 1.00 0.00 ATOM 1114 O LEU 165 19.880 3.220 26.634 1.00 0.00 ATOM 1115 C LEU 165 20.192 3.187 25.437 1.00 0.00 ATOM 1116 N ASP 166 20.995 2.253 24.936 1.00 0.00 ATOM 1117 CA ASP 166 21.592 1.237 25.810 1.00 0.00 ATOM 1118 CB ASP 166 22.465 0.247 25.017 1.00 0.00 ATOM 1119 CG ASP 166 21.646 -0.694 24.125 1.00 0.00 ATOM 1120 OD1 ASP 166 20.368 -0.680 24.167 1.00 0.00 ATOM 1121 OD2 ASP 166 22.306 -1.441 23.359 1.00 0.00 ATOM 1122 O ASP 166 22.465 1.360 28.043 1.00 0.00 ATOM 1123 C ASP 166 22.430 1.873 26.920 1.00 0.00 ATOM 1124 N ILE 167 23.142 2.948 26.593 1.00 0.00 ATOM 1125 CA ILE 167 23.900 3.661 27.593 1.00 0.00 ATOM 1126 CB ILE 167 24.726 4.744 26.965 1.00 0.00 ATOM 1127 CG1 ILE 167 25.926 4.090 26.255 1.00 0.00 ATOM 1128 CG2 ILE 167 25.192 5.713 28.044 1.00 0.00 ATOM 1129 CD1 ILE 167 26.740 5.016 25.402 1.00 0.00 ATOM 1130 O ILE 167 23.237 4.108 29.853 1.00 0.00 ATOM 1131 C ILE 167 22.991 4.263 28.651 1.00 0.00 ATOM 1132 N ILE 168 21.936 4.943 28.228 1.00 0.00 ATOM 1133 CA ILE 168 21.021 5.555 29.178 1.00 0.00 ATOM 1134 CB ILE 168 20.024 6.477 28.478 1.00 0.00 ATOM 1135 CG1 ILE 168 20.775 7.662 27.881 1.00 0.00 ATOM 1136 CG2 ILE 168 18.965 6.975 29.458 1.00 0.00 ATOM 1137 CD1 ILE 168 19.931 8.535 27.061 1.00 0.00 ATOM 1138 O ILE 168 20.100 4.722 31.214 1.00 0.00 ATOM 1139 C ILE 168 20.277 4.511 30.011 1.00 0.00 ATOM 1140 N GLU 169 19.840 3.414 29.384 1.00 0.00 ATOM 1141 CA GLU 169 19.103 2.357 30.100 1.00 0.00 ATOM 1142 CB GLU 169 18.513 1.322 29.154 1.00 0.00 ATOM 1143 CG GLU 169 17.280 1.845 28.446 1.00 0.00 ATOM 1144 CD GLU 169 16.611 0.826 27.491 1.00 0.00 ATOM 1145 OE1 GLU 169 17.300 -0.105 27.008 1.00 0.00 ATOM 1146 OE2 GLU 169 15.391 0.997 27.211 1.00 0.00 ATOM 1147 O GLU 169 19.453 1.266 32.188 1.00 0.00 ATOM 1148 C GLU 169 19.948 1.650 31.145 1.00 0.00 ATOM 1149 N GLU 170 21.237 1.516 30.876 1.00 0.00 ATOM 1150 CA GLU 170 22.122 0.877 31.814 1.00 0.00 ATOM 1151 CB GLU 170 23.501 0.683 31.154 1.00 0.00 ATOM 1152 CG GLU 170 24.497 -0.199 31.917 1.00 0.00 ATOM 1153 CD GLU 170 25.867 -0.318 31.201 1.00 0.00 ATOM 1154 O GLU 170 22.075 1.244 34.175 1.00 0.00 ATOM 1155 C GLU 170 22.186 1.758 33.071 1.00 0.00 ATOM 1156 N ASP 171 22.354 3.072 32.877 1.00 0.00 ATOM 1157 CA ASP 171 22.435 4.020 33.972 1.00 0.00 ATOM 1158 CB ASP 171 22.786 5.410 33.438 1.00 0.00 ATOM 1159 CG ASP 171 24.233 5.515 32.968 1.00 0.00 ATOM 1160 OD1 ASP 171 24.974 4.503 33.036 1.00 0.00 ATOM 1161 OD2 ASP 171 24.642 6.617 32.530 1.00 0.00 ATOM 1162 O ASP 171 21.163 4.014 35.949 1.00 0.00 ATOM 1163 C ASP 171 21.132 4.094 34.751 1.00 0.00 ATOM 1164 N THR 172 20.001 4.247 34.065 1.00 0.00 ATOM 1165 CA THR 172 18.716 4.353 34.753 1.00 0.00 ATOM 1166 CB THR 172 17.527 4.677 33.825 1.00 0.00 ATOM 1167 CG2 THR 172 17.730 5.977 33.132 1.00 0.00 ATOM 1168 OG1 THR 172 17.384 3.643 32.847 1.00 0.00 ATOM 1169 O THR 172 17.845 3.181 36.604 1.00 0.00 ATOM 1170 C THR 172 18.376 3.103 35.519 1.00 0.00 ATOM 1171 N ASP 173 18.700 1.941 34.978 1.00 0.00 ATOM 1172 CA ASP 173 18.442 0.699 35.710 1.00 0.00 ATOM 1173 CB ASP 173 18.795 -0.530 34.880 1.00 0.00 ATOM 1174 CG ASP 173 17.901 -0.672 33.642 1.00 0.00 ATOM 1175 OD1 ASP 173 16.847 0.042 33.575 1.00 0.00 ATOM 1176 OD2 ASP 173 18.274 -1.469 32.732 1.00 0.00 ATOM 1177 O ASP 173 18.678 0.292 38.038 1.00 0.00 ATOM 1178 C ASP 173 19.225 0.642 37.003 1.00 0.00 ATOM 1179 N ASP 174 20.516 0.955 36.932 1.00 0.00 ATOM 1180 CA ASP 174 21.342 0.942 38.121 1.00 0.00 ATOM 1181 CB ASP 174 22.819 1.257 37.789 1.00 0.00 ATOM 1182 CG ASP 174 23.454 0.212 36.837 1.00 0.00 ATOM 1183 OD1 ASP 174 22.740 -0.747 36.438 1.00 0.00 ATOM 1184 OD2 ASP 174 24.663 0.340 36.476 1.00 0.00 ATOM 1185 O ASP 174 20.719 1.633 40.314 1.00 0.00 ATOM 1186 C ASP 174 20.806 1.944 39.150 1.00 0.00 ATOM 1187 N LEU 175 20.471 3.149 38.722 1.00 0.00 ATOM 1188 CA LEU 175 20.000 4.165 39.651 1.00 0.00 ATOM 1189 CB LEU 175 19.908 5.522 38.949 1.00 0.00 ATOM 1190 CG LEU 175 21.219 6.133 38.459 1.00 0.00 ATOM 1191 CD1 LEU 175 20.918 7.407 37.690 1.00 0.00 ATOM 1192 CD2 LEU 175 22.152 6.432 39.598 1.00 0.00 ATOM 1193 O LEU 175 18.460 4.038 41.457 1.00 0.00 ATOM 1194 C LEU 175 18.671 3.794 40.285 1.00 0.00 ATOM 1195 N GLN 176 17.800 3.161 39.516 1.00 0.00 ATOM 1196 CA GLN 176 16.487 2.750 40.000 1.00 0.00 ATOM 1197 CB GLN 176 15.670 2.158 38.852 1.00 0.00 ATOM 1198 CG GLN 176 14.196 2.033 39.179 1.00 0.00 ATOM 1199 CD GLN 176 13.375 1.597 37.970 1.00 0.00 ATOM 1200 OE1 GLN 176 12.423 2.286 37.570 1.00 0.00 ATOM 1201 NE2 GLN 176 13.785 0.511 37.343 1.00 0.00 ATOM 1202 O GLN 176 15.944 1.758 42.111 1.00 0.00 ATOM 1203 C GLN 176 16.627 1.709 41.088 1.00 0.00 ATOM 1204 N ILE 177 17.565 0.781 40.881 1.00 0.00 ATOM 1205 CA ILE 177 17.822 -0.262 41.854 1.00 0.00 ATOM 1206 CB ILE 177 18.755 -1.324 41.285 1.00 0.00 ATOM 1207 CG1 ILE 177 18.012 -2.091 40.187 1.00 0.00 ATOM 1208 CG2 ILE 177 19.224 -2.272 42.410 1.00 0.00 ATOM 1209 CD1 ILE 177 18.914 -3.071 39.372 1.00 0.00 ATOM 1210 O ILE 177 17.869 -0.060 44.238 1.00 0.00 ATOM 1211 C ILE 177 18.361 0.310 43.162 1.00 0.00 ATOM 1212 N GLN 178 19.370 1.177 43.070 1.00 0.00 ATOM 1213 CA GLN 178 19.934 1.825 44.247 1.00 0.00 ATOM 1214 CB GLN 178 21.072 2.761 43.860 1.00 0.00 ATOM 1215 CG GLN 178 22.346 2.082 43.319 1.00 0.00 ATOM 1216 O GLN 178 18.717 2.508 46.182 1.00 0.00 ATOM 1217 C GLN 178 18.860 2.613 44.988 1.00 0.00 ATOM 1218 N LEU 179 18.039 3.336 44.253 1.00 0.00 ATOM 1219 CA LEU 179 16.992 4.125 44.865 1.00 0.00 ATOM 1220 CB LEU 179 16.347 4.955 43.770 1.00 0.00 ATOM 1221 CG LEU 179 15.311 5.988 44.121 1.00 0.00 ATOM 1222 CD1 LEU 179 15.912 7.024 45.071 1.00 0.00 ATOM 1223 CD2 LEU 179 14.891 6.611 42.795 1.00 0.00 ATOM 1224 O LEU 179 15.598 3.548 46.753 1.00 0.00 ATOM 1225 C LEU 179 15.971 3.238 45.629 1.00 0.00 ATOM 1226 N ARG 180 15.540 2.138 45.028 1.00 0.00 ATOM 1227 CA ARG 180 14.628 1.195 45.707 1.00 0.00 ATOM 1228 CB ARG 180 14.119 0.154 44.737 1.00 0.00 ATOM 1229 CG ARG 180 13.182 0.754 43.745 1.00 0.00 ATOM 1230 CD ARG 180 12.564 -0.295 42.802 1.00 0.00 ATOM 1231 NE ARG 180 11.589 0.404 41.982 1.00 0.00 ATOM 1232 CZ ARG 180 11.393 0.185 40.682 1.00 0.00 ATOM 1233 NH1 ARG 180 12.125 -0.714 40.027 1.00 0.00 ATOM 1234 NH2 ARG 180 10.482 0.904 40.021 1.00 0.00 ATOM 1235 O ARG 180 14.572 0.158 47.845 1.00 0.00 ATOM 1236 C ARG 180 15.256 0.486 46.890 1.00 0.00 ATOM 1237 N ARG 181 16.545 0.196 46.787 1.00 0.00 ATOM 1238 CA ARG 181 17.292 -0.446 47.866 1.00 0.00 ATOM 1239 CB ARG 181 18.730 -0.712 47.395 1.00 0.00 ATOM 1240 CG ARG 181 19.651 -1.478 48.369 1.00 0.00 ATOM 1241 CD ARG 181 21.010 -1.871 47.672 1.00 0.00 ATOM 1242 NE ARG 181 20.830 -2.524 46.354 1.00 0.00 ATOM 1243 CZ ARG 181 21.809 -2.781 45.480 1.00 0.00 ATOM 1244 O ARG 181 17.063 0.115 50.206 1.00 0.00 ATOM 1245 C ARG 181 17.274 0.519 49.074 1.00 0.00 ATOM 1246 N GLN 182 17.496 1.797 48.819 1.00 0.00 ATOM 1247 CA GLN 182 17.464 2.772 49.887 1.00 0.00 ATOM 1248 CB GLN 182 17.911 4.148 49.396 1.00 0.00 ATOM 1249 CG GLN 182 19.410 4.256 49.215 1.00 0.00 ATOM 1250 CD GLN 182 19.851 5.598 48.667 1.00 0.00 ATOM 1251 OE1 GLN 182 19.128 6.238 47.895 1.00 0.00 ATOM 1252 NE2 GLN 182 21.054 6.012 49.028 1.00 0.00 ATOM 1253 O GLN 182 15.989 3.136 51.690 1.00 0.00 ATOM 1254 C GLN 182 16.105 2.934 50.494 1.00 0.00 ATOM 1255 N LEU 183 15.074 2.916 49.660 1.00 0.00 ATOM 1256 CA LEU 183 13.720 3.046 50.181 1.00 0.00 ATOM 1257 CB LEU 183 12.711 3.241 49.027 1.00 0.00 ATOM 1258 CG LEU 183 11.233 3.462 49.373 1.00 0.00 ATOM 1259 CD1 LEU 183 11.023 4.448 50.495 1.00 0.00 ATOM 1260 CD2 LEU 183 10.467 3.867 48.197 1.00 0.00 ATOM 1261 O LEU 183 12.883 1.981 52.112 1.00 0.00 ATOM 1262 C LEU 183 13.405 1.839 51.036 1.00 0.00 ATOM 1263 N PHE 184 13.779 0.653 50.575 1.00 0.00 ATOM 1264 CA PHE 184 13.543 -0.589 51.301 1.00 0.00 ATOM 1265 CB PHE 184 14.139 -1.747 50.526 1.00 0.00 ATOM 1266 CG PHE 184 13.837 -3.077 51.112 1.00 0.00 ATOM 1267 CD1 PHE 184 12.542 -3.510 51.233 1.00 0.00 ATOM 1268 CD2 PHE 184 14.854 -3.918 51.520 1.00 0.00 ATOM 1269 CE1 PHE 184 12.254 -4.756 51.777 1.00 0.00 ATOM 1270 CE2 PHE 184 14.570 -5.163 52.056 1.00 0.00 ATOM 1271 CZ PHE 184 13.262 -5.580 52.191 1.00 0.00 ATOM 1272 O PHE 184 13.420 -0.915 53.709 1.00 0.00 ATOM 1273 C PHE 184 14.094 -0.511 52.738 1.00 0.00 ATOM 1274 N ALA 185 15.292 0.060 52.879 1.00 0.00 ATOM 1275 CA ALA 185 15.919 0.239 54.192 1.00 0.00 ATOM 1276 CB ALA 185 17.346 0.740 54.016 1.00 0.00 ATOM 1277 O ALA 185 15.268 1.118 56.306 1.00 0.00 ATOM 1278 C ALA 185 15.175 1.213 55.090 1.00 0.00 ATOM 1279 N LEU 186 14.461 2.167 54.505 1.00 0.00 ATOM 1280 CA LEU 186 13.720 3.177 55.279 1.00 0.00 ATOM 1281 CB LEU 186 13.666 4.529 54.530 1.00 0.00 ATOM 1282 CG LEU 186 14.867 5.397 54.280 1.00 0.00 ATOM 1283 CD1 LEU 186 14.455 6.679 53.568 1.00 0.00 ATOM 1284 CD2 LEU 186 15.561 5.725 55.614 1.00 0.00 ATOM 1285 O LEU 186 11.606 3.543 56.282 1.00 0.00 ATOM 1286 C LEU 186 12.258 2.826 55.534 1.00 0.00 ATOM 1287 N GLU 187 11.733 1.764 54.941 1.00 0.00 ATOM 1288 CA GLU 187 10.300 1.463 55.089 1.00 0.00 ATOM 1289 CB GLU 187 9.918 0.196 54.342 1.00 0.00 ATOM 1290 CG GLU 187 10.111 0.334 52.819 1.00 0.00 ATOM 1291 CD GLU 187 9.745 -0.937 52.084 1.00 0.00 ATOM 1292 OE1 GLU 187 9.181 -1.848 52.749 1.00 0.00 ATOM 1293 OE2 GLU 187 10.018 -1.024 50.849 1.00 0.00 ATOM 1294 O GLU 187 8.746 1.888 56.850 1.00 0.00 ATOM 1295 C GLU 187 9.838 1.390 56.544 1.00 0.00 ATOM 1296 N SER 188 10.649 0.779 57.416 1.00 0.00 ATOM 1297 CA SER 188 10.303 0.615 58.835 1.00 0.00 ATOM 1298 CB SER 188 11.459 -0.088 59.575 1.00 0.00 ATOM 1299 OG SER 188 12.657 0.697 59.445 1.00 0.00 ATOM 1300 O SER 188 9.478 1.992 60.607 1.00 0.00 ATOM 1301 C SER 188 10.072 1.942 59.549 1.00 0.00 ATOM 1302 N GLU 189 10.562 3.024 58.989 1.00 0.00 ATOM 1303 CA GLU 189 10.413 4.304 59.653 1.00 0.00 ATOM 1304 CB GLU 189 11.789 4.964 59.864 1.00 0.00 ATOM 1305 CG GLU 189 12.549 5.438 58.713 1.00 0.00 ATOM 1306 CD GLU 189 13.998 5.784 59.124 1.00 0.00 ATOM 1307 OE1 GLU 189 14.656 4.912 59.752 1.00 0.00 ATOM 1308 OE2 GLU 189 14.475 6.908 58.802 1.00 0.00 ATOM 1309 O GLU 189 9.140 6.344 59.509 1.00 0.00 ATOM 1310 C GLU 189 9.384 5.246 59.026 1.00 0.00 ATOM 1311 N LEU 190 8.706 4.770 57.999 1.00 0.00 ATOM 1312 CA LEU 190 7.756 5.597 57.310 1.00 0.00 ATOM 1313 CB LEU 190 8.188 5.756 55.839 1.00 0.00 ATOM 1314 CG LEU 190 9.571 6.333 55.509 1.00 0.00 ATOM 1315 CD1 LEU 190 9.764 6.268 53.984 1.00 0.00 ATOM 1316 CD2 LEU 190 9.748 7.786 55.985 1.00 0.00 ATOM 1317 O LEU 190 6.155 3.874 57.775 1.00 0.00 ATOM 1318 C LEU 190 6.345 5.020 57.411 1.00 0.00 ATOM 1319 N ASN 191 5.358 5.847 57.107 1.00 0.00 ATOM 1320 CA ASN 191 3.955 5.380 57.013 1.00 0.00 ATOM 1321 CB ASN 191 2.998 6.575 57.041 1.00 0.00 ATOM 1322 CG ASN 191 1.518 6.136 57.016 1.00 0.00 ATOM 1323 ND2 ASN 191 0.930 6.028 58.179 1.00 0.00 ATOM 1324 OD1 ASN 191 0.934 5.934 55.977 1.00 0.00 ATOM 1325 O ASN 191 4.276 4.940 54.672 1.00 0.00 ATOM 1326 C ASN 191 3.773 4.554 55.736 1.00 0.00 ATOM 1327 N PRO 192 3.076 3.397 55.830 1.00 0.00 ATOM 1328 CA PRO 192 2.989 2.538 54.645 1.00 0.00 ATOM 1329 CB PRO 192 2.075 1.381 55.109 1.00 0.00 ATOM 1330 CG PRO 192 1.499 1.829 56.397 1.00 0.00 ATOM 1331 CD PRO 192 2.433 2.773 56.999 1.00 0.00 ATOM 1332 O PRO 192 2.851 2.791 52.293 1.00 0.00 ATOM 1333 C PRO 192 2.431 3.150 53.385 1.00 0.00 ATOM 1334 N VAL 193 1.418 3.998 53.533 1.00 0.00 ATOM 1335 CA VAL 193 0.804 4.640 52.389 1.00 0.00 ATOM 1336 CB VAL 193 -0.519 5.360 52.826 1.00 0.00 ATOM 1337 CG1 VAL 193 -1.112 6.169 51.705 1.00 0.00 ATOM 1338 CG2 VAL 193 -1.560 4.320 53.303 1.00 0.00 ATOM 1339 O VAL 193 1.967 5.566 50.472 1.00 0.00 ATOM 1340 C VAL 193 1.843 5.547 51.719 1.00 0.00 ATOM 1341 N ASP 194 2.600 6.282 52.525 1.00 0.00 ATOM 1342 CA ASP 194 3.696 7.122 51.999 1.00 0.00 ATOM 1343 CB ASP 194 4.338 7.947 53.108 1.00 0.00 ATOM 1344 CG ASP 194 3.397 9.020 53.669 1.00 0.00 ATOM 1345 OD1 ASP 194 2.343 9.259 53.041 1.00 0.00 ATOM 1346 OD2 ASP 194 3.727 9.652 54.721 1.00 0.00 ATOM 1347 O ASP 194 5.316 6.712 50.268 1.00 0.00 ATOM 1348 C ASP 194 4.780 6.283 51.285 1.00 0.00 ATOM 1349 N VAL 195 5.101 5.100 51.819 1.00 0.00 ATOM 1350 CA VAL 195 6.063 4.208 51.209 1.00 0.00 ATOM 1351 CB VAL 195 6.308 2.911 52.048 1.00 0.00 ATOM 1352 CG1 VAL 195 7.153 1.878 51.270 1.00 0.00 ATOM 1353 CG2 VAL 195 7.042 3.222 53.349 1.00 0.00 ATOM 1354 O VAL 195 6.287 3.897 48.861 1.00 0.00 ATOM 1355 C VAL 195 5.555 3.817 49.827 1.00 0.00 ATOM 1356 N MET 196 4.294 3.402 49.739 1.00 0.00 ATOM 1357 CA MET 196 3.699 3.017 48.472 1.00 0.00 ATOM 1358 CB MET 196 2.256 2.509 48.693 1.00 0.00 ATOM 1359 CG MET 196 2.158 1.258 49.578 1.00 0.00 ATOM 1360 SD MET 196 3.396 -0.191 48.962 1.00 0.00 ATOM 1361 CE MET 196 4.926 0.329 49.781 1.00 0.00 ATOM 1362 O MET 196 3.988 4.040 46.331 1.00 0.00 ATOM 1363 C MET 196 3.702 4.207 47.485 1.00 0.00 ATOM 1364 N PHE 197 3.370 5.401 47.940 1.00 0.00 ATOM 1365 CA PHE 197 3.383 6.527 47.013 1.00 0.00 ATOM 1366 CB PHE 197 2.536 7.702 47.513 1.00 0.00 ATOM 1367 CG PHE 197 1.084 7.548 47.174 1.00 0.00 ATOM 1368 CD1 PHE 197 0.630 7.845 45.892 1.00 0.00 ATOM 1369 CD2 PHE 197 0.174 7.044 48.098 1.00 0.00 ATOM 1370 CE1 PHE 197 -0.714 7.654 45.565 1.00 0.00 ATOM 1371 CE2 PHE 197 -1.131 6.861 47.786 1.00 0.00 ATOM 1372 CZ PHE 197 -1.582 7.153 46.511 1.00 0.00 ATOM 1373 O PHE 197 4.950 7.591 45.534 1.00 0.00 ATOM 1374 C PHE 197 4.787 6.930 46.570 1.00 0.00 ATOM 1375 N LEU 198 5.790 6.582 47.358 1.00 0.00 ATOM 1376 CA LEU 198 7.191 6.785 46.940 1.00 0.00 ATOM 1377 CB LEU 198 8.108 6.733 48.108 1.00 0.00 ATOM 1378 CG LEU 198 8.061 7.955 49.032 1.00 0.00 ATOM 1379 CD1 LEU 198 8.708 7.661 50.375 1.00 0.00 ATOM 1380 CD2 LEU 198 8.729 9.128 48.422 1.00 0.00 ATOM 1381 O LEU 198 8.215 6.138 44.882 1.00 0.00 ATOM 1382 C LEU 198 7.573 5.769 45.861 1.00 0.00 ATOM 1383 N TYR 199 7.205 4.492 46.042 1.00 0.00 ATOM 1384 CA TYR 199 7.409 3.531 44.974 1.00 0.00 ATOM 1385 CB TYR 199 6.970 2.110 45.386 1.00 0.00 ATOM 1386 CG TYR 199 8.000 1.451 46.267 1.00 0.00 ATOM 1387 CD1 TYR 199 9.218 1.072 45.742 1.00 0.00 ATOM 1388 CD2 TYR 199 7.767 1.223 47.629 1.00 0.00 ATOM 1389 CE1 TYR 199 10.208 0.469 46.550 1.00 0.00 ATOM 1390 CE2 TYR 199 8.718 0.604 48.412 1.00 0.00 ATOM 1391 CZ TYR 199 9.941 0.235 47.858 1.00 0.00 ATOM 1392 OH TYR 199 10.900 -0.348 48.631 1.00 0.00 ATOM 1393 O TYR 199 7.222 3.789 42.652 1.00 0.00 ATOM 1394 C TYR 199 6.678 3.939 43.723 1.00 0.00 ATOM 1395 N LYS 200 5.424 4.377 43.825 1.00 0.00 ATOM 1396 CA LYS 200 4.667 4.828 42.626 1.00 0.00 ATOM 1397 CB LYS 200 3.229 5.267 42.945 1.00 0.00 ATOM 1398 CG LYS 200 2.185 4.139 42.944 1.00 0.00 ATOM 1399 CD LYS 200 0.895 4.525 43.732 1.00 0.00 ATOM 1400 O LYS 200 5.372 6.050 40.717 1.00 0.00 ATOM 1401 C LYS 200 5.354 5.988 41.926 1.00 0.00 ATOM 1402 N THR 201 5.925 6.910 42.679 1.00 0.00 ATOM 1403 CA THR 201 6.620 8.060 42.079 1.00 0.00 ATOM 1404 CB THR 201 6.959 9.113 43.145 1.00 0.00 ATOM 1405 CG2 THR 201 7.677 10.320 42.556 1.00 0.00 ATOM 1406 OG1 THR 201 5.750 9.584 43.735 1.00 0.00 ATOM 1407 O THR 201 8.154 8.035 40.235 1.00 0.00 ATOM 1408 C THR 201 7.884 7.594 41.328 1.00 0.00 ATOM 1409 N ILE 202 8.639 6.661 41.892 1.00 0.00 ATOM 1410 CA ILE 202 9.808 6.135 41.202 1.00 0.00 ATOM 1411 CB ILE 202 10.518 5.165 42.106 1.00 0.00 ATOM 1412 CG1 ILE 202 11.079 5.946 43.294 1.00 0.00 ATOM 1413 CG2 ILE 202 11.630 4.402 41.372 1.00 0.00 ATOM 1414 CD1 ILE 202 11.612 5.093 44.383 1.00 0.00 ATOM 1415 O ILE 202 9.964 5.671 38.873 1.00 0.00 ATOM 1416 C ILE 202 9.358 5.470 39.895 1.00 0.00 ATOM 1417 N GLU 203 8.278 4.693 39.956 1.00 0.00 ATOM 1418 CA GLU 203 7.721 4.031 38.808 1.00 0.00 ATOM 1419 CB GLU 203 6.498 3.204 39.240 1.00 0.00 ATOM 1420 CG GLU 203 5.779 2.471 38.115 1.00 0.00 ATOM 1421 CD GLU 203 4.323 2.006 38.460 1.00 0.00 ATOM 1422 OE1 GLU 203 3.857 2.107 39.623 1.00 0.00 ATOM 1423 OE2 GLU 203 3.633 1.540 37.529 1.00 0.00 ATOM 1424 O GLU 203 7.634 4.825 36.564 1.00 0.00 ATOM 1425 C GLU 203 7.305 5.014 37.732 1.00 0.00 ATOM 1426 N TRP 204 6.542 6.040 38.117 1.00 0.00 ATOM 1427 CA TRP 204 6.094 7.053 37.199 1.00 0.00 ATOM 1428 CB TRP 204 5.214 8.107 37.853 1.00 0.00 ATOM 1429 CG TRP 204 3.879 7.635 38.314 1.00 0.00 ATOM 1430 CD1 TRP 204 3.099 6.643 37.755 1.00 0.00 ATOM 1431 CD2 TRP 204 3.129 8.155 39.422 1.00 0.00 ATOM 1432 CE2 TRP 204 1.916 7.435 39.482 1.00 0.00 ATOM 1433 CE3 TRP 204 3.361 9.171 40.364 1.00 0.00 ATOM 1434 NE1 TRP 204 1.928 6.516 38.463 1.00 0.00 ATOM 1435 CZ2 TRP 204 0.940 7.699 40.445 1.00 0.00 ATOM 1436 CZ3 TRP 204 2.395 9.423 41.330 1.00 0.00 ATOM 1437 CH2 TRP 204 1.193 8.684 41.357 1.00 0.00 ATOM 1438 O TRP 204 7.178 8.011 35.327 1.00 0.00 ATOM 1439 C TRP 204 7.242 7.772 36.515 1.00 0.00 ATOM 1440 N VAL 205 8.288 8.101 37.254 1.00 0.00 ATOM 1441 CA VAL 205 9.429 8.748 36.665 1.00 0.00 ATOM 1442 CB VAL 205 10.421 9.218 37.738 1.00 0.00 ATOM 1443 CG1 VAL 205 11.736 9.693 37.138 1.00 0.00 ATOM 1444 CG2 VAL 205 9.768 10.390 38.520 1.00 0.00 ATOM 1445 O VAL 205 10.375 8.333 34.514 1.00 0.00 ATOM 1446 C VAL 205 10.054 7.852 35.607 1.00 0.00 ATOM 1447 N GLY 206 10.215 6.569 35.934 1.00 0.00 ATOM 1448 CA GLY 206 10.710 5.558 35.035 1.00 0.00 ATOM 1449 O GLY 206 10.421 5.237 32.714 1.00 0.00 ATOM 1450 C GLY 206 9.878 5.449 33.771 1.00 0.00 ATOM 1451 N GLY 207 8.562 5.619 33.901 1.00 0.00 ATOM 1452 CA GLY 207 7.614 5.698 32.776 1.00 0.00 ATOM 1453 O GLY 207 7.641 6.610 30.566 1.00 0.00 ATOM 1454 C GLY 207 7.917 6.781 31.756 1.00 0.00 ATOM 1455 N LEU 208 8.537 7.878 32.177 1.00 0.00 ATOM 1456 CA LEU 208 8.955 8.911 31.211 1.00 0.00 ATOM 1457 CB LEU 208 9.594 10.089 31.921 1.00 0.00 ATOM 1458 CG LEU 208 8.730 10.951 32.855 1.00 0.00 ATOM 1459 CD1 LEU 208 9.635 11.826 33.703 1.00 0.00 ATOM 1460 CD2 LEU 208 7.774 11.802 32.062 1.00 0.00 ATOM 1461 O LEU 208 9.888 8.614 29.027 1.00 0.00 ATOM 1462 C LEU 208 9.959 8.350 30.225 1.00 0.00 ATOM 1463 N ALA 209 10.920 7.600 30.732 1.00 0.00 ATOM 1464 CA ALA 209 11.928 6.960 29.891 1.00 0.00 ATOM 1465 CB ALA 209 13.025 6.444 30.731 1.00 0.00 ATOM 1466 O ALA 209 11.662 5.669 27.882 1.00 0.00 ATOM 1467 C ALA 209 11.296 5.847 29.048 1.00 0.00 ATOM 1468 N ASP 210 10.323 5.119 29.596 1.00 0.00 ATOM 1469 CA ASP 210 9.627 4.127 28.785 1.00 0.00 ATOM 1470 CB ASP 210 8.570 3.363 29.589 1.00 0.00 ATOM 1471 CG ASP 210 9.186 2.417 30.662 1.00 0.00 ATOM 1472 OD1 ASP 210 10.426 2.237 30.689 1.00 0.00 ATOM 1473 OD2 ASP 210 8.412 1.858 31.480 1.00 0.00 ATOM 1474 O ASP 210 8.958 4.201 26.519 1.00 0.00 ATOM 1475 C ASP 210 8.925 4.753 27.613 1.00 0.00 ATOM 1476 N LEU 211 8.277 5.895 27.850 1.00 0.00 ATOM 1477 CA LEU 211 7.517 6.598 26.810 1.00 0.00 ATOM 1478 CB LEU 211 6.647 7.692 27.434 1.00 0.00 ATOM 1479 CG LEU 211 5.532 7.167 28.324 1.00 0.00 ATOM 1480 CD1 LEU 211 4.948 8.237 29.207 1.00 0.00 ATOM 1481 CD2 LEU 211 4.419 6.480 27.512 1.00 0.00 ATOM 1482 O LEU 211 8.181 7.089 24.554 1.00 0.00 ATOM 1483 C LEU 211 8.465 7.158 25.741 1.00 0.00 ATOM 1484 N ALA 212 9.592 7.699 26.166 1.00 0.00 ATOM 1485 CA ALA 212 10.594 8.201 25.246 1.00 0.00 ATOM 1486 CB ALA 212 11.738 8.835 26.009 1.00 0.00 ATOM 1487 O ALA 212 11.329 7.302 23.109 1.00 0.00 ATOM 1488 C ALA 212 11.112 7.075 24.314 1.00 0.00 ATOM 1489 N GLU 213 11.262 5.874 24.849 1.00 0.00 ATOM 1490 CA GLU 213 11.706 4.719 24.042 1.00 0.00 ATOM 1491 CB GLU 213 11.961 3.507 24.929 1.00 0.00 ATOM 1492 CG GLU 213 12.573 2.297 24.251 1.00 0.00 ATOM 1493 O GLU 213 11.024 4.082 21.812 1.00 0.00 ATOM 1494 C GLU 213 10.666 4.410 22.947 1.00 0.00 ATOM 1495 N ARG 214 9.384 4.566 23.266 1.00 0.00 ATOM 1496 CA ARG 214 8.333 4.303 22.295 1.00 0.00 ATOM 1497 CB ARG 214 6.970 4.231 22.982 1.00 0.00 ATOM 1498 CG ARG 214 6.774 3.001 23.901 1.00 0.00 ATOM 1499 CD ARG 214 5.456 3.076 24.770 1.00 0.00 ATOM 1500 O ARG 214 8.078 5.075 20.025 1.00 0.00 ATOM 1501 C ARG 214 8.392 5.365 21.162 1.00 0.00 ATOM 1502 N VAL 215 8.879 6.570 21.451 1.00 0.00 ATOM 1503 CA VAL 215 9.067 7.561 20.400 1.00 0.00 ATOM 1504 CB VAL 215 9.431 9.003 20.965 1.00 0.00 ATOM 1505 CG1 VAL 215 9.667 9.985 19.880 1.00 0.00 ATOM 1506 CG2 VAL 215 8.284 9.579 21.844 1.00 0.00 ATOM 1507 O VAL 215 9.879 7.085 18.160 1.00 0.00 ATOM 1508 C VAL 215 10.108 7.054 19.383 1.00 0.00 ATOM 1509 N GLY 216 11.227 6.555 19.861 1.00 0.00 ATOM 1510 CA GLY 216 12.276 6.072 18.954 1.00 0.00 ATOM 1511 O GLY 216 12.227 4.675 17.023 1.00 0.00 ATOM 1512 C GLY 216 11.822 4.835 18.184 1.00 0.00 ATOM 1513 N SER 217 10.981 3.986 18.807 1.00 0.00 ATOM 1514 CA SER 217 10.415 2.832 18.144 1.00 0.00 ATOM 1515 CB SER 217 9.589 1.955 19.101 1.00 0.00 ATOM 1516 OG SER 217 10.487 1.316 19.972 1.00 0.00 ATOM 1517 O SER 217 9.546 2.562 15.965 1.00 0.00 ATOM 1518 C SER 217 9.534 3.234 16.987 1.00 0.00 ATOM 1519 N ARG 218 8.700 4.253 17.184 1.00 0.00 ATOM 1520 CA ARG 218 7.880 4.725 16.079 1.00 0.00 ATOM 1521 CB ARG 218 6.850 5.765 16.493 1.00 0.00 ATOM 1522 CG ARG 218 6.031 6.403 15.273 1.00 0.00 ATOM 1523 CD ARG 218 5.220 5.449 14.366 1.00 0.00 ATOM 1524 NE ARG 218 4.460 4.496 15.188 1.00 0.00 ATOM 1525 CZ ARG 218 3.678 3.532 14.693 1.00 0.00 ATOM 1526 NH1 ARG 218 3.494 3.400 13.381 1.00 0.00 ATOM 1527 NH2 ARG 218 3.076 2.691 15.510 1.00 0.00 ATOM 1528 O ARG 218 8.402 4.999 13.781 1.00 0.00 ATOM 1529 C ARG 218 8.727 5.251 14.933 1.00 0.00 ATOM 1530 N LEU 219 9.829 5.952 15.226 1.00 0.00 ATOM 1531 CA LEU 219 10.715 6.408 14.156 1.00 0.00 ATOM 1532 CB LEU 219 11.860 7.289 14.640 1.00 0.00 ATOM 1533 CG LEU 219 11.640 8.767 14.857 1.00 0.00 ATOM 1534 CD1 LEU 219 10.762 8.996 16.035 1.00 0.00 ATOM 1535 CD2 LEU 219 13.016 9.383 15.079 1.00 0.00 ATOM 1536 O LEU 219 11.577 5.327 12.205 1.00 0.00 ATOM 1537 C LEU 219 11.366 5.265 13.439 1.00 0.00 ATOM 1538 N GLU 220 11.730 4.236 14.192 1.00 0.00 ATOM 1539 CA GLU 220 12.346 3.079 13.576 1.00 0.00 ATOM 1540 CB GLU 220 12.905 2.136 14.625 1.00 0.00 ATOM 1541 CG GLU 220 13.444 0.830 14.103 1.00 0.00 ATOM 1542 CD GLU 220 14.039 -0.018 15.230 1.00 0.00 ATOM 1543 OE1 GLU 220 13.820 0.331 16.402 1.00 0.00 ATOM 1544 OE2 GLU 220 14.747 -0.989 14.929 1.00 0.00 ATOM 1545 O GLU 220 11.737 2.013 11.521 1.00 0.00 ATOM 1546 C GLU 220 11.350 2.414 12.617 1.00 0.00 ATOM 1547 N LEU 221 10.077 2.346 12.987 1.00 0.00 ATOM 1548 CA LEU 221 9.059 1.773 12.091 1.00 0.00 ATOM 1549 CB LEU 221 7.689 1.718 12.758 1.00 0.00 ATOM 1550 CG LEU 221 7.502 0.605 13.788 1.00 0.00 ATOM 1551 CD1 LEU 221 6.151 0.760 14.476 1.00 0.00 ATOM 1552 CD2 LEU 221 7.624 -0.769 13.169 1.00 0.00 ATOM 1553 O LEU 221 8.737 1.979 9.723 1.00 0.00 ATOM 1554 C LEU 221 8.910 2.547 10.801 1.00 0.00 ATOM 1555 N MET 222 8.981 3.859 10.906 1.00 0.00 ATOM 1556 CA MET 222 8.904 4.710 9.712 1.00 0.00 ATOM 1557 CB MET 222 8.897 6.192 10.075 1.00 0.00 ATOM 1558 CG MET 222 7.680 6.596 10.843 1.00 0.00 ATOM 1559 SD MET 222 7.726 8.436 11.554 1.00 0.00 ATOM 1560 CE MET 222 8.096 9.218 10.019 1.00 0.00 ATOM 1561 O MET 222 9.895 4.379 7.583 1.00 0.00 ATOM 1562 C MET 222 10.078 4.460 8.788 1.00 0.00 ATOM 1563 N LEU 223 11.287 4.362 9.343 1.00 0.00 ATOM 1564 CA LEU 223 12.451 4.087 8.527 1.00 0.00 ATOM 1565 CB LEU 223 13.760 4.239 9.325 1.00 0.00 ATOM 1566 CG LEU 223 13.978 5.659 9.858 1.00 0.00 ATOM 1567 CD1 LEU 223 15.092 5.778 10.865 1.00 0.00 ATOM 1568 CD2 LEU 223 14.228 6.581 8.693 1.00 0.00 ATOM 1569 O LEU 223 12.922 2.536 6.813 1.00 0.00 ATOM 1570 C LEU 223 12.363 2.715 7.888 1.00 0.00 ATOM 1571 N ALA 224 11.678 1.757 8.520 1.00 0.00 ATOM 1572 CA ALA 224 11.556 0.421 7.938 1.00 0.00 ATOM 1573 CB ALA 224 11.084 -0.607 8.984 1.00 0.00 ATOM 1574 O ALA 224 10.686 -0.560 5.988 1.00 0.00 ATOM 1575 C ALA 224 10.644 0.400 6.744 1.00 0.00 ATOM 1576 N ARG 225 9.790 1.415 6.561 1.00 0.00 ATOM 1577 CA ARG 225 8.898 1.413 5.384 1.00 0.00 ATOM 1578 CB ARG 225 7.696 2.329 5.536 1.00 0.00 ATOM 1579 CG ARG 225 6.774 1.875 6.571 1.00 0.00 ATOM 1580 CD ARG 225 5.462 2.678 6.591 1.00 0.00 ATOM 1581 NE ARG 225 4.972 2.698 7.977 1.00 0.00 ATOM 1582 CZ ARG 225 4.171 1.787 8.520 1.00 0.00 ATOM 1583 NH1 ARG 225 3.722 0.777 7.793 1.00 0.00 ATOM 1584 NH2 ARG 225 3.817 1.887 9.811 1.00 0.00 ATOM 1585 O ARG 225 8.974 1.700 3.032 1.00 0.00 ATOM 1586 C ARG 225 9.599 1.756 4.073 1.00 0.00 ATOM 1587 N VAL 226 10.881 2.112 4.126 1.00 0.00 ATOM 1588 CA VAL 226 11.700 2.420 2.929 1.00 0.00 ATOM 1589 CB VAL 226 10.954 2.164 1.588 1.00 0.00 ATOM 1590 O VAL 226 12.092 4.611 3.896 1.00 0.00 ATOM 1591 C VAL 226 12.220 3.867 2.914 1.00 0.00 ENDMDL # command:# Prefix for output files set to decoys/ # command:# Prefix for input files set to # command:# ReadConformPDB reading from PDB file T0365.undertaker-align.pdb looking for model 1 WARNING: atoms too close: (T0365)P73.C and (T0365)M78.C only 0.000 apart, marking (T0365)M78.C as missing WARNING: atoms too close: (T0365)S74.N and (T0365)P79.N only 0.000 apart, marking (T0365)S74.N as missing WARNING: atoms too close: (T0365)S74.CA and (T0365)P79.CA only 0.000 apart, marking (T0365)S74.CA as missing WARNING: atoms too close: (T0365)Q118.C and (T0365)V119.C only 0.000 apart, marking (T0365)V119.C as missing WARNING: atoms too close: (T0365)V119.N and (T0365)P120.N only 0.000 apart, marking (T0365)V119.N as missing WARNING: atoms too close: (T0365)V119.CA and (T0365)P120.CA only 0.000 apart, marking (T0365)V119.CA as missing WARNING: atoms too close: (T0365)I139.C and (T0365)F150.C only 0.000 apart, marking (T0365)F150.C as missing WARNING: atoms too close: (T0365)N140.N and (T0365)R151.N only 0.000 apart, marking (T0365)N140.N as missing WARNING: atoms too close: (T0365)N140.CA and (T0365)R151.CA only 0.000 apart, marking (T0365)N140.CA as missing WARNING: atoms too close: (T0365)S188.C and (T0365)L190.C only 0.000 apart, marking (T0365)L190.C as missing WARNING: atoms too close: (T0365)E189.N and (T0365)N191.N only 0.000 apart, marking (T0365)E189.N as missing WARNING: atoms too close: (T0365)E189.CA and (T0365)N191.CA only 0.000 apart, marking (T0365)E189.CA as missing # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # command:# naming current conformation align1 # command:Warning: Couldn't open file decoys/align1.gdt for output # fraction of real conformation used = 0.904 # GDT_score = -44.591 # GDT_score(maxd=8.000,maxw=2.900)= -42.758 # GDT_score(maxd=8.000,maxw=3.200)= -39.914 # GDT_score(maxd=8.000,maxw=3.500)= -37.383 # GDT_score(maxd=10.000,maxw=3.800)= -41.824 # GDT_score(maxd=10.000,maxw=4.000)= -40.183 # GDT_score(maxd=10.000,maxw=4.200)= -38.663 # GDT_score(maxd=12.000,maxw=4.300)= -42.924 # GDT_score(maxd=12.000,maxw=4.500)= -41.376 # GDT_score(maxd=12.000,maxw=4.700)= -39.943 # GDT_score(maxd=14.000,maxw=5.200)= -40.325 # GDT_score(maxd=14.000,maxw=5.500)= -38.454 # command:# ReadConformPDB reading from PDB file T0365.undertaker-align.pdb looking for model 2 WARNING: atoms too close: (T0365)L76.C and (T0365)P79.C only 0.000 apart, marking (T0365)P79.C as missing WARNING: atoms too close: (T0365)F77.N and (T0365)V80.N only 0.000 apart, marking (T0365)F77.N as missing WARNING: atoms too close: (T0365)F77.CA and (T0365)V80.CA only 0.000 apart, marking (T0365)F77.CA as missing WARNING: atoms too close: (T0365)L117.C and (T0365)Q118.C only 0.000 apart, marking (T0365)Q118.C as missing WARNING: atoms too close: (T0365)Q118.N and (T0365)V119.N only 0.000 apart, marking (T0365)Q118.N as missing WARNING: atoms too close: (T0365)Q118.CA and (T0365)V119.CA only 0.000 apart, marking (T0365)Q118.CA as missing WARNING: atoms too close: (T0365)D130.C and (T0365)G133.C only 0.000 apart, marking (T0365)G133.C as missing WARNING: atoms too close: (T0365)A131.N and (T0365)L134.N only 0.000 apart, marking (T0365)A131.N as missing WARNING: atoms too close: (T0365)A131.CA and (T0365)L134.CA only 0.000 apart, marking (T0365)A131.CA as missing WARNING: atoms too close: (T0365)D144.C and (T0365)G152.C only 0.000 apart, marking (T0365)G152.C as missing WARNING: atoms too close: (T0365)L145.N and (T0365)R153.N only 0.000 apart, marking (T0365)L145.N as missing WARNING: atoms too close: (T0365)L145.CA and (T0365)R153.CA only 0.000 apart, marking (T0365)L145.CA as missing WARNING: atoms too close: (T0365)D156.C and (T0365)K160.C only 0.000 apart, marking (T0365)K160.C as missing WARNING: atoms too close: (T0365)F157.N and (T0365)M161.N only 0.000 apart, marking (T0365)F157.N as missing WARNING: atoms too close: (T0365)F157.CA and (T0365)M161.CA only 0.000 apart, marking (T0365)F157.CA as missing WARNING: atoms too close: (T0365)E189.C and (T0365)L190.C only 0.000 apart, marking (T0365)L190.C as missing WARNING: atoms too close: (T0365)L190.N and (T0365)N191.N only 0.000 apart, marking (T0365)L190.N as missing WARNING: atoms too close: (T0365)L190.CA and (T0365)N191.CA only 0.000 apart, marking (T0365)L190.CA as missing # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # command:# naming current conformation align2 # command:Warning: Couldn't open file decoys/align2.gdt for output # fraction of real conformation used = 0.909 # GDT_score = -51.082 # GDT_score(maxd=8.000,maxw=2.900)= -49.899 # GDT_score(maxd=8.000,maxw=3.200)= -46.890 # GDT_score(maxd=8.000,maxw=3.500)= -44.084 # GDT_score(maxd=10.000,maxw=3.800)= -48.092 # GDT_score(maxd=10.000,maxw=4.000)= -46.237 # GDT_score(maxd=10.000,maxw=4.200)= -44.465 # GDT_score(maxd=12.000,maxw=4.300)= -48.642 # GDT_score(maxd=12.000,maxw=4.500)= -46.869 # GDT_score(maxd=12.000,maxw=4.700)= -45.181 # GDT_score(maxd=14.000,maxw=5.200)= -45.031 # GDT_score(maxd=14.000,maxw=5.500)= -42.874 # command:# ReadConformPDB reading from PDB file T0365.undertaker-align.pdb looking for model 3 WARNING: atoms too close: (T0365)Q136.C and (T0365)E141.C only 0.000 apart, marking (T0365)E141.C as missing WARNING: atoms too close: (T0365)Q137.N and (T0365)L142.N only 0.000 apart, marking (T0365)Q137.N as missing WARNING: atoms too close: (T0365)Q137.CA and (T0365)L142.CA only 0.000 apart, marking (T0365)Q137.CA as missing WARNING: atoms too close: (T0365)S188.C and (T0365)L190.C only 0.000 apart, marking (T0365)L190.C as missing WARNING: atoms too close: (T0365)E189.N and (T0365)N191.N only 0.000 apart, marking (T0365)E189.N as missing WARNING: atoms too close: (T0365)E189.CA and (T0365)N191.CA only 0.000 apart, marking (T0365)E189.CA as missing # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # command:# naming current conformation align3 # command:# ReadConformPDB reading from PDB file T0365.undertaker-align.pdb looking for model 4 WARNING: atoms too close: (T0365)D144.C and (T0365)A148.C only 0.000 apart, marking (T0365)A148.C as missing WARNING: atoms too close: (T0365)L145.N and (T0365)G149.N only 0.000 apart, marking (T0365)L145.N as missing WARNING: atoms too close: (T0365)L145.CA and (T0365)G149.CA only 0.000 apart, marking (T0365)L145.CA as missing WARNING: atoms too close: (T0365)F150.C and (T0365)G152.C only 0.000 apart, marking (T0365)G152.C as missing WARNING: atoms too close: (T0365)R151.N and (T0365)R153.N only 0.000 apart, marking (T0365)R151.N as missing WARNING: atoms too close: (T0365)R151.CA and (T0365)R153.CA only 0.000 apart, marking (T0365)R151.CA as missing # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # command:# naming current conformation align4 # command:# ReadConformPDB reading from PDB file T0365.undertaker-align.pdb looking for model 5 WARNING: atoms too close: (T0365)I40.C and (T0365)T41.C only 0.000 apart, marking (T0365)T41.C as missing WARNING: atoms too close: (T0365)T41.N and (T0365)G42.N only 0.000 apart, marking (T0365)T41.N as missing WARNING: atoms too close: (T0365)T41.CA and (T0365)G42.CA only 0.000 apart, marking (T0365)T41.CA as missing WARNING: atoms too close: (T0365)K59.C and (T0365)R66.C only 0.000 apart, marking (T0365)R66.C as missing WARNING: atoms too close: (T0365)Q60.N and (T0365)E67.N only 0.000 apart, marking (T0365)Q60.N as missing WARNING: atoms too close: (T0365)Q60.CA and (T0365)E67.CA only 0.000 apart, marking (T0365)Q60.CA as missing WARNING: atoms too close: (T0365)L76.C and (T0365)P79.C only 0.000 apart, marking (T0365)P79.C as missing WARNING: atoms too close: (T0365)F77.N and (T0365)V80.N only 0.000 apart, marking (T0365)F77.N as missing WARNING: atoms too close: (T0365)F77.CA and (T0365)V80.CA only 0.000 apart, marking (T0365)F77.CA as missing WARNING: atoms too close: (T0365)T83.C and (T0365)T90.C only 0.000 apart, marking (T0365)T90.C as missing WARNING: atoms too close: (T0365)D84.N and (T0365)Q91.N only 0.000 apart, marking (T0365)D84.N as missing WARNING: atoms too close: (T0365)D84.CA and (T0365)Q91.CA only 0.000 apart, marking (T0365)D84.CA as missing WARNING: atoms too close: (T0365)V106.C and (T0365)I107.C only 0.000 apart, marking (T0365)I107.C as missing WARNING: atoms too close: (T0365)I107.N and (T0365)G108.N only 0.000 apart, marking (T0365)I107.N as missing WARNING: atoms too close: (T0365)I107.CA and (T0365)G108.CA only 0.000 apart, marking (T0365)I107.CA as missing WARNING: atoms too close: (T0365)E141.C and (T0365)R151.C only 0.000 apart, marking (T0365)R151.C as missing WARNING: atoms too close: (T0365)L142.N and (T0365)G152.N only 0.000 apart, marking (T0365)L142.N as missing WARNING: atoms too close: (T0365)L142.CA and (T0365)G152.CA only 0.000 apart, marking (T0365)L142.CA as missing WARNING: atoms too close: (T0365)S188.C and (T0365)E189.C only 0.000 apart, marking (T0365)E189.C as missing WARNING: atoms too close: (T0365)E189.N and (T0365)L190.N only 0.000 apart, marking (T0365)E189.N as missing WARNING: atoms too close: (T0365)E189.CA and (T0365)L190.CA only 0.000 apart, marking (T0365)E189.CA as missing # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # command:# naming current conformation align5 # command:# Prefix for input files set to decoys/ # command:# reading script from file read-pdb+servers.under # ReadConformPDB reading from PDB file ../model1.ts-submitted looking for model 1 # Found a chain break before 192 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ../model2.ts-submitted looking for model 1 # Found a chain break before 110 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ../model3.ts-submitted looking for model 1 # Found a chain break before 164 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ../model4.ts-submitted looking for model 1 # Found a chain break before 198 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ../model5.ts-submitted looking for model 1 # Found a chain break before 201 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try1-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 189 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try1-opt1.pdb.gz looking for model 1 # Found a chain break before 189 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try1-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 110 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try1-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 110 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try1-opt2.pdb.gz looking for model 1 # Found a chain break before 189 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try1-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 189 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try10-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 183 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try10-opt1.pdb.gz looking for model 1 # Found a chain break before 183 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try10-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 148 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try10-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 148 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try10-opt2.pdb.gz looking for model 1 # Found a chain break before 183 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try10-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 183 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try11-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 195 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try11-opt1.pdb.gz looking for model 1 # Found a chain break before 195 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try11-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 193 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try11-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 193 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try11-opt2.pdb.gz looking for model 1 # Found a chain break before 195 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try11-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 195 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try12-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 201 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try12-opt1.pdb.gz looking for model 1 # Found a chain break before 201 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try12-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 201 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try12-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 201 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try12-opt2.pdb.gz looking for model 1 # Found a chain break before 201 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try12-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 201 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try13-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 188 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try13-opt1.pdb.gz looking for model 1 # Found a chain break before 188 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try13-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 143 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try13-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 143 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try13-opt2.pdb.gz looking for model 1 # Found a chain break before 188 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try13-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 188 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try14-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 192 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try14-opt1.pdb.gz looking for model 1 # Found a chain break before 192 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try14-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 117 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try14-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 117 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try14-opt2.pdb.gz looking for model 1 # Found a chain break before 192 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try14-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 192 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try15-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 164 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try15-opt1.pdb.gz looking for model 1 # Found a chain break before 164 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try15-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 121 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try15-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 121 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try15-opt2.pdb.gz looking for model 1 # Found a chain break before 164 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try15-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 164 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try16-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 198 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try16-opt1.pdb.gz looking for model 1 # Found a chain break before 198 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try16-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 225 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try16-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 225 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try16-opt2.pdb.gz looking for model 1 # Found a chain break before 198 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try16-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 198 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try2-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 189 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try2-opt1.pdb.gz looking for model 1 # Found a chain break before 189 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try2-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 191 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try2-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 191 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try2-opt2.pdb.gz looking for model 1 # Found a chain break before 189 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try2-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 189 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try3-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 117 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try3-opt1.pdb.gz looking for model 1 # Found a chain break before 117 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try3-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 72 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try3-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 72 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try3-opt2.pdb.gz looking for model 1 # Found a chain break before 135 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try3-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 135 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try4-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 191 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try4-opt1.pdb.gz looking for model 1 # Found a chain break before 191 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try4-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 192 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try4-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 192 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try4-opt2.pdb.gz looking for model 1 # Found a chain break before 191 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try4-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 191 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try5-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 192 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try5-opt1.pdb.gz looking for model 1 # Found a chain break before 192 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try5-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 164 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try5-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 164 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try5-opt2.pdb.gz looking for model 1 # Found a chain break before 192 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try5-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 192 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try6-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 192 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try6-opt1.pdb.gz looking for model 1 # Found a chain break before 192 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try6-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 121 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try6-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 121 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try6-opt2.pdb.gz looking for model 1 # Found a chain break before 192 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try6-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 192 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try7+breaks.pdb.gz looking for model 1 # Found a chain break before 122 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try7-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 192 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try7-opt1.pdb.gz looking for model 1 # Found a chain break before 192 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try7-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 117 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try7-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 117 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try7-opt2.pdb.gz looking for model 1 # Found a chain break before 192 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try7-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 192 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try8-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 193 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try8-opt1.pdb.gz looking for model 1 # Found a chain break before 193 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try8-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 128 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try8-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 128 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try8-opt2.pdb.gz looking for model 1 # Found a chain break before 193 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try8-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 193 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try9-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 192 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try9-opt1.pdb.gz looking for model 1 # Found a chain break before 192 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try9-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 77 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try9-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 77 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try9-opt2.pdb.gz looking for model 1 # Found a chain break before 192 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0365.try9-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 192 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file chimera-11-10.pdb.gz looking for model 1 # Found a chain break before 195 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file chimera-8-7.gromacs0.pdb.gz looking for model 1 # Found a chain break before 123 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file chimera-8-7.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 123 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file chimera-8-7.pdb.gz looking for model 1 # Found a chain break before 193 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file servers/3D-JIGSAW_POPULUS_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_POPULUS_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1624145432.pdb -s /var/tmp/to_scwrl_1624145432.seq -o /var/tmp/from_scwrl_1624145432.pdb > /var/tmp/scwrl_1624145432.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1624145432.pdb # conformation set from SCWRL output # naming current conformation 3D-JIGSAW_POPULUS_TS1-scwrl # ReadConformPDB reading from PDB file servers/3D-JIGSAW_POPULUS_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_POPULUS_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_661263087.pdb -s /var/tmp/to_scwrl_661263087.seq -o /var/tmp/from_scwrl_661263087.pdb > /var/tmp/scwrl_661263087.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_661263087.pdb # conformation set from SCWRL output # naming current conformation 3D-JIGSAW_POPULUS_TS2-scwrl # ReadConformPDB reading from PDB file servers/3D-JIGSAW_POPULUS_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_POPULUS_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_101577894.pdb -s /var/tmp/to_scwrl_101577894.seq -o /var/tmp/from_scwrl_101577894.pdb > /var/tmp/scwrl_101577894.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_101577894.pdb # conformation set from SCWRL output # naming current conformation 3D-JIGSAW_POPULUS_TS3-scwrl # ReadConformPDB reading from PDB file servers/3D-JIGSAW_POPULUS_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_POPULUS_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1113955267.pdb -s /var/tmp/to_scwrl_1113955267.seq -o /var/tmp/from_scwrl_1113955267.pdb > /var/tmp/scwrl_1113955267.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1113955267.pdb # conformation set from SCWRL output # naming current conformation 3D-JIGSAW_POPULUS_TS4-scwrl # ReadConformPDB reading from PDB file servers/3D-JIGSAW_POPULUS_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_POPULUS_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_380280616.pdb -s /var/tmp/to_scwrl_380280616.seq -o /var/tmp/from_scwrl_380280616.pdb > /var/tmp/scwrl_380280616.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_380280616.pdb # conformation set from SCWRL output # naming current conformation 3D-JIGSAW_POPULUS_TS5-scwrl # ReadConformPDB reading from PDB file servers/3D-JIGSAW_RECOM_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_RECOM_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_488606083.pdb -s /var/tmp/to_scwrl_488606083.seq -o /var/tmp/from_scwrl_488606083.pdb > /var/tmp/scwrl_488606083.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_488606083.pdb # conformation set from SCWRL output # naming current conformation 3D-JIGSAW_RECOM_TS1-scwrl # ReadConformPDB reading from PDB file servers/3D-JIGSAW_RECOM_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_RECOM_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_730143779.pdb -s /var/tmp/to_scwrl_730143779.seq -o /var/tmp/from_scwrl_730143779.pdb > /var/tmp/scwrl_730143779.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_730143779.pdb # conformation set from SCWRL output # naming current conformation 3D-JIGSAW_RECOM_TS2-scwrl # ReadConformPDB reading from PDB file servers/3D-JIGSAW_RECOM_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_RECOM_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_279098805.pdb -s /var/tmp/to_scwrl_279098805.seq -o /var/tmp/from_scwrl_279098805.pdb > /var/tmp/scwrl_279098805.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_279098805.pdb # conformation set from SCWRL output # naming current conformation 3D-JIGSAW_RECOM_TS3-scwrl # ReadConformPDB reading from PDB file servers/3D-JIGSAW_RECOM_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation 3D-JIGSAW_RECOM_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_2132108717.pdb -s /var/tmp/to_scwrl_2132108717.seq -o /var/tmp/from_scwrl_2132108717.pdb > /var/tmp/scwrl_2132108717.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2132108717.pdb # conformation set from SCWRL output # naming current conformation 3D-JIGSAW_RECOM_TS4-scwrl # ReadConformPDB reading from PDB file servers/3D-JIGSAW_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1316008631.pdb -s /var/tmp/to_scwrl_1316008631.seq -o /var/tmp/from_scwrl_1316008631.pdb > /var/tmp/scwrl_1316008631.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1316008631.pdb # conformation set from SCWRL output # naming current conformation 3D-JIGSAW_TS1-scwrl # ReadConformPDB reading from PDB file servers/3D-JIGSAW_TS2.pdb.gz looking for model 1 # Found a chain break before 213 # copying to AlignedFragments data structure # naming current conformation 3D-JIGSAW_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1595802854.pdb -s /var/tmp/to_scwrl_1595802854.seq -o /var/tmp/from_scwrl_1595802854.pdb > /var/tmp/scwrl_1595802854.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1595802854.pdb # conformation set from SCWRL output # naming current conformation 3D-JIGSAW_TS2-scwrl # ReadConformPDB reading from PDB file servers/3D-JIGSAW_TS3.pdb.gz looking for model 1 # Found a chain break before 190 # copying to AlignedFragments data structure # naming current conformation 3D-JIGSAW_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1936150429.pdb -s /var/tmp/to_scwrl_1936150429.seq -o /var/tmp/from_scwrl_1936150429.pdb > /var/tmp/scwrl_1936150429.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1936150429.pdb # conformation set from SCWRL output # naming current conformation 3D-JIGSAW_TS3-scwrl # ReadConformPDB reading from PDB file servers/3D-JIGSAW_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_84342300.pdb -s /var/tmp/to_scwrl_84342300.seq -o /var/tmp/from_scwrl_84342300.pdb > /var/tmp/scwrl_84342300.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_84342300.pdb # conformation set from SCWRL output # naming current conformation 3D-JIGSAW_TS4-scwrl # ReadConformPDB reading from PDB file servers/3D-JIGSAW_TS5.pdb.gz looking for model 1 # Found a chain break before 213 # copying to AlignedFragments data structure # naming current conformation 3D-JIGSAW_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_913105868.pdb -s /var/tmp/to_scwrl_913105868.seq -o /var/tmp/from_scwrl_913105868.pdb > /var/tmp/scwrl_913105868.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_913105868.pdb # conformation set from SCWRL output # naming current conformation 3D-JIGSAW_TS5-scwrl # ReadConformPDB reading from PDB file servers/3Dpro_TS1.pdb.gz looking for model 1 # Found a chain break before 117 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1893481122.pdb -s /var/tmp/to_scwrl_1893481122.seq -o /var/tmp/from_scwrl_1893481122.pdb > /var/tmp/scwrl_1893481122.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1893481122.pdb # conformation set from SCWRL output # naming current conformation 3Dpro_TS1-scwrl # ReadConformPDB reading from PDB file servers/3Dpro_TS2.pdb.gz looking for model 1 # Found a chain break before 129 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_318692411.pdb -s /var/tmp/to_scwrl_318692411.seq -o /var/tmp/from_scwrl_318692411.pdb > /var/tmp/scwrl_318692411.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_318692411.pdb # conformation set from SCWRL output # naming current conformation 3Dpro_TS2-scwrl # ReadConformPDB reading from PDB file servers/3Dpro_TS3.pdb.gz looking for model 1 # Found a chain break before 145 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_773101669.pdb -s /var/tmp/to_scwrl_773101669.seq -o /var/tmp/from_scwrl_773101669.pdb > /var/tmp/scwrl_773101669.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_773101669.pdb # conformation set from SCWRL output # naming current conformation 3Dpro_TS3-scwrl # ReadConformPDB reading from PDB file servers/3Dpro_TS4.pdb.gz looking for model 1 # Found a chain break before 184 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_565866149.pdb -s /var/tmp/to_scwrl_565866149.seq -o /var/tmp/from_scwrl_565866149.pdb > /var/tmp/scwrl_565866149.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_565866149.pdb # conformation set from SCWRL output # naming current conformation 3Dpro_TS4-scwrl # ReadConformPDB reading from PDB file servers/3Dpro_TS5.pdb.gz looking for model 1 # Found a chain break before 160 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1162143604.pdb -s /var/tmp/to_scwrl_1162143604.seq -o /var/tmp/from_scwrl_1162143604.pdb > /var/tmp/scwrl_1162143604.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1162143604.pdb # conformation set from SCWRL output # naming current conformation 3Dpro_TS5-scwrl # ReadConformPDB reading from PDB file servers/ABIpro_TS1.pdb.gz looking for model 1 # Found a chain break before 205 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1514408709.pdb -s /var/tmp/to_scwrl_1514408709.seq -o /var/tmp/from_scwrl_1514408709.pdb > /var/tmp/scwrl_1514408709.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1514408709.pdb # conformation set from SCWRL output # naming current conformation ABIpro_TS1-scwrl # ReadConformPDB reading from PDB file servers/ABIpro_TS2.pdb.gz looking for model 1 # Found a chain break before 197 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_258121725.pdb -s /var/tmp/to_scwrl_258121725.seq -o /var/tmp/from_scwrl_258121725.pdb > /var/tmp/scwrl_258121725.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_258121725.pdb # conformation set from SCWRL output # naming current conformation ABIpro_TS2-scwrl # ReadConformPDB reading from PDB file servers/ABIpro_TS3.pdb.gz looking for model 1 # Found a chain break before 208 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_237000466.pdb -s /var/tmp/to_scwrl_237000466.seq -o /var/tmp/from_scwrl_237000466.pdb > /var/tmp/scwrl_237000466.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_237000466.pdb # conformation set from SCWRL output # naming current conformation ABIpro_TS3-scwrl # ReadConformPDB reading from PDB file servers/ABIpro_TS4.pdb.gz looking for model 1 # Found a chain break before 180 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1324837311.pdb -s /var/tmp/to_scwrl_1324837311.seq -o /var/tmp/from_scwrl_1324837311.pdb > /var/tmp/scwrl_1324837311.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1324837311.pdb # conformation set from SCWRL output # naming current conformation ABIpro_TS4-scwrl # ReadConformPDB reading from PDB file servers/ABIpro_TS5.pdb.gz looking for model 1 # Found a chain break before 212 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_2078266377.pdb -s /var/tmp/to_scwrl_2078266377.seq -o /var/tmp/from_scwrl_2078266377.pdb > /var/tmp/scwrl_2078266377.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2078266377.pdb # conformation set from SCWRL output # naming current conformation ABIpro_TS5-scwrl # ReadConformPDB reading from PDB file servers/BayesHH_TS1.pdb.gz looking for model 1 # Found a chain break before 187 # copying to AlignedFragments data structure # naming current conformation BayesHH_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1003571078.pdb -s /var/tmp/to_scwrl_1003571078.seq -o /var/tmp/from_scwrl_1003571078.pdb > /var/tmp/scwrl_1003571078.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1003571078.pdb # conformation set from SCWRL output # naming current conformation BayesHH_TS1-scwrl # ReadConformPDB reading from PDB file servers/Bilab-ENABLE_TS1.pdb.gz looking for model 1 # Found a chain break before 160 # copying to AlignedFragments data structure # naming current conformation Bilab-ENABLE_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1553411242.pdb -s /var/tmp/to_scwrl_1553411242.seq -o /var/tmp/from_scwrl_1553411242.pdb > /var/tmp/scwrl_1553411242.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1553411242.pdb # conformation set from SCWRL output # naming current conformation Bilab-ENABLE_TS1-scwrl # ReadConformPDB reading from PDB file servers/Bilab-ENABLE_TS2.pdb.gz looking for model 1 # naming current conformation Bilab-ENABLE_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1409344087.pdb -s /var/tmp/to_scwrl_1409344087.seq -o /var/tmp/from_scwrl_1409344087.pdb > /var/tmp/scwrl_1409344087.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1409344087.pdb # conformation set from SCWRL output # naming current conformation Bilab-ENABLE_TS2-scwrl # ReadConformPDB reading from PDB file servers/CIRCLE_TS1.pdb.gz looking for model 1 # Found a chain break before 222 # copying to AlignedFragments data structure # naming current conformation CIRCLE_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_521384887.pdb -s /var/tmp/to_scwrl_521384887.seq -o /var/tmp/from_scwrl_521384887.pdb > /var/tmp/scwrl_521384887.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_521384887.pdb # conformation set from SCWRL output # naming current conformation CIRCLE_TS1-scwrl # ReadConformPDB reading from PDB file servers/CIRCLE_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation CIRCLE_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1978608448.pdb -s /var/tmp/to_scwrl_1978608448.seq -o /var/tmp/from_scwrl_1978608448.pdb > /var/tmp/scwrl_1978608448.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1978608448.pdb # conformation set from SCWRL output # naming current conformation CIRCLE_TS2-scwrl # ReadConformPDB reading from PDB file servers/CIRCLE_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation CIRCLE_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_546254228.pdb -s /var/tmp/to_scwrl_546254228.seq -o /var/tmp/from_scwrl_546254228.pdb > /var/tmp/scwrl_546254228.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_546254228.pdb # conformation set from SCWRL output # naming current conformation CIRCLE_TS3-scwrl # ReadConformPDB reading from PDB file servers/CIRCLE_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation CIRCLE_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_331875562.pdb -s /var/tmp/to_scwrl_331875562.seq -o /var/tmp/from_scwrl_331875562.pdb > /var/tmp/scwrl_331875562.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_331875562.pdb # conformation set from SCWRL output # naming current conformation CIRCLE_TS4-scwrl # ReadConformPDB reading from PDB file servers/CIRCLE_TS5.pdb.gz looking for model 1 # Found a chain break before 222 # copying to AlignedFragments data structure # naming current conformation CIRCLE_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1455270233.pdb -s /var/tmp/to_scwrl_1455270233.seq -o /var/tmp/from_scwrl_1455270233.pdb > /var/tmp/scwrl_1455270233.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1455270233.pdb # conformation set from SCWRL output # naming current conformation CIRCLE_TS5-scwrl # ReadConformPDB reading from PDB file servers/CPHmodels_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation CPHmodels_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1207517315.pdb -s /var/tmp/to_scwrl_1207517315.seq -o /var/tmp/from_scwrl_1207517315.pdb > /var/tmp/scwrl_1207517315.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1207517315.pdb # conformation set from SCWRL output # naming current conformation CPHmodels_TS1-scwrl # ReadConformPDB reading from PDB file servers/CaspIta-FOX_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation CaspIta-FOX_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_433453456.pdb -s /var/tmp/to_scwrl_433453456.seq -o /var/tmp/from_scwrl_433453456.pdb > /var/tmp/scwrl_433453456.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_433453456.pdb # conformation set from SCWRL output # naming current conformation CaspIta-FOX_TS1-scwrl # ReadConformPDB reading from PDB file servers/CaspIta-FOX_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation CaspIta-FOX_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_421741854.pdb -s /var/tmp/to_scwrl_421741854.seq -o /var/tmp/from_scwrl_421741854.pdb > /var/tmp/scwrl_421741854.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_421741854.pdb # conformation set from SCWRL output # naming current conformation CaspIta-FOX_TS2-scwrl # ReadConformPDB reading from PDB file servers/CaspIta-FOX_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation CaspIta-FOX_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1587797931.pdb -s /var/tmp/to_scwrl_1587797931.seq -o /var/tmp/from_scwrl_1587797931.pdb > /var/tmp/scwrl_1587797931.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1587797931.pdb # conformation set from SCWRL output # naming current conformation CaspIta-FOX_TS3-scwrl # ReadConformPDB reading from PDB file servers/CaspIta-FOX_TS4.pdb.gz looking for model 1 # Found a chain break before 195 # copying to AlignedFragments data structure # naming current conformation CaspIta-FOX_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_922059540.pdb -s /var/tmp/to_scwrl_922059540.seq -o /var/tmp/from_scwrl_922059540.pdb > /var/tmp/scwrl_922059540.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_922059540.pdb # conformation set from SCWRL output # naming current conformation CaspIta-FOX_TS4-scwrl # ReadConformPDB reading from PDB file servers/CaspIta-FOX_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation CaspIta-FOX_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1151885633.pdb -s /var/tmp/to_scwrl_1151885633.seq -o /var/tmp/from_scwrl_1151885633.pdb > /var/tmp/scwrl_1151885633.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1151885633.pdb # conformation set from SCWRL output # naming current conformation CaspIta-FOX_TS5-scwrl # ReadConformPDB reading from PDB file servers/Distill_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation Distill_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1866896737.pdb -s /var/tmp/to_scwrl_1866896737.seq -o /var/tmp/from_scwrl_1866896737.pdb > /var/tmp/scwrl_1866896737.log Error: Couldn't open file /var/tmp/from_scwrl_1866896737.pdb or /var/tmp/from_scwrl_1866896737.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1866896737_b.pdb or decoys//var/tmp/from_scwrl_1866896737_b.pdb.gz for input Trying /var/tmp/from_scwrl_1866896737_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1866896737_b.pdb or /var/tmp/from_scwrl_1866896737_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1866896737_a.pdb or decoys//var/tmp/from_scwrl_1866896737_a.pdb.gz for input Trying /var/tmp/from_scwrl_1866896737_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1866896737_a.pdb or /var/tmp/from_scwrl_1866896737_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1866896737.pdb or /var/tmp/from_scwrl_1866896737_b.pdb or /var/tmp/from_scwrl_1866896737_a.pdb Error: no new SCWRL conformation added # naming current conformation Distill_TS1-scwrl # ReadConformPDB reading from PDB file servers/Distill_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation Distill_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_906684610.pdb -s /var/tmp/to_scwrl_906684610.seq -o /var/tmp/from_scwrl_906684610.pdb > /var/tmp/scwrl_906684610.log Error: Couldn't open file /var/tmp/from_scwrl_906684610.pdb or /var/tmp/from_scwrl_906684610.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_906684610_b.pdb or decoys//var/tmp/from_scwrl_906684610_b.pdb.gz for input Trying /var/tmp/from_scwrl_906684610_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_906684610_b.pdb or /var/tmp/from_scwrl_906684610_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_906684610_a.pdb or decoys//var/tmp/from_scwrl_906684610_a.pdb.gz for input Trying /var/tmp/from_scwrl_906684610_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_906684610_a.pdb or /var/tmp/from_scwrl_906684610_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_906684610.pdb or /var/tmp/from_scwrl_906684610_b.pdb or /var/tmp/from_scwrl_906684610_a.pdb Error: no new SCWRL conformation added # naming current conformation Distill_TS2-scwrl # ReadConformPDB reading from PDB file servers/Distill_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation Distill_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_320410618.pdb -s /var/tmp/to_scwrl_320410618.seq -o /var/tmp/from_scwrl_320410618.pdb > /var/tmp/scwrl_320410618.log Error: Couldn't open file /var/tmp/from_scwrl_320410618.pdb or /var/tmp/from_scwrl_320410618.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_320410618_b.pdb or decoys//var/tmp/from_scwrl_320410618_b.pdb.gz for input Trying /var/tmp/from_scwrl_320410618_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_320410618_b.pdb or /var/tmp/from_scwrl_320410618_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_320410618_a.pdb or decoys//var/tmp/from_scwrl_320410618_a.pdb.gz for input Trying /var/tmp/from_scwrl_320410618_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_320410618_a.pdb or /var/tmp/from_scwrl_320410618_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_320410618.pdb or /var/tmp/from_scwrl_320410618_b.pdb or /var/tmp/from_scwrl_320410618_a.pdb Error: no new SCWRL conformation added # naming current conformation Distill_TS3-scwrl # ReadConformPDB reading from PDB file servers/Distill_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation Distill_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1315215944.pdb -s /var/tmp/to_scwrl_1315215944.seq -o /var/tmp/from_scwrl_1315215944.pdb > /var/tmp/scwrl_1315215944.log Error: Couldn't open file /var/tmp/from_scwrl_1315215944.pdb or /var/tmp/from_scwrl_1315215944.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1315215944_b.pdb or decoys//var/tmp/from_scwrl_1315215944_b.pdb.gz for input Trying /var/tmp/from_scwrl_1315215944_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1315215944_b.pdb or /var/tmp/from_scwrl_1315215944_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1315215944_a.pdb or decoys//var/tmp/from_scwrl_1315215944_a.pdb.gz for input Trying /var/tmp/from_scwrl_1315215944_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1315215944_a.pdb or /var/tmp/from_scwrl_1315215944_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1315215944.pdb or /var/tmp/from_scwrl_1315215944_b.pdb or /var/tmp/from_scwrl_1315215944_a.pdb Error: no new SCWRL conformation added # naming current conformation Distill_TS4-scwrl # ReadConformPDB reading from PDB file servers/Distill_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation Distill_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_695351392.pdb -s /var/tmp/to_scwrl_695351392.seq -o /var/tmp/from_scwrl_695351392.pdb > /var/tmp/scwrl_695351392.log Error: Couldn't open file /var/tmp/from_scwrl_695351392.pdb or /var/tmp/from_scwrl_695351392.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_695351392_b.pdb or decoys//var/tmp/from_scwrl_695351392_b.pdb.gz for input Trying /var/tmp/from_scwrl_695351392_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_695351392_b.pdb or /var/tmp/from_scwrl_695351392_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_695351392_a.pdb or decoys//var/tmp/from_scwrl_695351392_a.pdb.gz for input Trying /var/tmp/from_scwrl_695351392_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_695351392_a.pdb or /var/tmp/from_scwrl_695351392_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_695351392.pdb or /var/tmp/from_scwrl_695351392_b.pdb or /var/tmp/from_scwrl_695351392_a.pdb Error: no new SCWRL conformation added # naming current conformation Distill_TS5-scwrl # ReadConformPDB reading from PDB file servers/FAMSD_TS1.pdb.gz looking for model 1 # Found a chain break before 220 # copying to AlignedFragments data structure # naming current conformation FAMSD_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_404752918.pdb -s /var/tmp/to_scwrl_404752918.seq -o /var/tmp/from_scwrl_404752918.pdb > /var/tmp/scwrl_404752918.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_404752918.pdb # conformation set from SCWRL output # naming current conformation FAMSD_TS1-scwrl # ReadConformPDB reading from PDB file servers/FAMSD_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation FAMSD_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_80838165.pdb -s /var/tmp/to_scwrl_80838165.seq -o /var/tmp/from_scwrl_80838165.pdb > /var/tmp/scwrl_80838165.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_80838165.pdb # conformation set from SCWRL output # naming current conformation FAMSD_TS2-scwrl # ReadConformPDB reading from PDB file servers/FAMSD_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation FAMSD_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_441348867.pdb -s /var/tmp/to_scwrl_441348867.seq -o /var/tmp/from_scwrl_441348867.pdb > /var/tmp/scwrl_441348867.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_441348867.pdb # conformation set from SCWRL output # naming current conformation FAMSD_TS3-scwrl # ReadConformPDB reading from PDB file servers/FAMSD_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation FAMSD_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_723445329.pdb -s /var/tmp/to_scwrl_723445329.seq -o /var/tmp/from_scwrl_723445329.pdb > /var/tmp/scwrl_723445329.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_723445329.pdb # conformation set from SCWRL output # naming current conformation FAMSD_TS4-scwrl # ReadConformPDB reading from PDB file servers/FAMSD_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation FAMSD_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_853939834.pdb -s /var/tmp/to_scwrl_853939834.seq -o /var/tmp/from_scwrl_853939834.pdb > /var/tmp/scwrl_853939834.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_853939834.pdb # conformation set from SCWRL output # naming current conformation FAMSD_TS5-scwrl # ReadConformPDB reading from PDB file servers/FAMS_TS1.pdb.gz looking for model 1 # Found a chain break before 221 # copying to AlignedFragments data structure # naming current conformation FAMS_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1007215017.pdb -s /var/tmp/to_scwrl_1007215017.seq -o /var/tmp/from_scwrl_1007215017.pdb > /var/tmp/scwrl_1007215017.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1007215017.pdb # conformation set from SCWRL output # naming current conformation FAMS_TS1-scwrl # ReadConformPDB reading from PDB file servers/FAMS_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation FAMS_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1885588933.pdb -s /var/tmp/to_scwrl_1885588933.seq -o /var/tmp/from_scwrl_1885588933.pdb > /var/tmp/scwrl_1885588933.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1885588933.pdb # conformation set from SCWRL output # naming current conformation FAMS_TS2-scwrl # ReadConformPDB reading from PDB file servers/FAMS_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation FAMS_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_220864897.pdb -s /var/tmp/to_scwrl_220864897.seq -o /var/tmp/from_scwrl_220864897.pdb > /var/tmp/scwrl_220864897.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_220864897.pdb # conformation set from SCWRL output # naming current conformation FAMS_TS3-scwrl # ReadConformPDB reading from PDB file servers/FAMS_TS4.pdb.gz looking for model 1 # Found a chain break before 222 # copying to AlignedFragments data structure # naming current conformation FAMS_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1265336741.pdb -s /var/tmp/to_scwrl_1265336741.seq -o /var/tmp/from_scwrl_1265336741.pdb > /var/tmp/scwrl_1265336741.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1265336741.pdb # conformation set from SCWRL output # naming current conformation FAMS_TS4-scwrl # ReadConformPDB reading from PDB file servers/FAMS_TS5.pdb.gz looking for model 1 # Found a chain break before 222 # copying to AlignedFragments data structure # naming current conformation FAMS_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_2122589400.pdb -s /var/tmp/to_scwrl_2122589400.seq -o /var/tmp/from_scwrl_2122589400.pdb > /var/tmp/scwrl_2122589400.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2122589400.pdb # conformation set from SCWRL output # naming current conformation FAMS_TS5-scwrl # ReadConformPDB reading from PDB file servers/FOLDpro_TS1.pdb.gz looking for model 1 # Found a chain break before 193 # copying to AlignedFragments data structure # naming current conformation FOLDpro_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1545702208.pdb -s /var/tmp/to_scwrl_1545702208.seq -o /var/tmp/from_scwrl_1545702208.pdb > /var/tmp/scwrl_1545702208.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1545702208.pdb # conformation set from SCWRL output # naming current conformation FOLDpro_TS1-scwrl # ReadConformPDB reading from PDB file servers/FOLDpro_TS2.pdb.gz looking for model 1 # Found a chain break before 192 # copying to AlignedFragments data structure # naming current conformation FOLDpro_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1196119471.pdb -s /var/tmp/to_scwrl_1196119471.seq -o /var/tmp/from_scwrl_1196119471.pdb > /var/tmp/scwrl_1196119471.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1196119471.pdb # conformation set from SCWRL output # naming current conformation FOLDpro_TS2-scwrl # ReadConformPDB reading from PDB file servers/FOLDpro_TS3.pdb.gz looking for model 1 # Found a chain break before 224 # copying to AlignedFragments data structure # naming current conformation FOLDpro_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_978676831.pdb -s /var/tmp/to_scwrl_978676831.seq -o /var/tmp/from_scwrl_978676831.pdb > /var/tmp/scwrl_978676831.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_978676831.pdb # conformation set from SCWRL output # naming current conformation FOLDpro_TS3-scwrl # ReadConformPDB reading from PDB file servers/FOLDpro_TS4.pdb.gz looking for model 1 # naming current conformation FOLDpro_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_951629804.pdb -s /var/tmp/to_scwrl_951629804.seq -o /var/tmp/from_scwrl_951629804.pdb > /var/tmp/scwrl_951629804.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_951629804.pdb # conformation set from SCWRL output # naming current conformation FOLDpro_TS4-scwrl # ReadConformPDB reading from PDB file servers/FOLDpro_TS5.pdb.gz looking for model 1 # Found a chain break before 117 # copying to AlignedFragments data structure # naming current conformation FOLDpro_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_457979912.pdb -s /var/tmp/to_scwrl_457979912.seq -o /var/tmp/from_scwrl_457979912.pdb > /var/tmp/scwrl_457979912.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_457979912.pdb # conformation set from SCWRL output # naming current conformation FOLDpro_TS5-scwrl # ReadConformPDB reading from PDB file servers/FORTE1_AL1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation FORTE1_AL1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1500061717.pdb -s /var/tmp/to_scwrl_1500061717.seq -o /var/tmp/from_scwrl_1500061717.pdb > /var/tmp/scwrl_1500061717.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1500061717.pdb # conformation set from SCWRL output # naming current conformation FORTE1_AL1-scwrl # ReadConformPDB reading from PDB file servers/FORTE1_AL2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation FORTE1_AL2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_782754606.pdb -s /var/tmp/to_scwrl_782754606.seq -o /var/tmp/from_scwrl_782754606.pdb > /var/tmp/scwrl_782754606.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_782754606.pdb # conformation set from SCWRL output # naming current conformation FORTE1_AL2-scwrl # ReadConformPDB reading from PDB file servers/FORTE1_AL3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation FORTE1_AL3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1004234141.pdb -s /var/tmp/to_scwrl_1004234141.seq -o /var/tmp/from_scwrl_1004234141.pdb > /var/tmp/scwrl_1004234141.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1004234141.pdb # conformation set from SCWRL output # naming current conformation FORTE1_AL3-scwrl # ReadConformPDB reading from PDB file servers/FORTE1_AL4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation FORTE1_AL4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1831937279.pdb -s /var/tmp/to_scwrl_1831937279.seq -o /var/tmp/from_scwrl_1831937279.pdb > /var/tmp/scwrl_1831937279.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1831937279.pdb # conformation set from SCWRL output # naming current conformation FORTE1_AL4-scwrl # ReadConformPDB reading from PDB file servers/FORTE1_AL5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation FORTE1_AL5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_90541192.pdb -s /var/tmp/to_scwrl_90541192.seq -o /var/tmp/from_scwrl_90541192.pdb > /var/tmp/scwrl_90541192.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_90541192.pdb # conformation set from SCWRL output # naming current conformation FORTE1_AL5-scwrl # ReadConformPDB reading from PDB file servers/FORTE2_AL1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation FORTE2_AL1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_64267809.pdb -s /var/tmp/to_scwrl_64267809.seq -o /var/tmp/from_scwrl_64267809.pdb > /var/tmp/scwrl_64267809.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_64267809.pdb # conformation set from SCWRL output # naming current conformation FORTE2_AL1-scwrl # ReadConformPDB reading from PDB file servers/FORTE2_AL2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation FORTE2_AL2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_117907088.pdb -s /var/tmp/to_scwrl_117907088.seq -o /var/tmp/from_scwrl_117907088.pdb > /var/tmp/scwrl_117907088.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_117907088.pdb # conformation set from SCWRL output # naming current conformation FORTE2_AL2-scwrl # ReadConformPDB reading from PDB file servers/FORTE2_AL3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation FORTE2_AL3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_512283047.pdb -s /var/tmp/to_scwrl_512283047.seq -o /var/tmp/from_scwrl_512283047.pdb > /var/tmp/scwrl_512283047.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_512283047.pdb # conformation set from SCWRL output # naming current conformation FORTE2_AL3-scwrl # ReadConformPDB reading from PDB file servers/FORTE2_AL4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation FORTE2_AL4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1652065740.pdb -s /var/tmp/to_scwrl_1652065740.seq -o /var/tmp/from_scwrl_1652065740.pdb > /var/tmp/scwrl_1652065740.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1652065740.pdb # conformation set from SCWRL output # naming current conformation FORTE2_AL4-scwrl # ReadConformPDB reading from PDB file servers/FORTE2_AL5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation FORTE2_AL5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1039966628.pdb -s /var/tmp/to_scwrl_1039966628.seq -o /var/tmp/from_scwrl_1039966628.pdb > /var/tmp/scwrl_1039966628.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1039966628.pdb # conformation set from SCWRL output # naming current conformation FORTE2_AL5-scwrl # ReadConformPDB reading from PDB file servers/FPSOLVER-SERVER_TS1.pdb.gz looking for model 1 # Found a chain break before 176 # copying to AlignedFragments data structure # naming current conformation FPSOLVER-SERVER_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1664168680.pdb -s /var/tmp/to_scwrl_1664168680.seq -o /var/tmp/from_scwrl_1664168680.pdb > /var/tmp/scwrl_1664168680.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1664168680.pdb # conformation set from SCWRL output # naming current conformation FPSOLVER-SERVER_TS1-scwrl # ReadConformPDB reading from PDB file servers/FPSOLVER-SERVER_TS2.pdb.gz looking for model 1 # Found a chain break before 169 # copying to AlignedFragments data structure # naming current conformation FPSOLVER-SERVER_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1371478830.pdb -s /var/tmp/to_scwrl_1371478830.seq -o /var/tmp/from_scwrl_1371478830.pdb > /var/tmp/scwrl_1371478830.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1371478830.pdb # conformation set from SCWRL output # naming current conformation FPSOLVER-SERVER_TS2-scwrl # ReadConformPDB reading from PDB file servers/FPSOLVER-SERVER_TS3.pdb.gz looking for model 1 # Found a chain break before 205 # copying to AlignedFragments data structure # naming current conformation FPSOLVER-SERVER_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1946651238.pdb -s /var/tmp/to_scwrl_1946651238.seq -o /var/tmp/from_scwrl_1946651238.pdb > /var/tmp/scwrl_1946651238.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1946651238.pdb # conformation set from SCWRL output # naming current conformation FPSOLVER-SERVER_TS3-scwrl # ReadConformPDB reading from PDB file servers/FPSOLVER-SERVER_TS4.pdb.gz looking for model 1 # Found a chain break before 83 # copying to AlignedFragments data structure # naming current conformation FPSOLVER-SERVER_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1984579298.pdb -s /var/tmp/to_scwrl_1984579298.seq -o /var/tmp/from_scwrl_1984579298.pdb > /var/tmp/scwrl_1984579298.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1984579298.pdb # conformation set from SCWRL output # naming current conformation FPSOLVER-SERVER_TS4-scwrl # ReadConformPDB reading from PDB file servers/FPSOLVER-SERVER_TS5.pdb.gz looking for model 1 # Found a chain break before 192 # copying to AlignedFragments data structure # naming current conformation FPSOLVER-SERVER_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_539211129.pdb -s /var/tmp/to_scwrl_539211129.seq -o /var/tmp/from_scwrl_539211129.pdb > /var/tmp/scwrl_539211129.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_539211129.pdb # conformation set from SCWRL output # naming current conformation FPSOLVER-SERVER_TS5-scwrl # ReadConformPDB reading from PDB file servers/FUGUE_AL1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation FUGUE_AL1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_494518983.pdb -s /var/tmp/to_scwrl_494518983.seq -o /var/tmp/from_scwrl_494518983.pdb > /var/tmp/scwrl_494518983.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_494518983.pdb # conformation set from SCWRL output # naming current conformation FUGUE_AL1-scwrl # ReadConformPDB reading from PDB file servers/FUGUE_AL2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation FUGUE_AL2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_241848569.pdb -s /var/tmp/to_scwrl_241848569.seq -o /var/tmp/from_scwrl_241848569.pdb > /var/tmp/scwrl_241848569.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_241848569.pdb # conformation set from SCWRL output # naming current conformation FUGUE_AL2-scwrl # ReadConformPDB reading from PDB file servers/FUGUE_AL3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation FUGUE_AL3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_620049294.pdb -s /var/tmp/to_scwrl_620049294.seq -o /var/tmp/from_scwrl_620049294.pdb > /var/tmp/scwrl_620049294.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_620049294.pdb # conformation set from SCWRL output # naming current conformation FUGUE_AL3-scwrl # ReadConformPDB reading from PDB file servers/FUGUE_AL4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation FUGUE_AL4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_935867851.pdb -s /var/tmp/to_scwrl_935867851.seq -o /var/tmp/from_scwrl_935867851.pdb > /var/tmp/scwrl_935867851.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_935867851.pdb # conformation set from SCWRL output # naming current conformation FUGUE_AL4-scwrl # ReadConformPDB reading from PDB file servers/FUGUE_AL5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation FUGUE_AL5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_965293899.pdb -s /var/tmp/to_scwrl_965293899.seq -o /var/tmp/from_scwrl_965293899.pdb > /var/tmp/scwrl_965293899.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_965293899.pdb # conformation set from SCWRL output # naming current conformation FUGUE_AL5-scwrl # ReadConformPDB reading from PDB file servers/FUNCTION_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation FUNCTION_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1473989128.pdb -s /var/tmp/to_scwrl_1473989128.seq -o /var/tmp/from_scwrl_1473989128.pdb > /var/tmp/scwrl_1473989128.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1473989128.pdb # conformation set from SCWRL output # naming current conformation FUNCTION_TS1-scwrl # ReadConformPDB reading from PDB file servers/FUNCTION_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation FUNCTION_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1943082867.pdb -s /var/tmp/to_scwrl_1943082867.seq -o /var/tmp/from_scwrl_1943082867.pdb > /var/tmp/scwrl_1943082867.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1943082867.pdb # conformation set from SCWRL output # naming current conformation FUNCTION_TS2-scwrl # ReadConformPDB reading from PDB file servers/FUNCTION_TS3.pdb.gz looking for model 1 # Found a chain break before 223 # copying to AlignedFragments data structure # naming current conformation FUNCTION_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_703399185.pdb -s /var/tmp/to_scwrl_703399185.seq -o /var/tmp/from_scwrl_703399185.pdb > /var/tmp/scwrl_703399185.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_703399185.pdb # conformation set from SCWRL output # naming current conformation FUNCTION_TS3-scwrl # ReadConformPDB reading from PDB file servers/FUNCTION_TS4.pdb.gz looking for model 1 # Found a chain break before 223 # copying to AlignedFragments data structure # naming current conformation FUNCTION_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1694854025.pdb -s /var/tmp/to_scwrl_1694854025.seq -o /var/tmp/from_scwrl_1694854025.pdb > /var/tmp/scwrl_1694854025.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1694854025.pdb # conformation set from SCWRL output # naming current conformation FUNCTION_TS4-scwrl # ReadConformPDB reading from PDB file servers/FUNCTION_TS5.pdb.gz looking for model 1 # Found a chain break before 191 # copying to AlignedFragments data structure # naming current conformation FUNCTION_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1060935962.pdb -s /var/tmp/to_scwrl_1060935962.seq -o /var/tmp/from_scwrl_1060935962.pdb > /var/tmp/scwrl_1060935962.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1060935962.pdb # conformation set from SCWRL output # naming current conformation FUNCTION_TS5-scwrl # ReadConformPDB reading from PDB file servers/Frankenstein_TS1.pdb.gz looking for model 1 # Found a chain break before 111 # copying to AlignedFragments data structure # naming current conformation Frankenstein_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_678504938.pdb -s /var/tmp/to_scwrl_678504938.seq -o /var/tmp/from_scwrl_678504938.pdb > /var/tmp/scwrl_678504938.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_678504938.pdb # conformation set from SCWRL output # naming current conformation Frankenstein_TS1-scwrl # ReadConformPDB reading from PDB file servers/Frankenstein_TS2.pdb.gz looking for model 1 # Found a chain break before 153 # copying to AlignedFragments data structure # naming current conformation Frankenstein_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1093072586.pdb -s /var/tmp/to_scwrl_1093072586.seq -o /var/tmp/from_scwrl_1093072586.pdb > /var/tmp/scwrl_1093072586.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1093072586.pdb # conformation set from SCWRL output # naming current conformation Frankenstein_TS2-scwrl # ReadConformPDB reading from PDB file servers/Frankenstein_TS3.pdb.gz looking for model 1 # Found a chain break before 217 # copying to AlignedFragments data structure # naming current conformation Frankenstein_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_109571787.pdb -s /var/tmp/to_scwrl_109571787.seq -o /var/tmp/from_scwrl_109571787.pdb > /var/tmp/scwrl_109571787.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_109571787.pdb # conformation set from SCWRL output # naming current conformation Frankenstein_TS3-scwrl # ReadConformPDB reading from PDB file servers/Frankenstein_TS4.pdb.gz looking for model 1 # Found a chain break before 68 # copying to AlignedFragments data structure # naming current conformation Frankenstein_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1657181768.pdb -s /var/tmp/to_scwrl_1657181768.seq -o /var/tmp/from_scwrl_1657181768.pdb > /var/tmp/scwrl_1657181768.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1657181768.pdb # conformation set from SCWRL output # naming current conformation Frankenstein_TS4-scwrl # ReadConformPDB reading from PDB file servers/GeneSilicoMetaServer_TS1.pdb.gz looking for model 1 # Found a chain break before 105 # copying to AlignedFragments data structure # naming current conformation GeneSilicoMetaServer_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_2044702391.pdb -s /var/tmp/to_scwrl_2044702391.seq -o /var/tmp/from_scwrl_2044702391.pdb > /var/tmp/scwrl_2044702391.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2044702391.pdb # conformation set from SCWRL output # naming current conformation GeneSilicoMetaServer_TS1-scwrl # ReadConformPDB reading from PDB file servers/GeneSilicoMetaServer_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation GeneSilicoMetaServer_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_567551699.pdb -s /var/tmp/to_scwrl_567551699.seq -o /var/tmp/from_scwrl_567551699.pdb > /var/tmp/scwrl_567551699.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_567551699.pdb # conformation set from SCWRL output # naming current conformation GeneSilicoMetaServer_TS2-scwrl # ReadConformPDB reading from PDB file servers/GeneSilicoMetaServer_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation GeneSilicoMetaServer_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1009759839.pdb -s /var/tmp/to_scwrl_1009759839.seq -o /var/tmp/from_scwrl_1009759839.pdb > /var/tmp/scwrl_1009759839.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1009759839.pdb # conformation set from SCWRL output # naming current conformation GeneSilicoMetaServer_TS3-scwrl # ReadConformPDB reading from PDB file servers/GeneSilicoMetaServer_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation GeneSilicoMetaServer_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_679973350.pdb -s /var/tmp/to_scwrl_679973350.seq -o /var/tmp/from_scwrl_679973350.pdb > /var/tmp/scwrl_679973350.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_679973350.pdb # conformation set from SCWRL output # naming current conformation GeneSilicoMetaServer_TS4-scwrl # ReadConformPDB reading from PDB file servers/GeneSilicoMetaServer_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation GeneSilicoMetaServer_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1571785839.pdb -s /var/tmp/to_scwrl_1571785839.seq -o /var/tmp/from_scwrl_1571785839.pdb > /var/tmp/scwrl_1571785839.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1571785839.pdb # conformation set from SCWRL output # naming current conformation GeneSilicoMetaServer_TS5-scwrl # ReadConformPDB reading from PDB file servers/HHpred1_TS1.pdb.gz looking for model 1 # Found a chain break before 184 # copying to AlignedFragments data structure # naming current conformation HHpred1_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_694213471.pdb -s /var/tmp/to_scwrl_694213471.seq -o /var/tmp/from_scwrl_694213471.pdb > /var/tmp/scwrl_694213471.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_694213471.pdb # conformation set from SCWRL output # naming current conformation HHpred1_TS1-scwrl # ReadConformPDB reading from PDB file servers/HHpred2_TS1.pdb.gz looking for model 1 # Found a chain break before 82 # copying to AlignedFragments data structure # naming current conformation HHpred2_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_770514542.pdb -s /var/tmp/to_scwrl_770514542.seq -o /var/tmp/from_scwrl_770514542.pdb > /var/tmp/scwrl_770514542.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_770514542.pdb # conformation set from SCWRL output # naming current conformation HHpred2_TS1-scwrl # ReadConformPDB reading from PDB file servers/HHpred3_TS1.pdb.gz looking for model 1 # Found a chain break before 47 # copying to AlignedFragments data structure # naming current conformation HHpred3_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1636053648.pdb -s /var/tmp/to_scwrl_1636053648.seq -o /var/tmp/from_scwrl_1636053648.pdb > /var/tmp/scwrl_1636053648.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1636053648.pdb # conformation set from SCWRL output # naming current conformation HHpred3_TS1-scwrl # ReadConformPDB reading from PDB file servers/Huber-Torda-Server_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation Huber-Torda-Server_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_812120560.pdb -s /var/tmp/to_scwrl_812120560.seq -o /var/tmp/from_scwrl_812120560.pdb > /var/tmp/scwrl_812120560.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_812120560.pdb # conformation set from SCWRL output # naming current conformation Huber-Torda-Server_TS1-scwrl # ReadConformPDB reading from PDB file servers/Huber-Torda-Server_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation Huber-Torda-Server_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1282797588.pdb -s /var/tmp/to_scwrl_1282797588.seq -o /var/tmp/from_scwrl_1282797588.pdb > /var/tmp/scwrl_1282797588.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1282797588.pdb # conformation set from SCWRL output # naming current conformation Huber-Torda-Server_TS2-scwrl # ReadConformPDB reading from PDB file servers/Huber-Torda-Server_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation Huber-Torda-Server_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1140635742.pdb -s /var/tmp/to_scwrl_1140635742.seq -o /var/tmp/from_scwrl_1140635742.pdb > /var/tmp/scwrl_1140635742.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1140635742.pdb # conformation set from SCWRL output # naming current conformation Huber-Torda-Server_TS3-scwrl # ReadConformPDB reading from PDB file servers/Huber-Torda-Server_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation Huber-Torda-Server_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1852087187.pdb -s /var/tmp/to_scwrl_1852087187.seq -o /var/tmp/from_scwrl_1852087187.pdb > /var/tmp/scwrl_1852087187.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1852087187.pdb # conformation set from SCWRL output # naming current conformation Huber-Torda-Server_TS4-scwrl # ReadConformPDB reading from PDB file servers/Huber-Torda-Server_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation Huber-Torda-Server_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_799482622.pdb -s /var/tmp/to_scwrl_799482622.seq -o /var/tmp/from_scwrl_799482622.pdb > /var/tmp/scwrl_799482622.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_799482622.pdb # conformation set from SCWRL output # naming current conformation Huber-Torda-Server_TS5-scwrl # ReadConformPDB reading from PDB file servers/LOOPP_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation LOOPP_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_364630926.pdb -s /var/tmp/to_scwrl_364630926.seq -o /var/tmp/from_scwrl_364630926.pdb > /var/tmp/scwrl_364630926.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_364630926.pdb # conformation set from SCWRL output # naming current conformation LOOPP_TS1-scwrl # ReadConformPDB reading from PDB file servers/LOOPP_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation LOOPP_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1651254778.pdb -s /var/tmp/to_scwrl_1651254778.seq -o /var/tmp/from_scwrl_1651254778.pdb > /var/tmp/scwrl_1651254778.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1651254778.pdb # conformation set from SCWRL output # naming current conformation LOOPP_TS2-scwrl # ReadConformPDB reading from PDB file servers/LOOPP_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation LOOPP_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_636578273.pdb -s /var/tmp/to_scwrl_636578273.seq -o /var/tmp/from_scwrl_636578273.pdb > /var/tmp/scwrl_636578273.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_636578273.pdb # conformation set from SCWRL output # naming current conformation LOOPP_TS3-scwrl # ReadConformPDB reading from PDB file servers/LOOPP_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation LOOPP_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_903842055.pdb -s /var/tmp/to_scwrl_903842055.seq -o /var/tmp/from_scwrl_903842055.pdb > /var/tmp/scwrl_903842055.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_903842055.pdb # conformation set from SCWRL output # naming current conformation LOOPP_TS4-scwrl # ReadConformPDB reading from PDB file servers/LOOPP_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation LOOPP_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_2145773762.pdb -s /var/tmp/to_scwrl_2145773762.seq -o /var/tmp/from_scwrl_2145773762.pdb > /var/tmp/scwrl_2145773762.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2145773762.pdb # conformation set from SCWRL output # naming current conformation LOOPP_TS5-scwrl # ReadConformPDB reading from PDB file servers/MIG_FROST_AL1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation MIG_FROST_AL1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_878426843.pdb -s /var/tmp/to_scwrl_878426843.seq -o /var/tmp/from_scwrl_878426843.pdb > /var/tmp/scwrl_878426843.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_878426843.pdb # conformation set from SCWRL output # naming current conformation MIG_FROST_AL1-scwrl # ReadConformPDB reading from PDB file servers/Ma-OPUS-server2_TS1.pdb.gz looking for model 1 # Found a chain break before 145 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server2_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1523891349.pdb -s /var/tmp/to_scwrl_1523891349.seq -o /var/tmp/from_scwrl_1523891349.pdb > /var/tmp/scwrl_1523891349.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1523891349.pdb # conformation set from SCWRL output # naming current conformation Ma-OPUS-server2_TS1-scwrl # ReadConformPDB reading from PDB file servers/Ma-OPUS-server2_TS2.pdb.gz looking for model 1 # Found a chain break before 199 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server2_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_934157966.pdb -s /var/tmp/to_scwrl_934157966.seq -o /var/tmp/from_scwrl_934157966.pdb > /var/tmp/scwrl_934157966.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_934157966.pdb # conformation set from SCWRL output # naming current conformation Ma-OPUS-server2_TS2-scwrl # ReadConformPDB reading from PDB file servers/Ma-OPUS-server2_TS3.pdb.gz looking for model 1 # Found a chain break before 156 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server2_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1843720741.pdb -s /var/tmp/to_scwrl_1843720741.seq -o /var/tmp/from_scwrl_1843720741.pdb > /var/tmp/scwrl_1843720741.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1843720741.pdb # conformation set from SCWRL output # naming current conformation Ma-OPUS-server2_TS3-scwrl # ReadConformPDB reading from PDB file servers/Ma-OPUS-server2_TS4.pdb.gz looking for model 1 # Found a chain break before 219 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server2_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_850396831.pdb -s /var/tmp/to_scwrl_850396831.seq -o /var/tmp/from_scwrl_850396831.pdb > /var/tmp/scwrl_850396831.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_850396831.pdb # conformation set from SCWRL output # naming current conformation Ma-OPUS-server2_TS4-scwrl # ReadConformPDB reading from PDB file servers/Ma-OPUS-server2_TS5.pdb.gz looking for model 1 # Found a chain break before 176 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server2_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_729757186.pdb -s /var/tmp/to_scwrl_729757186.seq -o /var/tmp/from_scwrl_729757186.pdb > /var/tmp/scwrl_729757186.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_729757186.pdb # conformation set from SCWRL output # naming current conformation Ma-OPUS-server2_TS5-scwrl # ReadConformPDB reading from PDB file servers/Ma-OPUS-server_TS1.pdb.gz looking for model 1 # Found a chain break before 128 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_399636279.pdb -s /var/tmp/to_scwrl_399636279.seq -o /var/tmp/from_scwrl_399636279.pdb > /var/tmp/scwrl_399636279.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_399636279.pdb # conformation set from SCWRL output # naming current conformation Ma-OPUS-server_TS1-scwrl # ReadConformPDB reading from PDB file servers/Ma-OPUS-server_TS2.pdb.gz looking for model 1 # Found a chain break before 201 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_397767209.pdb -s /var/tmp/to_scwrl_397767209.seq -o /var/tmp/from_scwrl_397767209.pdb > /var/tmp/scwrl_397767209.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_397767209.pdb # conformation set from SCWRL output # naming current conformation Ma-OPUS-server_TS2-scwrl # ReadConformPDB reading from PDB file servers/Ma-OPUS-server_TS3.pdb.gz looking for model 1 # Found a chain break before 146 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1790693147.pdb -s /var/tmp/to_scwrl_1790693147.seq -o /var/tmp/from_scwrl_1790693147.pdb > /var/tmp/scwrl_1790693147.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1790693147.pdb # conformation set from SCWRL output # naming current conformation Ma-OPUS-server_TS3-scwrl # ReadConformPDB reading from PDB file servers/Ma-OPUS-server_TS4.pdb.gz looking for model 1 # Found a chain break before 219 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1078141217.pdb -s /var/tmp/to_scwrl_1078141217.seq -o /var/tmp/from_scwrl_1078141217.pdb > /var/tmp/scwrl_1078141217.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1078141217.pdb # conformation set from SCWRL output # naming current conformation Ma-OPUS-server_TS4-scwrl # ReadConformPDB reading from PDB file servers/Ma-OPUS-server_TS5.pdb.gz looking for model 1 # Found a chain break before 40 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1490839795.pdb -s /var/tmp/to_scwrl_1490839795.seq -o /var/tmp/from_scwrl_1490839795.pdb > /var/tmp/scwrl_1490839795.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1490839795.pdb # conformation set from SCWRL output # naming current conformation Ma-OPUS-server_TS5-scwrl # ReadConformPDB reading from PDB file servers/MetaTasser_TS1.pdb.gz looking for model 1 # Found a chain break before 151 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1900264934.pdb -s /var/tmp/to_scwrl_1900264934.seq -o /var/tmp/from_scwrl_1900264934.pdb > /var/tmp/scwrl_1900264934.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1900264934.pdb # conformation set from SCWRL output # naming current conformation MetaTasser_TS1-scwrl # ReadConformPDB reading from PDB file servers/MetaTasser_TS2.pdb.gz looking for model 1 # Found a chain break before 195 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_587839339.pdb -s /var/tmp/to_scwrl_587839339.seq -o /var/tmp/from_scwrl_587839339.pdb > /var/tmp/scwrl_587839339.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_587839339.pdb # conformation set from SCWRL output # naming current conformation MetaTasser_TS2-scwrl # ReadConformPDB reading from PDB file servers/MetaTasser_TS3.pdb.gz looking for model 1 # Found a chain break before 151 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1388058539.pdb -s /var/tmp/to_scwrl_1388058539.seq -o /var/tmp/from_scwrl_1388058539.pdb > /var/tmp/scwrl_1388058539.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1388058539.pdb # conformation set from SCWRL output # naming current conformation MetaTasser_TS3-scwrl # ReadConformPDB reading from PDB file servers/MetaTasser_TS4.pdb.gz looking for model 1 # Found a chain break before 150 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_320332987.pdb -s /var/tmp/to_scwrl_320332987.seq -o /var/tmp/from_scwrl_320332987.pdb > /var/tmp/scwrl_320332987.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_320332987.pdb # conformation set from SCWRL output # naming current conformation MetaTasser_TS4-scwrl # ReadConformPDB reading from PDB file servers/MetaTasser_TS5.pdb.gz looking for model 1 # Found a chain break before 182 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1597599178.pdb -s /var/tmp/to_scwrl_1597599178.seq -o /var/tmp/from_scwrl_1597599178.pdb > /var/tmp/scwrl_1597599178.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1597599178.pdb # conformation set from SCWRL output # naming current conformation MetaTasser_TS5-scwrl # ReadConformPDB reading from PDB file servers/NN_PUT_lab_TS1.pdb.gz looking for model 1 # Found a chain break before 74 # copying to AlignedFragments data structure # naming current conformation NN_PUT_lab_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_2068031889.pdb -s /var/tmp/to_scwrl_2068031889.seq -o /var/tmp/from_scwrl_2068031889.pdb > /var/tmp/scwrl_2068031889.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2068031889.pdb # conformation set from SCWRL output # naming current conformation NN_PUT_lab_TS1-scwrl # ReadConformPDB reading from PDB file servers/POMYSL_TS1.pdb.gz looking for model 1 # Found a chain break before 222 # copying to AlignedFragments data structure # naming current conformation POMYSL_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1892118826.pdb -s /var/tmp/to_scwrl_1892118826.seq -o /var/tmp/from_scwrl_1892118826.pdb > /var/tmp/scwrl_1892118826.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1892118826.pdb # conformation set from SCWRL output # naming current conformation POMYSL_TS1-scwrl # ReadConformPDB reading from PDB file servers/POMYSL_TS2.pdb.gz looking for model 1 WARNING: atom 1 has residue number 1 < previous residue 226 in servers/POMYSL_TS2.pdb.gz # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation POMYSL_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_144329002.pdb -s /var/tmp/to_scwrl_144329002.seq -o /var/tmp/from_scwrl_144329002.pdb > /var/tmp/scwrl_144329002.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_144329002.pdb # conformation set from SCWRL output # naming current conformation POMYSL_TS2-scwrl # ReadConformPDB reading from PDB file servers/POMYSL_TS3.pdb.gz looking for model 1 # Found a chain break before 224 # copying to AlignedFragments data structure # naming current conformation POMYSL_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_691062785.pdb -s /var/tmp/to_scwrl_691062785.seq -o /var/tmp/from_scwrl_691062785.pdb > /var/tmp/scwrl_691062785.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_691062785.pdb # conformation set from SCWRL output # naming current conformation POMYSL_TS3-scwrl # ReadConformPDB reading from PDB file servers/POMYSL_TS4.pdb.gz looking for model 1 # Found a chain break before 220 # copying to AlignedFragments data structure # naming current conformation POMYSL_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1380688828.pdb -s /var/tmp/to_scwrl_1380688828.seq -o /var/tmp/from_scwrl_1380688828.pdb > /var/tmp/scwrl_1380688828.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1380688828.pdb # conformation set from SCWRL output # naming current conformation POMYSL_TS4-scwrl # ReadConformPDB reading from PDB file servers/POMYSL_TS5.pdb.gz looking for model 1 WARNING: atom 1 has residue number 33 < previous residue 226 in servers/POMYSL_TS5.pdb.gz # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation POMYSL_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_956449562.pdb -s /var/tmp/to_scwrl_956449562.seq -o /var/tmp/from_scwrl_956449562.pdb > /var/tmp/scwrl_956449562.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_956449562.pdb # conformation set from SCWRL output # naming current conformation POMYSL_TS5-scwrl # ReadConformPDB reading from PDB file servers/PROTINFO-AB_TS1.pdb.gz looking for model 1 # naming current conformation PROTINFO-AB_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1973860373.pdb -s /var/tmp/to_scwrl_1973860373.seq -o /var/tmp/from_scwrl_1973860373.pdb > /var/tmp/scwrl_1973860373.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1973860373.pdb # conformation set from SCWRL output # naming current conformation PROTINFO-AB_TS1-scwrl # ReadConformPDB reading from PDB file servers/PROTINFO-AB_TS2.pdb.gz looking for model 1 # naming current conformation PROTINFO-AB_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_373840924.pdb -s /var/tmp/to_scwrl_373840924.seq -o /var/tmp/from_scwrl_373840924.pdb > /var/tmp/scwrl_373840924.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_373840924.pdb # conformation set from SCWRL output # naming current conformation PROTINFO-AB_TS2-scwrl # ReadConformPDB reading from PDB file servers/PROTINFO-AB_TS3.pdb.gz looking for model 1 # naming current conformation PROTINFO-AB_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_661053103.pdb -s /var/tmp/to_scwrl_661053103.seq -o /var/tmp/from_scwrl_661053103.pdb > /var/tmp/scwrl_661053103.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_661053103.pdb # conformation set from SCWRL output # naming current conformation PROTINFO-AB_TS3-scwrl # ReadConformPDB reading from PDB file servers/PROTINFO-AB_TS4.pdb.gz looking for model 1 # naming current conformation PROTINFO-AB_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_625859349.pdb -s /var/tmp/to_scwrl_625859349.seq -o /var/tmp/from_scwrl_625859349.pdb > /var/tmp/scwrl_625859349.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_625859349.pdb # conformation set from SCWRL output # naming current conformation PROTINFO-AB_TS4-scwrl # ReadConformPDB reading from PDB file servers/PROTINFO-AB_TS5.pdb.gz looking for model 1 # naming current conformation PROTINFO-AB_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_738471850.pdb -s /var/tmp/to_scwrl_738471850.seq -o /var/tmp/from_scwrl_738471850.pdb > /var/tmp/scwrl_738471850.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_738471850.pdb # conformation set from SCWRL output # naming current conformation PROTINFO-AB_TS5-scwrl # ReadConformPDB reading from PDB file servers/PROTINFO_TS1.pdb.gz looking for model 1 # Found a chain break before 193 # copying to AlignedFragments data structure # naming current conformation PROTINFO_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_164824234.pdb -s /var/tmp/to_scwrl_164824234.seq -o /var/tmp/from_scwrl_164824234.pdb > /var/tmp/scwrl_164824234.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_164824234.pdb # conformation set from SCWRL output # naming current conformation PROTINFO_TS1-scwrl # ReadConformPDB reading from PDB file servers/PROTINFO_TS2.pdb.gz looking for model 1 # naming current conformation PROTINFO_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1262437621.pdb -s /var/tmp/to_scwrl_1262437621.seq -o /var/tmp/from_scwrl_1262437621.pdb > /var/tmp/scwrl_1262437621.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1262437621.pdb # conformation set from SCWRL output # naming current conformation PROTINFO_TS2-scwrl # ReadConformPDB reading from PDB file servers/PROTINFO_TS3.pdb.gz looking for model 1 # naming current conformation PROTINFO_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1642313905.pdb -s /var/tmp/to_scwrl_1642313905.seq -o /var/tmp/from_scwrl_1642313905.pdb > /var/tmp/scwrl_1642313905.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1642313905.pdb # conformation set from SCWRL output # naming current conformation PROTINFO_TS3-scwrl # ReadConformPDB reading from PDB file servers/PROTINFO_TS4.pdb.gz looking for model 1 # naming current conformation PROTINFO_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_163114349.pdb -s /var/tmp/to_scwrl_163114349.seq -o /var/tmp/from_scwrl_163114349.pdb > /var/tmp/scwrl_163114349.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_163114349.pdb # conformation set from SCWRL output # naming current conformation PROTINFO_TS4-scwrl # ReadConformPDB reading from PDB file servers/PROTINFO_TS5.pdb.gz looking for model 1 # naming current conformation PROTINFO_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_2140864464.pdb -s /var/tmp/to_scwrl_2140864464.seq -o /var/tmp/from_scwrl_2140864464.pdb > /var/tmp/scwrl_2140864464.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2140864464.pdb # conformation set from SCWRL output # naming current conformation PROTINFO_TS5-scwrl # ReadConformPDB reading from PDB file servers/Pcons6_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation Pcons6_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1018721608.pdb -s /var/tmp/to_scwrl_1018721608.seq -o /var/tmp/from_scwrl_1018721608.pdb > /var/tmp/scwrl_1018721608.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1018721608.pdb # conformation set from SCWRL output # naming current conformation Pcons6_TS1-scwrl # ReadConformPDB reading from PDB file servers/Pcons6_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation Pcons6_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1097272314.pdb -s /var/tmp/to_scwrl_1097272314.seq -o /var/tmp/from_scwrl_1097272314.pdb > /var/tmp/scwrl_1097272314.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1097272314.pdb # conformation set from SCWRL output # naming current conformation Pcons6_TS2-scwrl # ReadConformPDB reading from PDB file servers/Pcons6_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation Pcons6_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1837101558.pdb -s /var/tmp/to_scwrl_1837101558.seq -o /var/tmp/from_scwrl_1837101558.pdb > /var/tmp/scwrl_1837101558.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1837101558.pdb # conformation set from SCWRL output # naming current conformation Pcons6_TS3-scwrl # ReadConformPDB reading from PDB file servers/Pcons6_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation Pcons6_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1869118438.pdb -s /var/tmp/to_scwrl_1869118438.seq -o /var/tmp/from_scwrl_1869118438.pdb > /var/tmp/scwrl_1869118438.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1869118438.pdb # conformation set from SCWRL output # naming current conformation Pcons6_TS4-scwrl # ReadConformPDB reading from PDB file servers/Pcons6_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation Pcons6_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1827029500.pdb -s /var/tmp/to_scwrl_1827029500.seq -o /var/tmp/from_scwrl_1827029500.pdb > /var/tmp/scwrl_1827029500.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1827029500.pdb # conformation set from SCWRL output # naming current conformation Pcons6_TS5-scwrl # ReadConformPDB reading from PDB file servers/Phyre-1_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation Phyre-1_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_89254191.pdb -s /var/tmp/to_scwrl_89254191.seq -o /var/tmp/from_scwrl_89254191.pdb > /var/tmp/scwrl_89254191.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_89254191.pdb # conformation set from SCWRL output # naming current conformation Phyre-1_TS1-scwrl # ReadConformPDB reading from PDB file servers/Phyre-2_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation Phyre-2_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_119402000.pdb -s /var/tmp/to_scwrl_119402000.seq -o /var/tmp/from_scwrl_119402000.pdb > /var/tmp/scwrl_119402000.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_119402000.pdb # conformation set from SCWRL output # naming current conformation Phyre-2_TS1-scwrl # ReadConformPDB reading from PDB file servers/Phyre-2_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation Phyre-2_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1470239001.pdb -s /var/tmp/to_scwrl_1470239001.seq -o /var/tmp/from_scwrl_1470239001.pdb > /var/tmp/scwrl_1470239001.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1470239001.pdb # conformation set from SCWRL output # naming current conformation Phyre-2_TS2-scwrl # ReadConformPDB reading from PDB file servers/Phyre-2_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation Phyre-2_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1167395408.pdb -s /var/tmp/to_scwrl_1167395408.seq -o /var/tmp/from_scwrl_1167395408.pdb > /var/tmp/scwrl_1167395408.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1167395408.pdb # conformation set from SCWRL output # naming current conformation Phyre-2_TS3-scwrl # ReadConformPDB reading from PDB file servers/Phyre-2_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation Phyre-2_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1610241795.pdb -s /var/tmp/to_scwrl_1610241795.seq -o /var/tmp/from_scwrl_1610241795.pdb > /var/tmp/scwrl_1610241795.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1610241795.pdb # conformation set from SCWRL output # naming current conformation Phyre-2_TS4-scwrl # ReadConformPDB reading from PDB file servers/Phyre-2_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation Phyre-2_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1223020288.pdb -s /var/tmp/to_scwrl_1223020288.seq -o /var/tmp/from_scwrl_1223020288.pdb > /var/tmp/scwrl_1223020288.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1223020288.pdb # conformation set from SCWRL output # naming current conformation Phyre-2_TS5-scwrl # ReadConformPDB reading from PDB file servers/Pmodeller6_TS1.pdb.gz looking for model 1 # Found a chain break before 153 # copying to AlignedFragments data structure # naming current conformation Pmodeller6_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1755234747.pdb -s /var/tmp/to_scwrl_1755234747.seq -o /var/tmp/from_scwrl_1755234747.pdb > /var/tmp/scwrl_1755234747.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1755234747.pdb # conformation set from SCWRL output # naming current conformation Pmodeller6_TS1-scwrl # ReadConformPDB reading from PDB file servers/Pmodeller6_TS2.pdb.gz looking for model 1 # Found a chain break before 142 # copying to AlignedFragments data structure # naming current conformation Pmodeller6_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_850816689.pdb -s /var/tmp/to_scwrl_850816689.seq -o /var/tmp/from_scwrl_850816689.pdb > /var/tmp/scwrl_850816689.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_850816689.pdb # conformation set from SCWRL output # naming current conformation Pmodeller6_TS2-scwrl # ReadConformPDB reading from PDB file servers/Pmodeller6_TS3.pdb.gz looking for model 1 # Found a chain break before 190 # copying to AlignedFragments data structure # naming current conformation Pmodeller6_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1543353275.pdb -s /var/tmp/to_scwrl_1543353275.seq -o /var/tmp/from_scwrl_1543353275.pdb > /var/tmp/scwrl_1543353275.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1543353275.pdb # conformation set from SCWRL output # naming current conformation Pmodeller6_TS3-scwrl # ReadConformPDB reading from PDB file servers/Pmodeller6_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation Pmodeller6_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1205350278.pdb -s /var/tmp/to_scwrl_1205350278.seq -o /var/tmp/from_scwrl_1205350278.pdb > /var/tmp/scwrl_1205350278.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1205350278.pdb # conformation set from SCWRL output # naming current conformation Pmodeller6_TS4-scwrl # ReadConformPDB reading from PDB file servers/Pmodeller6_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation Pmodeller6_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_771364931.pdb -s /var/tmp/to_scwrl_771364931.seq -o /var/tmp/from_scwrl_771364931.pdb > /var/tmp/scwrl_771364931.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_771364931.pdb # conformation set from SCWRL output # naming current conformation Pmodeller6_TS5-scwrl # ReadConformPDB reading from PDB file servers/RAPTOR-ACE_TS1.pdb.gz looking for model 1 # Found a chain break before 158 # copying to AlignedFragments data structure # naming current conformation RAPTOR-ACE_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1287988455.pdb -s /var/tmp/to_scwrl_1287988455.seq -o /var/tmp/from_scwrl_1287988455.pdb > /var/tmp/scwrl_1287988455.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1287988455.pdb # conformation set from SCWRL output # naming current conformation RAPTOR-ACE_TS1-scwrl # ReadConformPDB reading from PDB file servers/RAPTOR-ACE_TS2.pdb.gz looking for model 1 # Found a chain break before 222 # copying to AlignedFragments data structure # naming current conformation RAPTOR-ACE_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1349679281.pdb -s /var/tmp/to_scwrl_1349679281.seq -o /var/tmp/from_scwrl_1349679281.pdb > /var/tmp/scwrl_1349679281.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1349679281.pdb # conformation set from SCWRL output # naming current conformation RAPTOR-ACE_TS2-scwrl # ReadConformPDB reading from PDB file servers/RAPTOR-ACE_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation RAPTOR-ACE_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1462427715.pdb -s /var/tmp/to_scwrl_1462427715.seq -o /var/tmp/from_scwrl_1462427715.pdb > /var/tmp/scwrl_1462427715.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1462427715.pdb # conformation set from SCWRL output # naming current conformation RAPTOR-ACE_TS3-scwrl # ReadConformPDB reading from PDB file servers/RAPTOR-ACE_TS4.pdb.gz looking for model 1 # Found a chain break before 197 # copying to AlignedFragments data structure # naming current conformation RAPTOR-ACE_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_521193637.pdb -s /var/tmp/to_scwrl_521193637.seq -o /var/tmp/from_scwrl_521193637.pdb > /var/tmp/scwrl_521193637.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_521193637.pdb # conformation set from SCWRL output # naming current conformation RAPTOR-ACE_TS4-scwrl # ReadConformPDB reading from PDB file servers/RAPTOR-ACE_TS5.pdb.gz looking for model 1 # naming current conformation RAPTOR-ACE_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_158645196.pdb -s /var/tmp/to_scwrl_158645196.seq -o /var/tmp/from_scwrl_158645196.pdb > /var/tmp/scwrl_158645196.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_158645196.pdb # conformation set from SCWRL output # naming current conformation RAPTOR-ACE_TS5-scwrl # ReadConformPDB reading from PDB file servers/RAPTORESS_TS1.pdb.gz looking for model 1 # Found a chain break before 9 # copying to AlignedFragments data structure # naming current conformation RAPTORESS_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1288804442.pdb -s /var/tmp/to_scwrl_1288804442.seq -o /var/tmp/from_scwrl_1288804442.pdb > /var/tmp/scwrl_1288804442.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1288804442.pdb # conformation set from SCWRL output # naming current conformation RAPTORESS_TS1-scwrl # ReadConformPDB reading from PDB file servers/RAPTORESS_TS2.pdb.gz looking for model 1 # naming current conformation RAPTORESS_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_895034561.pdb -s /var/tmp/to_scwrl_895034561.seq -o /var/tmp/from_scwrl_895034561.pdb > /var/tmp/scwrl_895034561.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_895034561.pdb # conformation set from SCWRL output # naming current conformation RAPTORESS_TS2-scwrl # ReadConformPDB reading from PDB file servers/RAPTORESS_TS3.pdb.gz looking for model 1 # Found a chain break before 83 # copying to AlignedFragments data structure # naming current conformation RAPTORESS_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_819698299.pdb -s /var/tmp/to_scwrl_819698299.seq -o /var/tmp/from_scwrl_819698299.pdb > /var/tmp/scwrl_819698299.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_819698299.pdb # conformation set from SCWRL output # naming current conformation RAPTORESS_TS3-scwrl # ReadConformPDB reading from PDB file servers/RAPTORESS_TS4.pdb.gz looking for model 1 # Found a chain break before 9 # copying to AlignedFragments data structure # naming current conformation RAPTORESS_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1914663791.pdb -s /var/tmp/to_scwrl_1914663791.seq -o /var/tmp/from_scwrl_1914663791.pdb > /var/tmp/scwrl_1914663791.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1914663791.pdb # conformation set from SCWRL output # naming current conformation RAPTORESS_TS4-scwrl # ReadConformPDB reading from PDB file servers/RAPTORESS_TS5.pdb.gz looking for model 1 # naming current conformation RAPTORESS_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1633506410.pdb -s /var/tmp/to_scwrl_1633506410.seq -o /var/tmp/from_scwrl_1633506410.pdb > /var/tmp/scwrl_1633506410.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1633506410.pdb # conformation set from SCWRL output # naming current conformation RAPTORESS_TS5-scwrl # ReadConformPDB reading from PDB file servers/RAPTOR_TS1.pdb.gz looking for model 1 # Found a chain break before 80 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_984522534.pdb -s /var/tmp/to_scwrl_984522534.seq -o /var/tmp/from_scwrl_984522534.pdb > /var/tmp/scwrl_984522534.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_984522534.pdb # conformation set from SCWRL output # naming current conformation RAPTOR_TS1-scwrl # ReadConformPDB reading from PDB file servers/RAPTOR_TS2.pdb.gz looking for model 1 # Found a chain break before 162 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1029617766.pdb -s /var/tmp/to_scwrl_1029617766.seq -o /var/tmp/from_scwrl_1029617766.pdb > /var/tmp/scwrl_1029617766.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1029617766.pdb # conformation set from SCWRL output # naming current conformation RAPTOR_TS2-scwrl # ReadConformPDB reading from PDB file servers/RAPTOR_TS3.pdb.gz looking for model 1 # Found a chain break before 184 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1128336668.pdb -s /var/tmp/to_scwrl_1128336668.seq -o /var/tmp/from_scwrl_1128336668.pdb > /var/tmp/scwrl_1128336668.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1128336668.pdb # conformation set from SCWRL output # naming current conformation RAPTOR_TS3-scwrl # ReadConformPDB reading from PDB file servers/RAPTOR_TS4.pdb.gz looking for model 1 # Found a chain break before 80 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1147636882.pdb -s /var/tmp/to_scwrl_1147636882.seq -o /var/tmp/from_scwrl_1147636882.pdb > /var/tmp/scwrl_1147636882.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1147636882.pdb # conformation set from SCWRL output # naming current conformation RAPTOR_TS4-scwrl # ReadConformPDB reading from PDB file servers/RAPTOR_TS5.pdb.gz looking for model 1 # Found a chain break before 142 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1022998584.pdb -s /var/tmp/to_scwrl_1022998584.seq -o /var/tmp/from_scwrl_1022998584.pdb > /var/tmp/scwrl_1022998584.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1022998584.pdb # conformation set from SCWRL output # naming current conformation RAPTOR_TS5-scwrl # ReadConformPDB reading from PDB file servers/ROBETTA_TS1.pdb.gz looking for model 1 # Found a chain break before 156 # copying to AlignedFragments data structure # naming current conformation ROBETTA_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_2147058276.pdb -s /var/tmp/to_scwrl_2147058276.seq -o /var/tmp/from_scwrl_2147058276.pdb > /var/tmp/scwrl_2147058276.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2147058276.pdb # conformation set from SCWRL output # naming current conformation ROBETTA_TS1-scwrl # ReadConformPDB reading from PDB file servers/ROBETTA_TS2.pdb.gz looking for model 1 # Found a chain break before 78 # copying to AlignedFragments data structure # naming current conformation ROBETTA_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_97425551.pdb -s /var/tmp/to_scwrl_97425551.seq -o /var/tmp/from_scwrl_97425551.pdb > /var/tmp/scwrl_97425551.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_97425551.pdb # conformation set from SCWRL output # naming current conformation ROBETTA_TS2-scwrl # ReadConformPDB reading from PDB file servers/ROBETTA_TS3.pdb.gz looking for model 1 # Found a chain break before 190 # copying to AlignedFragments data structure # naming current conformation ROBETTA_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_712616495.pdb -s /var/tmp/to_scwrl_712616495.seq -o /var/tmp/from_scwrl_712616495.pdb > /var/tmp/scwrl_712616495.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_712616495.pdb # conformation set from SCWRL output # naming current conformation ROBETTA_TS3-scwrl # ReadConformPDB reading from PDB file servers/ROBETTA_TS4.pdb.gz looking for model 1 # Found a chain break before 153 # copying to AlignedFragments data structure # naming current conformation ROBETTA_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1868693067.pdb -s /var/tmp/to_scwrl_1868693067.seq -o /var/tmp/from_scwrl_1868693067.pdb > /var/tmp/scwrl_1868693067.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1868693067.pdb # conformation set from SCWRL output # naming current conformation ROBETTA_TS4-scwrl # ReadConformPDB reading from PDB file servers/ROBETTA_TS5.pdb.gz looking for model 1 # Found a chain break before 142 # copying to AlignedFragments data structure # naming current conformation ROBETTA_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1924455051.pdb -s /var/tmp/to_scwrl_1924455051.seq -o /var/tmp/from_scwrl_1924455051.pdb > /var/tmp/scwrl_1924455051.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1924455051.pdb # conformation set from SCWRL output # naming current conformation ROBETTA_TS5-scwrl # ReadConformPDB reading from PDB file servers/ROKKY_TS1.pdb.gz looking for model 1 # Found a chain break before 186 # copying to AlignedFragments data structure # naming current conformation ROKKY_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_801870686.pdb -s /var/tmp/to_scwrl_801870686.seq -o /var/tmp/from_scwrl_801870686.pdb > /var/tmp/scwrl_801870686.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_801870686.pdb # conformation set from SCWRL output # naming current conformation ROKKY_TS1-scwrl # ReadConformPDB reading from PDB file servers/ROKKY_TS2.pdb.gz looking for model 1 # Found a chain break before 183 # copying to AlignedFragments data structure # naming current conformation ROKKY_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1988095067.pdb -s /var/tmp/to_scwrl_1988095067.seq -o /var/tmp/from_scwrl_1988095067.pdb > /var/tmp/scwrl_1988095067.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1988095067.pdb # conformation set from SCWRL output # naming current conformation ROKKY_TS2-scwrl # ReadConformPDB reading from PDB file servers/ROKKY_TS3.pdb.gz looking for model 1 # Found a chain break before 195 # copying to AlignedFragments data structure # naming current conformation ROKKY_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1247210405.pdb -s /var/tmp/to_scwrl_1247210405.seq -o /var/tmp/from_scwrl_1247210405.pdb > /var/tmp/scwrl_1247210405.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1247210405.pdb # conformation set from SCWRL output # naming current conformation ROKKY_TS3-scwrl # ReadConformPDB reading from PDB file servers/ROKKY_TS4.pdb.gz looking for model 1 # Found a chain break before 184 # copying to AlignedFragments data structure # naming current conformation ROKKY_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1969266094.pdb -s /var/tmp/to_scwrl_1969266094.seq -o /var/tmp/from_scwrl_1969266094.pdb > /var/tmp/scwrl_1969266094.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1969266094.pdb # conformation set from SCWRL output # naming current conformation ROKKY_TS4-scwrl # ReadConformPDB reading from PDB file servers/ROKKY_TS5.pdb.gz looking for model 1 # Found a chain break before 187 # copying to AlignedFragments data structure # naming current conformation ROKKY_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1450853216.pdb -s /var/tmp/to_scwrl_1450853216.seq -o /var/tmp/from_scwrl_1450853216.pdb > /var/tmp/scwrl_1450853216.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1450853216.pdb # conformation set from SCWRL output # naming current conformation ROKKY_TS5-scwrl # ReadConformPDB reading from PDB file servers/SAM-T02_AL1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_322747048.pdb -s /var/tmp/to_scwrl_322747048.seq -o /var/tmp/from_scwrl_322747048.pdb > /var/tmp/scwrl_322747048.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_322747048.pdb # conformation set from SCWRL output # naming current conformation SAM-T02_AL1-scwrl # ReadConformPDB reading from PDB file servers/SAM-T02_AL2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1577017195.pdb -s /var/tmp/to_scwrl_1577017195.seq -o /var/tmp/from_scwrl_1577017195.pdb > /var/tmp/scwrl_1577017195.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1577017195.pdb # conformation set from SCWRL output # naming current conformation SAM-T02_AL2-scwrl # ReadConformPDB reading from PDB file servers/SAM-T02_AL3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_154186258.pdb -s /var/tmp/to_scwrl_154186258.seq -o /var/tmp/from_scwrl_154186258.pdb > /var/tmp/scwrl_154186258.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_154186258.pdb # conformation set from SCWRL output # naming current conformation SAM-T02_AL3-scwrl # ReadConformPDB reading from PDB file servers/SAM-T02_AL4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1866100323.pdb -s /var/tmp/to_scwrl_1866100323.seq -o /var/tmp/from_scwrl_1866100323.pdb > /var/tmp/scwrl_1866100323.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1866100323.pdb # conformation set from SCWRL output # naming current conformation SAM-T02_AL4-scwrl # ReadConformPDB reading from PDB file servers/SAM-T02_AL5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_634883827.pdb -s /var/tmp/to_scwrl_634883827.seq -o /var/tmp/from_scwrl_634883827.pdb > /var/tmp/scwrl_634883827.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_634883827.pdb # conformation set from SCWRL output # naming current conformation SAM-T02_AL5-scwrl # ReadConformPDB reading from PDB file servers/SAM-T99_AL1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation SAM-T99_AL1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_925551189.pdb -s /var/tmp/to_scwrl_925551189.seq -o /var/tmp/from_scwrl_925551189.pdb > /var/tmp/scwrl_925551189.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_925551189.pdb # conformation set from SCWRL output # naming current conformation SAM-T99_AL1-scwrl # ReadConformPDB reading from PDB file servers/SAM-T99_AL2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation SAM-T99_AL2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1006605132.pdb -s /var/tmp/to_scwrl_1006605132.seq -o /var/tmp/from_scwrl_1006605132.pdb > /var/tmp/scwrl_1006605132.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1006605132.pdb # conformation set from SCWRL output # naming current conformation SAM-T99_AL2-scwrl # ReadConformPDB reading from PDB file servers/SAM-T99_AL3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation SAM-T99_AL3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1984563108.pdb -s /var/tmp/to_scwrl_1984563108.seq -o /var/tmp/from_scwrl_1984563108.pdb > /var/tmp/scwrl_1984563108.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1984563108.pdb # conformation set from SCWRL output # naming current conformation SAM-T99_AL3-scwrl # ReadConformPDB reading from PDB file servers/SAM-T99_AL4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation SAM-T99_AL4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_240495258.pdb -s /var/tmp/to_scwrl_240495258.seq -o /var/tmp/from_scwrl_240495258.pdb > /var/tmp/scwrl_240495258.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_240495258.pdb # conformation set from SCWRL output # naming current conformation SAM-T99_AL4-scwrl # ReadConformPDB reading from PDB file servers/SAM-T99_AL5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation SAM-T99_AL5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1527798768.pdb -s /var/tmp/to_scwrl_1527798768.seq -o /var/tmp/from_scwrl_1527798768.pdb > /var/tmp/scwrl_1527798768.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1527798768.pdb # conformation set from SCWRL output # naming current conformation SAM-T99_AL5-scwrl # ReadConformPDB reading from PDB file servers/SAM_T06_server_TS1.pdb.gz looking for model 1 # Found a chain break before 190 # copying to AlignedFragments data structure # naming current conformation SAM_T06_server_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_2143208305.pdb -s /var/tmp/to_scwrl_2143208305.seq -o /var/tmp/from_scwrl_2143208305.pdb > /var/tmp/scwrl_2143208305.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2143208305.pdb # conformation set from SCWRL output # naming current conformation SAM_T06_server_TS1-scwrl # ReadConformPDB reading from PDB file servers/SAM_T06_server_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation SAM_T06_server_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1529299700.pdb -s /var/tmp/to_scwrl_1529299700.seq -o /var/tmp/from_scwrl_1529299700.pdb > /var/tmp/scwrl_1529299700.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1529299700.pdb # conformation set from SCWRL output # naming current conformation SAM_T06_server_TS2-scwrl # ReadConformPDB reading from PDB file servers/SAM_T06_server_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation SAM_T06_server_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_275349682.pdb -s /var/tmp/to_scwrl_275349682.seq -o /var/tmp/from_scwrl_275349682.pdb > /var/tmp/scwrl_275349682.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_275349682.pdb # conformation set from SCWRL output # naming current conformation SAM_T06_server_TS3-scwrl # ReadConformPDB reading from PDB file servers/SAM_T06_server_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation SAM_T06_server_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_815422957.pdb -s /var/tmp/to_scwrl_815422957.seq -o /var/tmp/from_scwrl_815422957.pdb > /var/tmp/scwrl_815422957.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_815422957.pdb # conformation set from SCWRL output # naming current conformation SAM_T06_server_TS4-scwrl # ReadConformPDB reading from PDB file servers/SAM_T06_server_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation SAM_T06_server_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1296479844.pdb -s /var/tmp/to_scwrl_1296479844.seq -o /var/tmp/from_scwrl_1296479844.pdb > /var/tmp/scwrl_1296479844.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1296479844.pdb # conformation set from SCWRL output # naming current conformation SAM_T06_server_TS5-scwrl # ReadConformPDB reading from PDB file servers/SP3_TS1.pdb.gz looking for model 1 # Found a chain break before 222 # copying to AlignedFragments data structure # naming current conformation SP3_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1908856093.pdb -s /var/tmp/to_scwrl_1908856093.seq -o /var/tmp/from_scwrl_1908856093.pdb > /var/tmp/scwrl_1908856093.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1908856093.pdb # conformation set from SCWRL output # naming current conformation SP3_TS1-scwrl # ReadConformPDB reading from PDB file servers/SP3_TS2.pdb.gz looking for model 1 # Found a chain break before 158 # copying to AlignedFragments data structure # naming current conformation SP3_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1799945490.pdb -s /var/tmp/to_scwrl_1799945490.seq -o /var/tmp/from_scwrl_1799945490.pdb > /var/tmp/scwrl_1799945490.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1799945490.pdb # conformation set from SCWRL output # naming current conformation SP3_TS2-scwrl # ReadConformPDB reading from PDB file servers/SP3_TS3.pdb.gz looking for model 1 # Found a chain break before 198 # copying to AlignedFragments data structure # naming current conformation SP3_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_178613963.pdb -s /var/tmp/to_scwrl_178613963.seq -o /var/tmp/from_scwrl_178613963.pdb > /var/tmp/scwrl_178613963.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_178613963.pdb # conformation set from SCWRL output # naming current conformation SP3_TS3-scwrl # ReadConformPDB reading from PDB file servers/SP3_TS4.pdb.gz looking for model 1 # Found a chain break before 74 # copying to AlignedFragments data structure # naming current conformation SP3_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_889709115.pdb -s /var/tmp/to_scwrl_889709115.seq -o /var/tmp/from_scwrl_889709115.pdb > /var/tmp/scwrl_889709115.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_889709115.pdb # conformation set from SCWRL output # naming current conformation SP3_TS4-scwrl # ReadConformPDB reading from PDB file servers/SP3_TS5.pdb.gz looking for model 1 # naming current conformation SP3_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_800098727.pdb -s /var/tmp/to_scwrl_800098727.seq -o /var/tmp/from_scwrl_800098727.pdb > /var/tmp/scwrl_800098727.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_800098727.pdb # conformation set from SCWRL output # naming current conformation SP3_TS5-scwrl # ReadConformPDB reading from PDB file servers/SP4_TS1.pdb.gz looking for model 1 # Found a chain break before 142 # copying to AlignedFragments data structure # naming current conformation SP4_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1201612546.pdb -s /var/tmp/to_scwrl_1201612546.seq -o /var/tmp/from_scwrl_1201612546.pdb > /var/tmp/scwrl_1201612546.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1201612546.pdb # conformation set from SCWRL output # naming current conformation SP4_TS1-scwrl # ReadConformPDB reading from PDB file servers/SP4_TS2.pdb.gz looking for model 1 # Found a chain break before 75 # copying to AlignedFragments data structure # naming current conformation SP4_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_889283745.pdb -s /var/tmp/to_scwrl_889283745.seq -o /var/tmp/from_scwrl_889283745.pdb > /var/tmp/scwrl_889283745.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_889283745.pdb # conformation set from SCWRL output # naming current conformation SP4_TS2-scwrl # ReadConformPDB reading from PDB file servers/SP4_TS3.pdb.gz looking for model 1 # Found a chain break before 152 # copying to AlignedFragments data structure # naming current conformation SP4_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_897524278.pdb -s /var/tmp/to_scwrl_897524278.seq -o /var/tmp/from_scwrl_897524278.pdb > /var/tmp/scwrl_897524278.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_897524278.pdb # conformation set from SCWRL output # naming current conformation SP4_TS3-scwrl # ReadConformPDB reading from PDB file servers/SP4_TS4.pdb.gz looking for model 1 # Found a chain break before 197 # copying to AlignedFragments data structure # naming current conformation SP4_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1914229042.pdb -s /var/tmp/to_scwrl_1914229042.seq -o /var/tmp/from_scwrl_1914229042.pdb > /var/tmp/scwrl_1914229042.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1914229042.pdb # conformation set from SCWRL output # naming current conformation SP4_TS4-scwrl # ReadConformPDB reading from PDB file servers/SP4_TS5.pdb.gz looking for model 1 # naming current conformation SP4_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_610493165.pdb -s /var/tmp/to_scwrl_610493165.seq -o /var/tmp/from_scwrl_610493165.pdb > /var/tmp/scwrl_610493165.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_610493165.pdb # conformation set from SCWRL output # naming current conformation SP4_TS5-scwrl # ReadConformPDB reading from PDB file servers/SPARKS2_TS1.pdb.gz looking for model 1 # Found a chain break before 74 # copying to AlignedFragments data structure # naming current conformation SPARKS2_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_674495682.pdb -s /var/tmp/to_scwrl_674495682.seq -o /var/tmp/from_scwrl_674495682.pdb > /var/tmp/scwrl_674495682.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_674495682.pdb # conformation set from SCWRL output # naming current conformation SPARKS2_TS1-scwrl # ReadConformPDB reading from PDB file servers/SPARKS2_TS2.pdb.gz looking for model 1 # Found a chain break before 160 # copying to AlignedFragments data structure # naming current conformation SPARKS2_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_568616081.pdb -s /var/tmp/to_scwrl_568616081.seq -o /var/tmp/from_scwrl_568616081.pdb > /var/tmp/scwrl_568616081.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_568616081.pdb # conformation set from SCWRL output # naming current conformation SPARKS2_TS2-scwrl # ReadConformPDB reading from PDB file servers/SPARKS2_TS3.pdb.gz looking for model 1 # naming current conformation SPARKS2_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_451104586.pdb -s /var/tmp/to_scwrl_451104586.seq -o /var/tmp/from_scwrl_451104586.pdb > /var/tmp/scwrl_451104586.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_451104586.pdb # conformation set from SCWRL output # naming current conformation SPARKS2_TS3-scwrl # ReadConformPDB reading from PDB file servers/SPARKS2_TS4.pdb.gz looking for model 1 # Found a chain break before 72 # copying to AlignedFragments data structure # naming current conformation SPARKS2_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1921706088.pdb -s /var/tmp/to_scwrl_1921706088.seq -o /var/tmp/from_scwrl_1921706088.pdb > /var/tmp/scwrl_1921706088.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1921706088.pdb # conformation set from SCWRL output # naming current conformation SPARKS2_TS4-scwrl # ReadConformPDB reading from PDB file servers/SPARKS2_TS5.pdb.gz looking for model 1 # naming current conformation SPARKS2_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_390398529.pdb -s /var/tmp/to_scwrl_390398529.seq -o /var/tmp/from_scwrl_390398529.pdb > /var/tmp/scwrl_390398529.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_390398529.pdb # conformation set from SCWRL output # naming current conformation SPARKS2_TS5-scwrl # ReadConformPDB reading from PDB file servers/UNI-EID_bnmx_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation UNI-EID_bnmx_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1901957802.pdb -s /var/tmp/to_scwrl_1901957802.seq -o /var/tmp/from_scwrl_1901957802.pdb > /var/tmp/scwrl_1901957802.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1901957802.pdb # conformation set from SCWRL output # naming current conformation UNI-EID_bnmx_TS1-scwrl # ReadConformPDB reading from PDB file servers/UNI-EID_bnmx_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation UNI-EID_bnmx_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_96969489.pdb -s /var/tmp/to_scwrl_96969489.seq -o /var/tmp/from_scwrl_96969489.pdb > /var/tmp/scwrl_96969489.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_96969489.pdb # conformation set from SCWRL output # naming current conformation UNI-EID_bnmx_TS2-scwrl # ReadConformPDB reading from PDB file servers/UNI-EID_bnmx_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation UNI-EID_bnmx_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1967415724.pdb -s /var/tmp/to_scwrl_1967415724.seq -o /var/tmp/from_scwrl_1967415724.pdb > /var/tmp/scwrl_1967415724.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1967415724.pdb # conformation set from SCWRL output # naming current conformation UNI-EID_bnmx_TS3-scwrl # ReadConformPDB reading from PDB file servers/UNI-EID_bnmx_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation UNI-EID_bnmx_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_2056144060.pdb -s /var/tmp/to_scwrl_2056144060.seq -o /var/tmp/from_scwrl_2056144060.pdb > /var/tmp/scwrl_2056144060.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2056144060.pdb # conformation set from SCWRL output # naming current conformation UNI-EID_bnmx_TS4-scwrl # ReadConformPDB reading from PDB file servers/UNI-EID_expm_TS1.pdb.gz looking for model 1 WARNING: atoms too close: (T0365)E141.CA and (T0365)A148.CA only 0.000 apart, marking (T0365)E141.CA as missing WARNING: atoms too close: (T0365)L142.CA and (T0365)G149.CA only 0.000 apart, marking (T0365)L142.CA as missing WARNING: atoms too close: (T0365)D143.CA and (T0365)F150.CA only 0.000 apart, marking (T0365)F150.CA as missing # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation UNI-EID_expm_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1963069812.pdb -s /var/tmp/to_scwrl_1963069812.seq -o /var/tmp/from_scwrl_1963069812.pdb > /var/tmp/scwrl_1963069812.log Error: Couldn't open file /var/tmp/from_scwrl_1963069812.pdb or /var/tmp/from_scwrl_1963069812.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1963069812_b.pdb or decoys//var/tmp/from_scwrl_1963069812_b.pdb.gz for input Trying /var/tmp/from_scwrl_1963069812_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1963069812_b.pdb or /var/tmp/from_scwrl_1963069812_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1963069812_a.pdb or decoys//var/tmp/from_scwrl_1963069812_a.pdb.gz for input Trying /var/tmp/from_scwrl_1963069812_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1963069812_a.pdb or /var/tmp/from_scwrl_1963069812_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1963069812.pdb or /var/tmp/from_scwrl_1963069812_b.pdb or /var/tmp/from_scwrl_1963069812_a.pdb Error: no new SCWRL conformation added # naming current conformation UNI-EID_expm_TS1-scwrl # ReadConformPDB reading from PDB file servers/UNI-EID_sfst_AL1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation UNI-EID_sfst_AL1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_454815904.pdb -s /var/tmp/to_scwrl_454815904.seq -o /var/tmp/from_scwrl_454815904.pdb > /var/tmp/scwrl_454815904.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_454815904.pdb # conformation set from SCWRL output # naming current conformation UNI-EID_sfst_AL1-scwrl # ReadConformPDB reading from PDB file servers/UNI-EID_sfst_AL2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation UNI-EID_sfst_AL2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_834211602.pdb -s /var/tmp/to_scwrl_834211602.seq -o /var/tmp/from_scwrl_834211602.pdb > /var/tmp/scwrl_834211602.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_834211602.pdb # conformation set from SCWRL output # naming current conformation UNI-EID_sfst_AL2-scwrl # ReadConformPDB reading from PDB file servers/UNI-EID_sfst_AL3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation UNI-EID_sfst_AL3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_822191298.pdb -s /var/tmp/to_scwrl_822191298.seq -o /var/tmp/from_scwrl_822191298.pdb > /var/tmp/scwrl_822191298.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_822191298.pdb # conformation set from SCWRL output # naming current conformation UNI-EID_sfst_AL3-scwrl # ReadConformPDB reading from PDB file servers/UNI-EID_sfst_AL4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation UNI-EID_sfst_AL4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_291895366.pdb -s /var/tmp/to_scwrl_291895366.seq -o /var/tmp/from_scwrl_291895366.pdb > /var/tmp/scwrl_291895366.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_291895366.pdb # conformation set from SCWRL output # naming current conformation UNI-EID_sfst_AL4-scwrl # ReadConformPDB reading from PDB file servers/Zhang-Server_TS1.pdb.gz looking for model 1 # Found a chain break before 152 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1074706859.pdb -s /var/tmp/to_scwrl_1074706859.seq -o /var/tmp/from_scwrl_1074706859.pdb > /var/tmp/scwrl_1074706859.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1074706859.pdb # conformation set from SCWRL output # naming current conformation Zhang-Server_TS1-scwrl # ReadConformPDB reading from PDB file servers/Zhang-Server_TS2.pdb.gz looking for model 1 # Found a chain break before 2 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_202506419.pdb -s /var/tmp/to_scwrl_202506419.seq -o /var/tmp/from_scwrl_202506419.pdb > /var/tmp/scwrl_202506419.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_202506419.pdb # conformation set from SCWRL output # naming current conformation Zhang-Server_TS2-scwrl # ReadConformPDB reading from PDB file servers/Zhang-Server_TS3.pdb.gz looking for model 1 # Found a chain break before 191 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_287620024.pdb -s /var/tmp/to_scwrl_287620024.seq -o /var/tmp/from_scwrl_287620024.pdb > /var/tmp/scwrl_287620024.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_287620024.pdb # conformation set from SCWRL output # naming current conformation Zhang-Server_TS3-scwrl # ReadConformPDB reading from PDB file servers/Zhang-Server_TS4.pdb.gz looking for model 1 # Found a chain break before 153 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_456522913.pdb -s /var/tmp/to_scwrl_456522913.seq -o /var/tmp/from_scwrl_456522913.pdb > /var/tmp/scwrl_456522913.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_456522913.pdb # conformation set from SCWRL output # naming current conformation Zhang-Server_TS4-scwrl # ReadConformPDB reading from PDB file servers/Zhang-Server_TS5.pdb.gz looking for model 1 # Found a chain break before 152 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_477856102.pdb -s /var/tmp/to_scwrl_477856102.seq -o /var/tmp/from_scwrl_477856102.pdb > /var/tmp/scwrl_477856102.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_477856102.pdb # conformation set from SCWRL output # naming current conformation Zhang-Server_TS5-scwrl # ReadConformPDB reading from PDB file servers/beautshot_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation beautshot_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1103042980.pdb -s /var/tmp/to_scwrl_1103042980.seq -o /var/tmp/from_scwrl_1103042980.pdb > /var/tmp/scwrl_1103042980.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1103042980.pdb # conformation set from SCWRL output # naming current conformation beautshot_TS1-scwrl # ReadConformPDB reading from PDB file servers/beautshotbase_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation beautshotbase_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1753002757.pdb -s /var/tmp/to_scwrl_1753002757.seq -o /var/tmp/from_scwrl_1753002757.pdb > /var/tmp/scwrl_1753002757.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1753002757.pdb # conformation set from SCWRL output # naming current conformation beautshotbase_TS1-scwrl # ReadConformPDB reading from PDB file servers/forecast-s_AL1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation forecast-s_AL1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_239228548.pdb -s /var/tmp/to_scwrl_239228548.seq -o /var/tmp/from_scwrl_239228548.pdb > /var/tmp/scwrl_239228548.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_239228548.pdb # conformation set from SCWRL output # naming current conformation forecast-s_AL1-scwrl # ReadConformPDB reading from PDB file servers/forecast-s_AL2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation forecast-s_AL2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_755504825.pdb -s /var/tmp/to_scwrl_755504825.seq -o /var/tmp/from_scwrl_755504825.pdb > /var/tmp/scwrl_755504825.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_755504825.pdb # conformation set from SCWRL output # naming current conformation forecast-s_AL2-scwrl # ReadConformPDB reading from PDB file servers/forecast-s_AL3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation forecast-s_AL3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1931616721.pdb -s /var/tmp/to_scwrl_1931616721.seq -o /var/tmp/from_scwrl_1931616721.pdb > /var/tmp/scwrl_1931616721.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1931616721.pdb # conformation set from SCWRL output # naming current conformation forecast-s_AL3-scwrl # ReadConformPDB reading from PDB file servers/forecast-s_AL4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation forecast-s_AL4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1128937662.pdb -s /var/tmp/to_scwrl_1128937662.seq -o /var/tmp/from_scwrl_1128937662.pdb > /var/tmp/scwrl_1128937662.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1128937662.pdb # conformation set from SCWRL output # naming current conformation forecast-s_AL4-scwrl # ReadConformPDB reading from PDB file servers/forecast-s_AL5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation forecast-s_AL5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1555603551.pdb -s /var/tmp/to_scwrl_1555603551.seq -o /var/tmp/from_scwrl_1555603551.pdb > /var/tmp/scwrl_1555603551.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1555603551.pdb # conformation set from SCWRL output # naming current conformation forecast-s_AL5-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv.2_TS1.pdb.gz looking for model 1 # Found a chain break before 16 # copying to AlignedFragments data structure # naming current conformation karypis.srv.2_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_985745621.pdb -s /var/tmp/to_scwrl_985745621.seq -o /var/tmp/from_scwrl_985745621.pdb > /var/tmp/scwrl_985745621.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_985745621.pdb # conformation set from SCWRL output # naming current conformation karypis.srv.2_TS1-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv.2_TS2.pdb.gz looking for model 1 # Found a chain break before 175 # copying to AlignedFragments data structure # naming current conformation karypis.srv.2_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_2018221407.pdb -s /var/tmp/to_scwrl_2018221407.seq -o /var/tmp/from_scwrl_2018221407.pdb > /var/tmp/scwrl_2018221407.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2018221407.pdb # conformation set from SCWRL output # naming current conformation karypis.srv.2_TS2-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv.2_TS3.pdb.gz looking for model 1 # naming current conformation karypis.srv.2_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_305644182.pdb -s /var/tmp/to_scwrl_305644182.seq -o /var/tmp/from_scwrl_305644182.pdb > /var/tmp/scwrl_305644182.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_305644182.pdb # conformation set from SCWRL output # naming current conformation karypis.srv.2_TS3-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv.2_TS4.pdb.gz looking for model 1 # Found a chain break before 164 # copying to AlignedFragments data structure # naming current conformation karypis.srv.2_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_752491016.pdb -s /var/tmp/to_scwrl_752491016.seq -o /var/tmp/from_scwrl_752491016.pdb > /var/tmp/scwrl_752491016.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_752491016.pdb # conformation set from SCWRL output # naming current conformation karypis.srv.2_TS4-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv.2_TS5.pdb.gz looking for model 1 # Found a chain break before 144 # copying to AlignedFragments data structure # naming current conformation karypis.srv.2_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_481230926.pdb -s /var/tmp/to_scwrl_481230926.seq -o /var/tmp/from_scwrl_481230926.pdb > /var/tmp/scwrl_481230926.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_481230926.pdb # conformation set from SCWRL output # naming current conformation karypis.srv.2_TS5-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv.4_TS1.pdb.gz looking for model 1 # Found a chain break before 223 # copying to AlignedFragments data structure # naming current conformation karypis.srv.4_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_980139864.pdb -s /var/tmp/to_scwrl_980139864.seq -o /var/tmp/from_scwrl_980139864.pdb > /var/tmp/scwrl_980139864.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_980139864.pdb # conformation set from SCWRL output # naming current conformation karypis.srv.4_TS1-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv.4_TS2.pdb.gz looking for model 1 # Found a chain break before 223 # copying to AlignedFragments data structure # naming current conformation karypis.srv.4_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1321107097.pdb -s /var/tmp/to_scwrl_1321107097.seq -o /var/tmp/from_scwrl_1321107097.pdb > /var/tmp/scwrl_1321107097.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1321107097.pdb # conformation set from SCWRL output # naming current conformation karypis.srv.4_TS2-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv.4_TS3.pdb.gz looking for model 1 WARNING: atoms too close: (T0365)D84.O and (T0365)L85.N only 0.000 apart, marking (T0365)L85.N as missing # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation karypis.srv.4_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_932335512.pdb -s /var/tmp/to_scwrl_932335512.seq -o /var/tmp/from_scwrl_932335512.pdb > /var/tmp/scwrl_932335512.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_932335512.pdb # conformation set from SCWRL output # naming current conformation karypis.srv.4_TS3-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv.4_TS4.pdb.gz looking for model 1 WARNING: atoms too close: (T0365)R66.O and (T0365)E67.N only 0.000 apart, marking (T0365)E67.N as missing # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation karypis.srv.4_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_754362305.pdb -s /var/tmp/to_scwrl_754362305.seq -o /var/tmp/from_scwrl_754362305.pdb > /var/tmp/scwrl_754362305.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_754362305.pdb # conformation set from SCWRL output # naming current conformation karypis.srv.4_TS4-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv.4_TS5.pdb.gz looking for model 1 WARNING: atoms too close: (T0365)D45.O and (T0365)D46.N only 0.000 apart, marking (T0365)D46.N as missing # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation karypis.srv.4_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1711505626.pdb -s /var/tmp/to_scwrl_1711505626.seq -o /var/tmp/from_scwrl_1711505626.pdb > /var/tmp/scwrl_1711505626.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1711505626.pdb # conformation set from SCWRL output # naming current conformation karypis.srv.4_TS5-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation karypis.srv_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_686809667.pdb -s /var/tmp/to_scwrl_686809667.seq -o /var/tmp/from_scwrl_686809667.pdb > /var/tmp/scwrl_686809667.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_686809667.pdb # conformation set from SCWRL output # naming current conformation karypis.srv_TS1-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation karypis.srv_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_851331794.pdb -s /var/tmp/to_scwrl_851331794.seq -o /var/tmp/from_scwrl_851331794.pdb > /var/tmp/scwrl_851331794.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_851331794.pdb # conformation set from SCWRL output # naming current conformation karypis.srv_TS2-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation karypis.srv_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1531437703.pdb -s /var/tmp/to_scwrl_1531437703.seq -o /var/tmp/from_scwrl_1531437703.pdb > /var/tmp/scwrl_1531437703.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1531437703.pdb # conformation set from SCWRL output # naming current conformation karypis.srv_TS3-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation karypis.srv_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_595470080.pdb -s /var/tmp/to_scwrl_595470080.seq -o /var/tmp/from_scwrl_595470080.pdb > /var/tmp/scwrl_595470080.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_595470080.pdb # conformation set from SCWRL output # naming current conformation karypis.srv_TS4-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation karypis.srv_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_666917960.pdb -s /var/tmp/to_scwrl_666917960.seq -o /var/tmp/from_scwrl_666917960.pdb > /var/tmp/scwrl_666917960.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_666917960.pdb # conformation set from SCWRL output # naming current conformation karypis.srv_TS5-scwrl # ReadConformPDB reading from PDB file servers/keasar-server_TS1.pdb.gz looking for model 1 # naming current conformation keasar-server_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1986253607.pdb -s /var/tmp/to_scwrl_1986253607.seq -o /var/tmp/from_scwrl_1986253607.pdb > /var/tmp/scwrl_1986253607.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1986253607.pdb # conformation set from SCWRL output # naming current conformation keasar-server_TS1-scwrl # ReadConformPDB reading from PDB file servers/keasar-server_TS2.pdb.gz looking for model 1 # naming current conformation keasar-server_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1429681681.pdb -s /var/tmp/to_scwrl_1429681681.seq -o /var/tmp/from_scwrl_1429681681.pdb > /var/tmp/scwrl_1429681681.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1429681681.pdb # conformation set from SCWRL output # naming current conformation keasar-server_TS2-scwrl # ReadConformPDB reading from PDB file servers/keasar-server_TS3.pdb.gz looking for model 1 # naming current conformation keasar-server_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1489109257.pdb -s /var/tmp/to_scwrl_1489109257.seq -o /var/tmp/from_scwrl_1489109257.pdb > /var/tmp/scwrl_1489109257.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1489109257.pdb # conformation set from SCWRL output # naming current conformation keasar-server_TS3-scwrl # ReadConformPDB reading from PDB file servers/keasar-server_TS4.pdb.gz looking for model 1 # naming current conformation keasar-server_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_130665326.pdb -s /var/tmp/to_scwrl_130665326.seq -o /var/tmp/from_scwrl_130665326.pdb > /var/tmp/scwrl_130665326.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_130665326.pdb # conformation set from SCWRL output # naming current conformation keasar-server_TS4-scwrl # ReadConformPDB reading from PDB file servers/keasar-server_TS5.pdb.gz looking for model 1 # naming current conformation keasar-server_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_356904895.pdb -s /var/tmp/to_scwrl_356904895.seq -o /var/tmp/from_scwrl_356904895.pdb > /var/tmp/scwrl_356904895.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_356904895.pdb # conformation set from SCWRL output # naming current conformation keasar-server_TS5-scwrl # ReadConformPDB reading from PDB file servers/mGen-3D_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation mGen-3D_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1691615676.pdb -s /var/tmp/to_scwrl_1691615676.seq -o /var/tmp/from_scwrl_1691615676.pdb > /var/tmp/scwrl_1691615676.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1691615676.pdb # conformation set from SCWRL output # naming current conformation mGen-3D_TS1-scwrl # ReadConformPDB reading from PDB file servers/nFOLD_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation nFOLD_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_418285350.pdb -s /var/tmp/to_scwrl_418285350.seq -o /var/tmp/from_scwrl_418285350.pdb > /var/tmp/scwrl_418285350.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_418285350.pdb # conformation set from SCWRL output # naming current conformation nFOLD_TS1-scwrl # ReadConformPDB reading from PDB file servers/nFOLD_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation nFOLD_TS2 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_813427808.pdb -s /var/tmp/to_scwrl_813427808.seq -o /var/tmp/from_scwrl_813427808.pdb > /var/tmp/scwrl_813427808.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_813427808.pdb # conformation set from SCWRL output # naming current conformation nFOLD_TS2-scwrl # ReadConformPDB reading from PDB file servers/nFOLD_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation nFOLD_TS3 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_21988131.pdb -s /var/tmp/to_scwrl_21988131.seq -o /var/tmp/from_scwrl_21988131.pdb > /var/tmp/scwrl_21988131.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_21988131.pdb # conformation set from SCWRL output # naming current conformation nFOLD_TS3-scwrl # ReadConformPDB reading from PDB file servers/nFOLD_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation nFOLD_TS4 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_1521328331.pdb -s /var/tmp/to_scwrl_1521328331.seq -o /var/tmp/from_scwrl_1521328331.pdb > /var/tmp/scwrl_1521328331.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1521328331.pdb # conformation set from SCWRL output # naming current conformation nFOLD_TS4-scwrl # ReadConformPDB reading from PDB file servers/nFOLD_TS5.pdb.gz looking for model 1 WARNING: atom 1 has residue number 9 < previous residue 226 in servers/nFOLD_TS5.pdb.gz # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation nFOLD_TS5 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_418946919.pdb -s /var/tmp/to_scwrl_418946919.seq -o /var/tmp/from_scwrl_418946919.pdb > /var/tmp/scwrl_418946919.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_418946919.pdb # conformation set from SCWRL output # naming current conformation nFOLD_TS5-scwrl # ReadConformPDB reading from PDB file servers/shub_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0365 can't currently be optimized by undertaker # naming current conformation shub_TS1 # request to SCWRL produces command: ulimit -t 204 ; scwrl3 -i /var/tmp/to_scwrl_261216679.pdb -s /var/tmp/to_scwrl_261216679.seq -o /var/tmp/from_scwrl_261216679.pdb > /var/tmp/scwrl_261216679.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_261216679.pdb # conformation set from SCWRL output # naming current conformation shub_TS1-scwrl # command:CPU_time= 86.629 sec, elapsed time= 2159.345 sec. # command:# Prefix for output files set to decoys/ # command:# Will now start reporting costs to decoys/evaluate.anglevector.rdb # command:# CostConform Warning: Couldn't open file decoys//projects/compbio/experiments/undertaker/spots/near-backbone-center.spot or decoys//projects/compbio/experiments/undertaker/spots/near-backbone-center.spot.gz for input Trying /projects/compbio/experiments/undertaker/spots/near-backbone-center.spot # Reading spots from /projects/compbio/experiments/undertaker/spots/near-backbone-center.spot shub_TS1-scwrl costs 68.972 real_cost = 6.896 shub_TS1 costs 68.998 real_cost = 14.332 nFOLD_TS5-scwrl costs 96.763 real_cost = 408.720 nFOLD_TS5 costs 96.752 real_cost = 478.742 nFOLD_TS4-scwrl costs 51.389 real_cost = 264.812 nFOLD_TS4 costs 51.386 real_cost = 357.580 nFOLD_TS3-scwrl costs 64.754 real_cost = 144.498 nFOLD_TS3 costs 64.666 real_cost = 227.028 nFOLD_TS2-scwrl costs 69.671 real_cost = 160.538 nFOLD_TS2 costs 69.808 real_cost = 249.452 nFOLD_TS1-scwrl costs 71.371 real_cost = 167.689 nFOLD_TS1 costs 71.322 real_cost = 250.607 mGen-3D_TS1-scwrl costs 48.835 real_cost = 2.612 mGen-3D_TS1 costs 48.762 real_cost = 106.541 keasar-server_TS5-scwrl costs 64.248 real_cost = 98.467 keasar-server_TS5 costs 64.248 real_cost = 103.736 keasar-server_TS4-scwrl costs 58.328 real_cost = 211.922 keasar-server_TS4 costs 58.328 real_cost = 217.904 keasar-server_TS3-scwrl costs 76.801 real_cost = 107.109 keasar-server_TS3 costs 76.801 real_cost = 110.984 keasar-server_TS2-scwrl costs 48.393 real_cost = -80.281 keasar-server_TS2 costs 48.393 real_cost = -69.533 keasar-server_TS1-scwrl costs 48.817 real_cost = -48.615 keasar-server_TS1 costs 48.817 real_cost = -41.098 karypis.srv_TS5-scwrl costs 67.051 real_cost = 235.918 karypis.srv_TS5 costs 67.056 real_cost = 235.093 karypis.srv_TS4-scwrl costs 83.683 real_cost = 302.801 karypis.srv_TS4 costs 83.571 real_cost = 299.889 karypis.srv_TS3-scwrl costs 65.369 real_cost = 203.417 karypis.srv_TS3 costs 65.398 real_cost = 200.080 karypis.srv_TS2-scwrl costs 72.898 real_cost = 215.948 karypis.srv_TS2 costs 72.907 real_cost = 213.597 karypis.srv_TS1-scwrl costs 56.695 real_cost = -29.923 karypis.srv_TS1 costs 56.684 real_cost = -33.318 karypis.srv.4_TS5-scwrl costs 103.615 real_cost = 232.610 karypis.srv.4_TS5 costs 103.615 real_cost = 231.344 karypis.srv.4_TS4-scwrl costs 117.046 real_cost = 241.695 karypis.srv.4_TS4 costs 117.046 real_cost = 241.705 karypis.srv.4_TS3-scwrl costs 145.044 real_cost = 289.982 karypis.srv.4_TS3 costs 145.044 real_cost = 290.377 karypis.srv.4_TS2-scwrl costs 137.440 real_cost = 287.303 karypis.srv.4_TS2 costs 137.440 real_cost = 287.303 karypis.srv.4_TS1-scwrl costs 160.836 real_cost = 259.893 karypis.srv.4_TS1 costs 160.836 real_cost = 259.890 karypis.srv.2_TS5-scwrl costs 93.339 real_cost = 272.648 karypis.srv.2_TS5 costs 93.339 real_cost = 272.642 karypis.srv.2_TS4-scwrl costs 80.047 real_cost = 246.900 karypis.srv.2_TS4 costs 80.047 real_cost = 247.841 karypis.srv.2_TS3-scwrl costs 94.041 real_cost = 244.641 karypis.srv.2_TS3 costs 94.041 real_cost = 244.641 karypis.srv.2_TS2-scwrl costs 86.265 real_cost = 257.343 karypis.srv.2_TS2 costs 86.265 real_cost = 255.391 karypis.srv.2_TS1-scwrl costs 92.684 real_cost = 251.429 karypis.srv.2_TS1 costs 92.684 real_cost = 251.849 forecast-s_AL5-scwrl costs 125.116 real_cost = 299.750 forecast-s_AL5 costs 125.130 real_cost = 445.151 forecast-s_AL4-scwrl costs 126.654 real_cost = 566.033 forecast-s_AL4 costs 126.704 real_cost = 586.447 forecast-s_AL3-scwrl costs 129.759 real_cost = 452.430 forecast-s_AL3 costs 129.790 real_cost = 544.600 forecast-s_AL2-scwrl costs 136.658 real_cost = 340.618 forecast-s_AL2 costs 136.612 real_cost = 470.927 forecast-s_AL1-scwrl costs 135.767 real_cost = 330.473 forecast-s_AL1 costs 135.727 real_cost = 469.307 beautshotbase_TS1-scwrl costs 49.568 real_cost = -29.128 beautshotbase_TS1 costs 49.556 real_cost = -32.132 beautshot_TS1-scwrl costs 60.919 real_cost = -13.489 beautshot_TS1 costs 60.882 real_cost = -4.179 Zhang-Server_TS5-scwrl costs 24.461 real_cost = -129.259 Zhang-Server_TS5 costs 24.461 real_cost = -129.259 Zhang-Server_TS4-scwrl costs 29.208 real_cost = -123.469 Zhang-Server_TS4 costs 29.208 real_cost = -123.469 Zhang-Server_TS3-scwrl costs 32.040 real_cost = -83.943 Zhang-Server_TS3 costs 32.040 real_cost = -84.368 Zhang-Server_TS2-scwrl costs 25.997 real_cost = -151.812 Zhang-Server_TS2 costs 25.997 real_cost = -151.837 Zhang-Server_TS1-scwrl costs 30.202 real_cost = -141.205 Zhang-Server_TS1 costs 30.202 real_cost = -141.205 UNI-EID_sfst_AL4-scwrl costs 76.782 real_cost = 314.913 UNI-EID_sfst_AL4 costs 76.770 real_cost = 370.880 UNI-EID_sfst_AL3-scwrl costs 49.964 real_cost = 39.209 UNI-EID_sfst_AL3 costs 49.976 real_cost = 164.074 UNI-EID_sfst_AL2-scwrl costs 52.925 real_cost = 24.159 UNI-EID_sfst_AL2 costs 52.904 real_cost = 129.638 UNI-EID_sfst_AL1-scwrl costs 51.572 real_cost = 17.864 UNI-EID_sfst_AL1 costs 51.600 real_cost = 152.640 UNI-EID_expm_TS1-scwrl costs 69.051 real_cost = 102.756 UNI-EID_bnmx_TS4-scwrl costs 80.986 real_cost = 251.436 UNI-EID_bnmx_TS4 costs 80.974 real_cost = 381.854 UNI-EID_bnmx_TS3-scwrl costs 45.866 real_cost = 17.217 UNI-EID_bnmx_TS3 costs 45.908 real_cost = 157.005 UNI-EID_bnmx_TS2-scwrl costs 44.297 real_cost = -7.351 UNI-EID_bnmx_TS2 costs 44.362 real_cost = 127.529 UNI-EID_bnmx_TS1-scwrl costs 49.517 real_cost = -9.592 UNI-EID_bnmx_TS1 costs 49.555 real_cost = 135.024 SPARKS2_TS5-scwrl costs 90.169 real_cost = 201.434 SPARKS2_TS5 costs 90.169 real_cost = 200.163 SPARKS2_TS4-scwrl costs 97.132 real_cost = 240.724 SPARKS2_TS4 costs 97.132 real_cost = 242.939 SPARKS2_TS3-scwrl costs 42.217 real_cost = -54.843 SPARKS2_TS3 costs 42.217 real_cost = -50.038 SPARKS2_TS2-scwrl costs 50.684 real_cost = -83.151 SPARKS2_TS2 costs 50.684 real_cost = -79.529 SPARKS2_TS1-scwrl costs 50.070 real_cost = -28.687 SPARKS2_TS1 costs 50.070 real_cost = -28.698 SP4_TS5-scwrl costs 60.425 real_cost = 173.165 SP4_TS5 costs 60.425 real_cost = 178.318 SP4_TS4-scwrl costs 37.727 real_cost = 168.407 SP4_TS4 costs 37.727 real_cost = 177.044 SP4_TS3-scwrl costs 61.868 real_cost = 39.428 SP4_TS3 costs 61.868 real_cost = 47.219 SP4_TS2-scwrl costs 44.839 real_cost = -22.286 SP4_TS2 costs 44.839 real_cost = -22.256 SP4_TS1-scwrl costs 49.788 real_cost = -62.871 SP4_TS1 costs 49.788 real_cost = -56.634 SP3_TS5-scwrl costs 38.552 real_cost = 173.155 SP3_TS5 costs 38.552 real_cost = 178.374 SP3_TS4-scwrl costs 54.385 real_cost = -28.603 SP3_TS4 costs 54.385 real_cost = -30.123 SP3_TS3-scwrl costs 39.660 real_cost = 145.624 SP3_TS3 costs 39.660 real_cost = 149.783 SP3_TS2-scwrl costs 42.275 real_cost = -56.817 SP3_TS2 costs 42.275 real_cost = -50.326 SP3_TS1-scwrl costs 42.160 real_cost = -92.086 SP3_TS1 costs 42.160 real_cost = -86.756 SAM_T06_server_TS5-scwrl costs 85.827 real_cost = 305.217 SAM_T06_server_TS5 costs 85.817 real_cost = 266.058 SAM_T06_server_TS4-scwrl costs 46.456 real_cost = 24.634 SAM_T06_server_TS4 costs 46.451 real_cost = 5.136 SAM_T06_server_TS3-scwrl costs 47.814 real_cost = 71.357 SAM_T06_server_TS3 costs 47.873 real_cost = 44.630 SAM_T06_server_TS2-scwrl costs 49.649 real_cost = 40.832 SAM_T06_server_TS2 costs 49.620 real_cost = 19.038 SAM_T06_server_TS1-scwrl costs 31.157 real_cost = 99.641 SAM_T06_server_TS1 costs 31.157 real_cost = 99.286 SAM-T99_AL5-scwrl costs 79.719 real_cost = 338.251 SAM-T99_AL5 costs 79.755 real_cost = 405.709 SAM-T99_AL4-scwrl costs 81.473 real_cost = 341.007 SAM-T99_AL4 costs 81.455 real_cost = 407.427 SAM-T99_AL3-scwrl costs 78.164 real_cost = 334.603 SAM-T99_AL3 costs 78.146 real_cost = 400.501 SAM-T99_AL2-scwrl costs 78.106 real_cost = 332.568 SAM-T99_AL2 costs 78.088 real_cost = 398.716 SAM-T99_AL1-scwrl costs 50.151 real_cost = 90.941 SAM-T99_AL1 costs 50.133 real_cost = 216.940 SAM-T02_AL5-scwrl costs 139.387 real_cost = 350.279 SAM-T02_AL5 costs 139.556 real_cost = 487.250 SAM-T02_AL4-scwrl costs 84.581 real_cost = 263.145 SAM-T02_AL4 costs 84.592 real_cost = 330.245 SAM-T02_AL3-scwrl costs 51.769 real_cost = 17.527 SAM-T02_AL3 costs 51.761 real_cost = 137.965 SAM-T02_AL2-scwrl costs 45.729 real_cost = 11.970 SAM-T02_AL2 costs 45.779 real_cost = 156.590 SAM-T02_AL1-scwrl costs 50.867 real_cost = 23.080 SAM-T02_AL1 costs 50.884 real_cost = 158.664 ROKKY_TS5-scwrl costs 54.945 real_cost = -39.085 ROKKY_TS5 costs 54.945 real_cost = -31.450 ROKKY_TS4-scwrl costs 52.478 real_cost = -43.843 ROKKY_TS4 costs 52.478 real_cost = -38.423 ROKKY_TS3-scwrl costs 50.316 real_cost = -70.031 ROKKY_TS3 costs 50.316 real_cost = -70.761 ROKKY_TS2-scwrl costs 48.541 real_cost = -90.843 ROKKY_TS2 costs 48.541 real_cost = -87.379 ROKKY_TS1-scwrl costs 45.389 real_cost = -86.847 ROKKY_TS1 costs 45.389 real_cost = -84.185 ROBETTA_TS5-scwrl costs 32.839 real_cost = -59.735 ROBETTA_TS5 costs 32.839 real_cost = -53.720 ROBETTA_TS4-scwrl costs 33.270 real_cost = -46.482 ROBETTA_TS4 costs 33.270 real_cost = -42.801 ROBETTA_TS3-scwrl costs 33.813 real_cost = -38.981 ROBETTA_TS3 costs 33.813 real_cost = -32.970 ROBETTA_TS2-scwrl costs 28.420 real_cost = -69.293 ROBETTA_TS2 costs 28.420 real_cost = -61.061 ROBETTA_TS1-scwrl costs 37.823 real_cost = -51.904 ROBETTA_TS1 costs 37.823 real_cost = -46.543 RAPTOR_TS5-scwrl costs 39.509 real_cost = -23.819 RAPTOR_TS5 costs 39.509 real_cost = -18.830 RAPTOR_TS4-scwrl costs 48.575 real_cost = -47.212 RAPTOR_TS4 costs 48.575 real_cost = -45.541 RAPTOR_TS3-scwrl costs 44.023 real_cost = -31.014 RAPTOR_TS3 costs 44.023 real_cost = -25.743 RAPTOR_TS2-scwrl costs 48.013 real_cost = -43.914 RAPTOR_TS2 costs 48.013 real_cost = -41.022 RAPTOR_TS1-scwrl costs 48.575 real_cost = -47.212 RAPTOR_TS1 costs 48.575 real_cost = -45.541 RAPTORESS_TS5-scwrl costs 46.675 real_cost = -21.510 RAPTORESS_TS5 costs 46.675 real_cost = -17.144 RAPTORESS_TS4-scwrl costs 59.316 real_cost = -38.562 RAPTORESS_TS4 costs 59.316 real_cost = -37.307 RAPTORESS_TS3-scwrl costs 51.509 real_cost = -12.878 RAPTORESS_TS3 costs 51.509 real_cost = -8.770 RAPTORESS_TS2-scwrl costs 58.705 real_cost = -33.647 RAPTORESS_TS2 costs 58.705 real_cost = -26.174 RAPTORESS_TS1-scwrl costs 59.316 real_cost = -38.562 RAPTORESS_TS1 costs 59.316 real_cost = -37.307 RAPTOR-ACE_TS5-scwrl costs 49.037 real_cost = -24.847 RAPTOR-ACE_TS5 costs 49.037 real_cost = -20.517 RAPTOR-ACE_TS4-scwrl costs 45.867 real_cost = -83.246 RAPTOR-ACE_TS4 costs 45.867 real_cost = -77.554 RAPTOR-ACE_TS3-scwrl costs 46.522 real_cost = -44.688 RAPTOR-ACE_TS3 costs 46.522 real_cost = -37.796 RAPTOR-ACE_TS2-scwrl costs 42.160 real_cost = -92.086 RAPTOR-ACE_TS2 costs 42.160 real_cost = -86.756 RAPTOR-ACE_TS1-scwrl costs 42.275 real_cost = -56.817 RAPTOR-ACE_TS1 costs 42.275 real_cost = -50.326 Pmodeller6_TS5-scwrl costs 23.134 real_cost = -92.754 Pmodeller6_TS5 costs 23.155 real_cost = -98.382 Pmodeller6_TS4-scwrl costs 21.299 real_cost = -85.198 Pmodeller6_TS4 costs 21.325 real_cost = -86.798 Pmodeller6_TS3-scwrl costs 33.813 real_cost = -38.981 Pmodeller6_TS3 costs 33.813 real_cost = -32.970 Pmodeller6_TS2-scwrl costs 32.839 real_cost = -59.735 Pmodeller6_TS2 costs 32.839 real_cost = -53.720 Pmodeller6_TS1-scwrl costs 33.270 real_cost = -46.482 Pmodeller6_TS1 costs 33.270 real_cost = -42.801 Phyre-2_TS5-scwrl costs 61.826 real_cost = -28.271 Phyre-2_TS5 costs 61.826 real_cost = -29.796 Phyre-2_TS4-scwrl costs 58.638 real_cost = 8.589 Phyre-2_TS4 costs 58.638 real_cost = 9.789 Phyre-2_TS3-scwrl costs 54.024 real_cost = -4.753 Phyre-2_TS3 costs 54.024 real_cost = -4.837 Phyre-2_TS2-scwrl costs 44.683 real_cost = -30.683 Phyre-2_TS2 costs 44.683 real_cost = -26.779 Phyre-2_TS1-scwrl costs 53.687 real_cost = -11.107 Phyre-2_TS1 costs 53.687 real_cost = -10.352 Phyre-1_TS1-scwrl costs 47.964 real_cost = 13.975 Phyre-1_TS1 costs 47.952 real_cost = -3.730 Pcons6_TS5-scwrl costs 23.134 real_cost = -92.754 Pcons6_TS5 costs 23.155 real_cost = -98.382 Pcons6_TS4-scwrl costs 26.094 real_cost = -114.806 Pcons6_TS4 costs 26.093 real_cost = -118.688 Pcons6_TS3-scwrl costs 23.518 real_cost = -103.627 Pcons6_TS3 costs 23.515 real_cost = -108.277 Pcons6_TS2-scwrl costs 26.551 real_cost = -63.696 Pcons6_TS2 costs 26.549 real_cost = -69.090 Pcons6_TS1-scwrl costs 24.592 real_cost = -90.443 Pcons6_TS1 costs 24.612 real_cost = -95.286 PROTINFO_TS5-scwrl costs 24.374 real_cost = -119.643 PROTINFO_TS5 costs 24.374 real_cost = -120.076 PROTINFO_TS4-scwrl costs 29.600 real_cost = -118.966 PROTINFO_TS4 costs 29.600 real_cost = -117.624 PROTINFO_TS3-scwrl costs 24.733 real_cost = -115.468 PROTINFO_TS3 costs 24.733 real_cost = -114.458 PROTINFO_TS2-scwrl costs 27.710 real_cost = -123.780 PROTINFO_TS2 costs 27.710 real_cost = -123.547 PROTINFO_TS1-scwrl costs 27.341 real_cost = -90.247 PROTINFO_TS1 costs 27.341 real_cost = -90.376 PROTINFO-AB_TS5-scwrl costs 25.753 real_cost = -123.500 PROTINFO-AB_TS5 costs 25.753 real_cost = -119.622 PROTINFO-AB_TS4-scwrl costs 22.995 real_cost = -112.185 PROTINFO-AB_TS4 costs 22.995 real_cost = -107.829 PROTINFO-AB_TS3-scwrl costs 25.109 real_cost = -114.768 PROTINFO-AB_TS3 costs 25.109 real_cost = -112.500 PROTINFO-AB_TS2-scwrl costs 24.854 real_cost = -123.171 PROTINFO-AB_TS2 costs 24.854 real_cost = -119.543 PROTINFO-AB_TS1-scwrl costs 23.851 real_cost = -118.994 PROTINFO-AB_TS1 costs 23.851 real_cost = -116.564 POMYSL_TS5-scwrl costs 175.719 real_cost = 400.003 POMYSL_TS5 costs 175.846 real_cost = 405.871 POMYSL_TS4-scwrl costs 185.814 real_cost = 327.449 POMYSL_TS4 costs 185.814 real_cost = 337.036 POMYSL_TS3-scwrl costs 186.457 real_cost = 317.226 POMYSL_TS3 costs 186.457 real_cost = 330.866 POMYSL_TS2-scwrl costs 171.308 real_cost = 334.723 POMYSL_TS2 costs 171.313 real_cost = 351.248 POMYSL_TS1-scwrl costs 196.470 real_cost = 334.545 POMYSL_TS1 costs 196.470 real_cost = 338.850 NN_PUT_lab_TS1-scwrl costs 50.070 real_cost = -28.687 NN_PUT_lab_TS1 costs 50.070 real_cost = -28.698 MetaTasser_TS5-scwrl costs 54.896 real_cost = -91.390 MetaTasser_TS5 costs 54.896 real_cost = -88.505 MetaTasser_TS4-scwrl costs 51.620 real_cost = -101.478 MetaTasser_TS4 costs 51.620 real_cost = -96.999 MetaTasser_TS3-scwrl costs 59.261 real_cost = -98.081 MetaTasser_TS3 costs 59.261 real_cost = -94.658 MetaTasser_TS2-scwrl costs 58.849 real_cost = -61.657 MetaTasser_TS2 costs 58.849 real_cost = -60.078 MetaTasser_TS1-scwrl costs 56.446 real_cost = -98.859 MetaTasser_TS1 costs 56.446 real_cost = -96.222 Ma-OPUS-server_TS5-scwrl costs 60.957 real_cost = 209.235 Ma-OPUS-server_TS5 costs 60.957 real_cost = 212.033 Ma-OPUS-server_TS4-scwrl costs 59.914 real_cost = -36.427 Ma-OPUS-server_TS4 costs 59.914 real_cost = -27.480 Ma-OPUS-server_TS3-scwrl costs 45.380 real_cost = -45.934 Ma-OPUS-server_TS3 costs 45.380 real_cost = -35.389 Ma-OPUS-server_TS2-scwrl costs 40.991 real_cost = -35.487 Ma-OPUS-server_TS2 costs 40.991 real_cost = -28.802 Ma-OPUS-server_TS1-scwrl costs 45.499 real_cost = -16.488 Ma-OPUS-server_TS1 costs 45.499 real_cost = -10.070 Ma-OPUS-server2_TS5-scwrl costs 59.035 real_cost = 233.252 Ma-OPUS-server2_TS5 costs 59.035 real_cost = 235.823 Ma-OPUS-server2_TS4-scwrl costs 59.914 real_cost = -36.427 Ma-OPUS-server2_TS4 costs 59.914 real_cost = -27.480 Ma-OPUS-server2_TS3-scwrl costs 47.172 real_cost = -46.968 Ma-OPUS-server2_TS3 costs 47.172 real_cost = -45.984 Ma-OPUS-server2_TS2-scwrl costs 36.468 real_cost = -65.154 Ma-OPUS-server2_TS2 costs 36.468 real_cost = -58.662 Ma-OPUS-server2_TS1-scwrl costs 47.516 real_cost = -39.467 Ma-OPUS-server2_TS1 costs 47.516 real_cost = -31.193 MIG_FROST_AL1-scwrl costs 42.781 real_cost = 201.451 MIG_FROST_AL1 costs 42.770 real_cost = 359.001 LOOPP_TS5-scwrl costs 35.894 real_cost = 181.781 LOOPP_TS5 costs 35.883 real_cost = 183.917 LOOPP_TS4-scwrl costs 47.731 real_cost = 88.717 LOOPP_TS4 costs 47.733 real_cost = 93.099 LOOPP_TS3-scwrl costs 40.575 real_cost = 24.460 LOOPP_TS3 costs 40.564 real_cost = 18.697 LOOPP_TS2-scwrl costs 40.814 real_cost = -38.563 LOOPP_TS2 costs 40.810 real_cost = -43.077 LOOPP_TS1-scwrl costs 36.570 real_cost = 61.174 LOOPP_TS1 costs 36.559 real_cost = 54.617 Huber-Torda-Server_TS5-scwrl costs 116.881 real_cost = 363.493 Huber-Torda-Server_TS5 costs 116.956 real_cost = 443.882 Huber-Torda-Server_TS4-scwrl costs 135.591 real_cost = 350.572 Huber-Torda-Server_TS4 costs 135.600 real_cost = 433.126 Huber-Torda-Server_TS3-scwrl costs 125.608 real_cost = 382.538 Huber-Torda-Server_TS3 costs 125.587 real_cost = 452.183 Huber-Torda-Server_TS2-scwrl costs 128.787 real_cost = 347.292 Huber-Torda-Server_TS2 costs 128.656 real_cost = 423.694 Huber-Torda-Server_TS1-scwrl costs 66.909 real_cost = 137.292 Huber-Torda-Server_TS1 costs 66.909 real_cost = 204.736 HHpred3_TS1-scwrl costs 48.776 real_cost = -86.226 HHpred3_TS1 costs 48.776 real_cost = -84.968 HHpred2_TS1-scwrl costs 53.386 real_cost = -85.684 HHpred2_TS1 costs 53.386 real_cost = -79.071 HHpred1_TS1-scwrl costs 50.464 real_cost = -76.687 HHpred1_TS1 costs 50.464 real_cost = -73.780 GeneSilicoMetaServer_TS5-scwrl costs 52.597 real_cost = -46.064 GeneSilicoMetaServer_TS5 costs 52.586 real_cost = -47.984 GeneSilicoMetaServer_TS4-scwrl costs 56.973 real_cost = 12.505 GeneSilicoMetaServer_TS4 costs 56.952 real_cost = 17.433 GeneSilicoMetaServer_TS3-scwrl costs 50.672 real_cost = -20.259 GeneSilicoMetaServer_TS3 costs 50.666 real_cost = -15.924 GeneSilicoMetaServer_TS2-scwrl costs 57.677 real_cost = -51.878 GeneSilicoMetaServer_TS2 costs 57.680 real_cost = -45.343 GeneSilicoMetaServer_TS1-scwrl costs 44.392 real_cost = -68.231 GeneSilicoMetaServer_TS1 costs 44.392 real_cost = -63.854 Frankenstein_TS4-scwrl costs 58.213 real_cost = 138.175 Frankenstein_TS4 costs 58.213 real_cost = 142.261 Frankenstein_TS3-scwrl costs 64.164 real_cost = 129.161 Frankenstein_TS3 costs 64.164 real_cost = 133.172 Frankenstein_TS2-scwrl costs 48.213 real_cost = 63.033 Frankenstein_TS2 costs 48.213 real_cost = 71.530 Frankenstein_TS1-scwrl costs 44.651 real_cost = 72.014 Frankenstein_TS1 costs 44.651 real_cost = 77.570 FUNCTION_TS5-scwrl costs 45.623 real_cost = -46.223 FUNCTION_TS5 costs 45.623 real_cost = -39.685 FUNCTION_TS4-scwrl costs 147.500 real_cost = 279.973 FUNCTION_TS4 costs 147.500 real_cost = 282.781 FUNCTION_TS3-scwrl costs 55.152 real_cost = -51.739 FUNCTION_TS3 costs 55.152 real_cost = -46.481 FUNCTION_TS2-scwrl costs 48.848 real_cost = -18.792 FUNCTION_TS2 costs 48.846 real_cost = -15.325 FUNCTION_TS1-scwrl costs 50.549 real_cost = -33.670 FUNCTION_TS1 costs 50.549 real_cost = -29.919 FUGUE_AL5-scwrl costs 68.710 real_cost = 245.626 FUGUE_AL5 costs 68.741 real_cost = 405.335 FUGUE_AL4-scwrl costs 53.669 real_cost = 217.556 FUGUE_AL4 costs 53.669 real_cost = 388.828 FUGUE_AL3-scwrl costs 41.640 real_cost = -28.498 FUGUE_AL3 costs 41.653 real_cost = 122.919 FUGUE_AL2-scwrl costs 75.535 real_cost = 307.182 FUGUE_AL2 costs 75.556 real_cost = 419.722 FUGUE_AL1-scwrl costs 46.384 real_cost = 233.963 FUGUE_AL1 costs 46.384 real_cost = 406.973 FPSOLVER-SERVER_TS5-scwrl costs 159.435 real_cost = 275.056 FPSOLVER-SERVER_TS5 costs 159.435 real_cost = 279.404 FPSOLVER-SERVER_TS4-scwrl costs 157.667 real_cost = 307.423 FPSOLVER-SERVER_TS4 costs 157.667 real_cost = 307.549 FPSOLVER-SERVER_TS3-scwrl costs 147.535 real_cost = 266.104 FPSOLVER-SERVER_TS3 costs 147.535 real_cost = 268.062 FPSOLVER-SERVER_TS2-scwrl costs 161.055 real_cost = 336.234 FPSOLVER-SERVER_TS2 costs 161.055 real_cost = 338.778 FPSOLVER-SERVER_TS1-scwrl costs 178.222 real_cost = 304.597 FPSOLVER-SERVER_TS1 costs 178.222 real_cost = 312.468 FORTE2_AL5-scwrl costs 43.981 real_cost = 241.702 FORTE2_AL5 costs 43.948 real_cost = 390.503 FORTE2_AL4-scwrl costs 48.067 real_cost = 223.505 FORTE2_AL4 costs 48.050 real_cost = 377.941 FORTE2_AL3-scwrl costs 56.024 real_cost = 222.130 FORTE2_AL3 costs 56.024 real_cost = 392.977 FORTE2_AL2-scwrl costs 29.897 real_cost = 285.976 FORTE2_AL2 costs 29.914 real_cost = 452.268 FORTE2_AL1-scwrl costs 37.332 real_cost = -21.914 FORTE2_AL1 costs 37.375 real_cost = 127.698 FORTE1_AL5-scwrl costs 43.981 real_cost = 241.702 FORTE1_AL5 costs 43.948 real_cost = 390.503 FORTE1_AL4-scwrl costs 48.067 real_cost = 223.505 FORTE1_AL4 costs 48.050 real_cost = 377.941 FORTE1_AL3-scwrl costs 56.024 real_cost = 222.130 FORTE1_AL3 costs 56.024 real_cost = 392.977 FORTE1_AL2-scwrl costs 29.897 real_cost = 285.976 FORTE1_AL2 costs 29.914 real_cost = 452.268 FORTE1_AL1-scwrl costs 37.332 real_cost = -21.914 FORTE1_AL1 costs 37.375 real_cost = 127.698 FOLDpro_TS5-scwrl costs 46.701 real_cost = -53.411 FOLDpro_TS5 costs 46.701 real_cost = -46.968 FOLDpro_TS4-scwrl costs 54.740 real_cost = 22.643 FOLDpro_TS4 costs 54.740 real_cost = 33.248 FOLDpro_TS3-scwrl costs 58.758 real_cost = 38.497 FOLDpro_TS3 costs 58.758 real_cost = 39.933 FOLDpro_TS2-scwrl costs 48.238 real_cost = -35.389 FOLDpro_TS2 costs 48.238 real_cost = -29.676 FOLDpro_TS1-scwrl costs 55.630 real_cost = -37.232 FOLDpro_TS1 costs 55.630 real_cost = -26.734 FAMS_TS5-scwrl costs 45.833 real_cost = -52.039 FAMS_TS5 costs 45.833 real_cost = -42.742 FAMS_TS4-scwrl costs 38.063 real_cost = -59.057 FAMS_TS4 costs 38.063 real_cost = -50.934 FAMS_TS3-scwrl costs 47.945 real_cost = -43.760 FAMS_TS3 costs 47.944 real_cost = -40.805 FAMS_TS2-scwrl costs 47.507 real_cost = -19.617 FAMS_TS2 costs 47.533 real_cost = -20.405 FAMS_TS1-scwrl costs 50.908 real_cost = -57.883 FAMS_TS1 costs 50.908 real_cost = -53.372 FAMSD_TS5-scwrl costs 62.136 real_cost = 31.251 FAMSD_TS5 costs 62.165 real_cost = 24.334 FAMSD_TS4-scwrl costs 47.160 real_cost = -27.932 FAMSD_TS4 costs 47.160 real_cost = -21.139 FAMSD_TS3-scwrl costs 48.857 real_cost = 4.188 FAMSD_TS3 costs 48.846 real_cost = 7.067 FAMSD_TS2-scwrl costs 56.600 real_cost = 29.155 FAMSD_TS2 costs 56.591 real_cost = 24.327 FAMSD_TS1-scwrl costs 43.511 real_cost = -43.115 FAMSD_TS1 costs 43.511 real_cost = -32.333 Distill_TS5-scwrl costs 255.534 real_cost = 564.806 Distill_TS4-scwrl costs 257.179 real_cost = 558.579 Distill_TS3-scwrl costs 251.413 real_cost = 557.870 Distill_TS2-scwrl costs 253.036 real_cost = 557.616 Distill_TS1-scwrl costs 252.816 real_cost = 550.403 CaspIta-FOX_TS5-scwrl costs 63.402 real_cost = 225.049 CaspIta-FOX_TS5 costs 63.387 real_cost = 216.531 CaspIta-FOX_TS4-scwrl costs 47.045 real_cost = 245.405 CaspIta-FOX_TS4 costs 47.045 real_cost = 245.779 CaspIta-FOX_TS3-scwrl costs 42.041 real_cost = -20.587 CaspIta-FOX_TS3 costs 42.060 real_cost = -27.199 CaspIta-FOX_TS2-scwrl costs 55.056 real_cost = 0.404 CaspIta-FOX_TS2 costs 55.093 real_cost = -3.364 CaspIta-FOX_TS1-scwrl costs 50.668 real_cost = -10.576 CaspIta-FOX_TS1 costs 50.661 real_cost = -12.812 CPHmodels_TS1-scwrl costs 87.011 real_cost = 334.330 CPHmodels_TS1 costs 87.036 real_cost = 328.746 CIRCLE_TS5-scwrl costs 45.833 real_cost = -52.039 CIRCLE_TS5 costs 45.833 real_cost = -42.742 CIRCLE_TS4-scwrl costs 47.945 real_cost = -43.760 CIRCLE_TS4 costs 47.944 real_cost = -40.805 CIRCLE_TS3-scwrl costs 40.788 real_cost = -33.310 CIRCLE_TS3 costs 40.787 real_cost = -31.439 CIRCLE_TS2-scwrl costs 47.507 real_cost = -19.617 CIRCLE_TS2 costs 47.533 real_cost = -20.405 CIRCLE_TS1-scwrl costs 38.063 real_cost = -59.057 CIRCLE_TS1 costs 38.063 real_cost = -50.934 Bilab-ENABLE_TS2-scwrl costs 59.961 real_cost = 193.542 Bilab-ENABLE_TS2 costs 59.961 real_cost = 193.542 Bilab-ENABLE_TS1-scwrl costs 58.617 real_cost = -54.220 Bilab-ENABLE_TS1 costs 58.617 real_cost = -54.220 BayesHH_TS1-scwrl costs 41.160 real_cost = -88.120 BayesHH_TS1 costs 41.160 real_cost = -81.802 ABIpro_TS5-scwrl costs 36.369 real_cost = 179.841 ABIpro_TS5 costs 36.369 real_cost = 179.841 ABIpro_TS4-scwrl costs 38.886 real_cost = 186.386 ABIpro_TS4 costs 38.886 real_cost = 187.917 ABIpro_TS3-scwrl costs 46.464 real_cost = 198.118 ABIpro_TS3 costs 46.464 real_cost = 198.118 ABIpro_TS2-scwrl costs 49.301 real_cost = 206.148 ABIpro_TS2 costs 49.301 real_cost = 206.148 ABIpro_TS1-scwrl costs 34.910 real_cost = 155.036 ABIpro_TS1 costs 34.910 real_cost = 155.959 3Dpro_TS5-scwrl costs 43.460 real_cost = -55.170 3Dpro_TS5 costs 43.460 real_cost = -44.154 3Dpro_TS4-scwrl costs 42.719 real_cost = 47.752 3Dpro_TS4 costs 42.719 real_cost = 41.999 3Dpro_TS3-scwrl costs 41.215 real_cost = -52.230 3Dpro_TS3 costs 41.215 real_cost = -42.692 3Dpro_TS2-scwrl costs 46.265 real_cost = 30.047 3Dpro_TS2 costs 46.265 real_cost = 35.711 3Dpro_TS1-scwrl costs 46.701 real_cost = -53.411 3Dpro_TS1 costs 46.701 real_cost = -46.968 3D-JIGSAW_TS5-scwrl costs 60.464 real_cost = 264.735 3D-JIGSAW_TS5 costs 60.464 real_cost = 264.900 3D-JIGSAW_TS4-scwrl costs 48.569 real_cost = 190.508 3D-JIGSAW_TS4 costs 48.564 real_cost = 194.104 3D-JIGSAW_TS3-scwrl costs 55.965 real_cost = 227.719 3D-JIGSAW_TS3 costs 55.965 real_cost = 232.377 3D-JIGSAW_TS2-scwrl costs 58.738 real_cost = 270.279 3D-JIGSAW_TS2 costs 58.738 real_cost = 273.995 3D-JIGSAW_TS1-scwrl costs 54.123 real_cost = 83.598 3D-JIGSAW_TS1 costs 54.116 real_cost = 86.400 3D-JIGSAW_RECOM_TS4-scwrl costs 69.129 real_cost = 205.405 3D-JIGSAW_RECOM_TS4 costs 69.129 real_cost = 214.050 3D-JIGSAW_RECOM_TS3-scwrl costs 57.947 real_cost = 215.415 3D-JIGSAW_RECOM_TS3 costs 58.131 real_cost = 214.318 3D-JIGSAW_RECOM_TS2-scwrl costs 34.005 real_cost = 163.845 3D-JIGSAW_RECOM_TS2 costs 33.998 real_cost = 167.844 3D-JIGSAW_RECOM_TS1-scwrl costs 50.748 real_cost = 206.962 3D-JIGSAW_RECOM_TS1 costs 50.726 real_cost = 209.059 3D-JIGSAW_POPULUS_TS5-scwrl costs 40.645 real_cost = 197.386 3D-JIGSAW_POPULUS_TS5 costs 40.629 real_cost = 193.429 3D-JIGSAW_POPULUS_TS4-scwrl costs 37.951 real_cost = 167.348 3D-JIGSAW_POPULUS_TS4 costs 37.944 real_cost = 164.270 3D-JIGSAW_POPULUS_TS3-scwrl costs 42.076 real_cost = 203.152 3D-JIGSAW_POPULUS_TS3 costs 42.064 real_cost = 200.263 3D-JIGSAW_POPULUS_TS2-scwrl costs 45.742 real_cost = 164.337 3D-JIGSAW_POPULUS_TS2 costs 45.741 real_cost = 163.337 3D-JIGSAW_POPULUS_TS1-scwrl costs 27.735 real_cost = 173.596 3D-JIGSAW_POPULUS_TS1 costs 27.729 real_cost = 170.446 chimera-8-7.pdb.gz costs 37.839 real_cost = -31.693 chimera-8-7.gromacs0.repack-nonPC.pdb.gz costs 31.094 real_cost = -30.883 chimera-8-7.gromacs0.pdb.gz costs 31.094 real_cost = -30.256 chimera-11-10.pdb.gz costs 38.509 real_cost = -15.857 T0365.try9-opt2.repack-nonPC.pdb.gz costs 31.993 real_cost = 43.035 T0365.try9-opt2.pdb.gz costs 31.993 real_cost = 42.652 T0365.try9-opt2.gromacs0.repack-nonPC.pdb.gz costs 26.328 real_cost = 45.731 T0365.try9-opt2.gromacs0.pdb.gz costs 26.328 real_cost = 43.740 T0365.try9-opt1.pdb.gz costs 31.594 real_cost = 44.000 T0365.try9-opt1-scwrl.pdb.gz costs 31.594 real_cost = 42.299 T0365.try8-opt2.repack-nonPC.pdb.gz costs 40.280 real_cost = -29.539 T0365.try8-opt2.pdb.gz costs 40.280 real_cost = -28.432 T0365.try8-opt2.gromacs0.repack-nonPC.pdb.gz costs 33.563 real_cost = -27.306 T0365.try8-opt2.gromacs0.pdb.gz costs 33.563 real_cost = -26.398 T0365.try8-opt1.pdb.gz costs 39.044 real_cost = -30.274 T0365.try8-opt1-scwrl.pdb.gz costs 39.044 real_cost = -31.026 T0365.try7-opt2.repack-nonPC.pdb.gz costs 37.413 real_cost = -45.508 T0365.try7-opt2.pdb.gz costs 37.413 real_cost = -43.251 T0365.try7-opt2.gromacs0.repack-nonPC.pdb.gz costs 34.777 real_cost = -43.673 T0365.try7-opt2.gromacs0.pdb.gz costs 34.777 real_cost = -40.521 T0365.try7-opt1.pdb.gz costs 36.933 real_cost = -41.584 T0365.try7-opt1-scwrl.pdb.gz costs 36.933 real_cost = -45.772 T0365.try7+breaks.pdb.gz costs 38.473 real_cost = -28.082 T0365.try6-opt2.repack-nonPC.pdb.gz costs 37.549 real_cost = -43.851 T0365.try6-opt2.pdb.gz costs 37.549 real_cost = -41.727 T0365.try6-opt2.gromacs0.repack-nonPC.pdb.gz costs 34.841 real_cost = -43.647 T0365.try6-opt2.gromacs0.pdb.gz costs 34.841 real_cost = -40.366 T0365.try6-opt1.pdb.gz costs 36.984 real_cost = -44.908 T0365.try6-opt1-scwrl.pdb.gz costs 36.984 real_cost = -46.579 T0365.try5-opt2.repack-nonPC.pdb.gz costs 39.828 real_cost = -44.210 T0365.try5-opt2.pdb.gz costs 39.828 real_cost = -43.458 T0365.try5-opt2.gromacs0.repack-nonPC.pdb.gz costs 34.518 real_cost = -41.677 T0365.try5-opt2.gromacs0.pdb.gz costs 34.518 real_cost = -42.674 T0365.try5-opt1.pdb.gz costs 40.278 real_cost = -41.932 T0365.try5-opt1-scwrl.pdb.gz costs 40.278 real_cost = -42.280 T0365.try4-opt2.repack-nonPC.pdb.gz costs 42.429 real_cost = -41.558 T0365.try4-opt2.pdb.gz costs 42.429 real_cost = -41.103 T0365.try4-opt2.gromacs0.repack-nonPC.pdb.gz costs 36.574 real_cost = -40.098 T0365.try4-opt2.gromacs0.pdb.gz costs 36.574 real_cost = -40.378 T0365.try4-opt1.pdb.gz costs 41.607 real_cost = -40.962 T0365.try4-opt1-scwrl.pdb.gz costs 41.607 real_cost = -42.151 T0365.try3-opt2.repack-nonPC.pdb.gz costs 35.932 real_cost = 171.718 T0365.try3-opt2.pdb.gz costs 35.932 real_cost = 173.447 T0365.try3-opt2.gromacs0.repack-nonPC.pdb.gz costs 30.534 real_cost = 171.265 T0365.try3-opt2.gromacs0.pdb.gz costs 30.534 real_cost = 173.130 T0365.try3-opt1.pdb.gz costs 31.934 real_cost = 173.789 T0365.try3-opt1-scwrl.pdb.gz costs 31.934 real_cost = 172.389 T0365.try2-opt2.repack-nonPC.pdb.gz costs 38.592 real_cost = 120.467 T0365.try2-opt2.pdb.gz costs 38.592 real_cost = 118.662 T0365.try2-opt2.gromacs0.repack-nonPC.pdb.gz costs 31.223 real_cost = 118.168 T0365.try2-opt2.gromacs0.pdb.gz costs 31.223 real_cost = 118.832 T0365.try2-opt1.pdb.gz costs 35.599 real_cost = 118.698 T0365.try2-opt1-scwrl.pdb.gz costs 35.599 real_cost = 119.493 T0365.try16-opt2.repack-nonPC.pdb.gz costs 39.327 real_cost = -83.405 T0365.try16-opt2.pdb.gz costs 39.327 real_cost = -87.201 T0365.try16-opt2.gromacs0.repack-nonPC.pdb.gz costs 30.673 real_cost = -85.536 T0365.try16-opt2.gromacs0.pdb.gz costs 30.673 real_cost = -90.043 T0365.try16-opt1.pdb.gz costs 34.267 real_cost = -87.408 T0365.try16-opt1-scwrl.pdb.gz costs 34.267 real_cost = -88.741 T0365.try15-opt2.repack-nonPC.pdb.gz costs 37.690 real_cost = -34.841 T0365.try15-opt2.pdb.gz costs 37.690 real_cost = -33.208 T0365.try15-opt2.gromacs0.repack-nonPC.pdb.gz costs 30.215 real_cost = -31.398 T0365.try15-opt2.gromacs0.pdb.gz costs 30.215 real_cost = -30.914 T0365.try15-opt1.pdb.gz costs 37.047 real_cost = -33.266 T0365.try15-opt1-scwrl.pdb.gz costs 37.047 real_cost = -36.590 T0365.try14-opt2.repack-nonPC.pdb.gz costs 37.549 real_cost = -44.116 T0365.try14-opt2.pdb.gz costs 37.549 real_cost = -42.313 T0365.try14-opt2.gromacs0.repack-nonPC.pdb.gz costs 34.355 real_cost = -45.022 T0365.try14-opt2.gromacs0.pdb.gz costs 34.355 real_cost = -41.351 T0365.try14-opt1.pdb.gz costs 37.549 real_cost = -42.467 T0365.try14-opt1-scwrl.pdb.gz costs 37.549 real_cost = -46.273 T0365.try13-opt2.repack-nonPC.pdb.gz costs 34.206 real_cost = 120.564 T0365.try13-opt2.pdb.gz costs 34.206 real_cost = 120.777 T0365.try13-opt2.gromacs0.repack-nonPC.pdb.gz costs 26.000 real_cost = 121.479 T0365.try13-opt2.gromacs0.pdb.gz costs 26.000 real_cost = 122.448 T0365.try13-opt1.pdb.gz costs 31.562 real_cost = 121.957 T0365.try13-opt1-scwrl.pdb.gz costs 31.562 real_cost = 119.587 T0365.try12-opt2.repack-nonPC.pdb.gz costs 42.611 real_cost = -16.992 T0365.try12-opt2.pdb.gz costs 42.611 real_cost = -18.337 T0365.try12-opt2.gromacs0.repack-nonPC.pdb.gz costs 33.899 real_cost = -23.071 T0365.try12-opt2.gromacs0.pdb.gz costs 33.899 real_cost = -21.223 T0365.try12-opt1.pdb.gz costs 41.525 real_cost = -21.585 T0365.try12-opt1-scwrl.pdb.gz costs 41.525 real_cost = -24.311 T0365.try11-opt2.repack-nonPC.pdb.gz costs 40.914 real_cost = 29.535 T0365.try11-opt2.pdb.gz costs 40.914 real_cost = 30.440 T0365.try11-opt2.gromacs0.repack-nonPC.pdb.gz costs 40.090 real_cost = 27.655 T0365.try11-opt2.gromacs0.pdb.gz costs 40.090 real_cost = 28.446 T0365.try11-opt1.pdb.gz costs 40.947 real_cost = 31.260 T0365.try11-opt1-scwrl.pdb.gz costs 40.947 real_cost = 28.055 T0365.try10-opt2.repack-nonPC.pdb.gz costs 39.753 real_cost = -23.165 T0365.try10-opt2.pdb.gz costs 39.753 real_cost = -23.062 T0365.try10-opt2.gromacs0.repack-nonPC.pdb.gz costs 37.946 real_cost = -22.313 T0365.try10-opt2.gromacs0.pdb.gz costs 37.946 real_cost = -22.147 T0365.try10-opt1.pdb.gz costs 40.954 real_cost = -25.352 T0365.try10-opt1-scwrl.pdb.gz costs 40.954 real_cost = -24.107 T0365.try1-opt2.repack-nonPC.pdb.gz costs 38.158 real_cost = 156.700 T0365.try1-opt2.pdb.gz costs 38.158 real_cost = 155.468 T0365.try1-opt2.gromacs0.repack-nonPC.pdb.gz costs 28.805 real_cost = 151.328 T0365.try1-opt2.gromacs0.pdb.gz costs 28.805 real_cost = 150.216 T0365.try1-opt1.pdb.gz costs 36.166 real_cost = 157.489 T0365.try1-opt1-scwrl.pdb.gz costs 36.166 real_cost = 156.742 ../model5.ts-submitted costs 42.611 real_cost = -18.461 ../model4.ts-submitted costs 39.327 real_cost = -87.301 ../model3.ts-submitted costs 37.690 real_cost = -33.323 ../model2.ts-submitted costs 28.805 real_cost = 151.323 ../model1.ts-submitted costs 37.549 real_cost = -42.518 align5 costs 74.531 real_cost = 255.898 align4 costs 61.699 real_cost = 199.206 align3 costs 80.188 real_cost = 314.419 align2 costs 53.768 real_cost = 26.843 align1 costs 45.254 real_cost = 32.002 T0365.try1-opt2.pdb costs 38.158 real_cost = 155.468 model5-scwrl costs 42.611 real_cost = -20.670 model5.ts-submitted costs 42.611 real_cost = -18.461 model4-scwrl costs 39.327 real_cost = -88.510 model4.ts-submitted costs 39.327 real_cost = -87.301 model3-scwrl costs 37.690 real_cost = -36.402 model3.ts-submitted costs 37.690 real_cost = -33.323 model2-scwrl costs 28.805 real_cost = 151.451 model2.ts-submitted costs 28.805 real_cost = 151.323 model1-scwrl costs 37.549 real_cost = -45.223 model1.ts-submitted costs 37.549 real_cost = -42.518 2iiuA costs 19.322 real_cost = -854.800 # command:CPU_time= 1605.697 sec, elapsed time= 5217.181 sec. # command:rm -f sort.tmp /projects/compbio/bin/sorttbl real_cost < decoys/evaluate.anglevector.rdb > sort.tmp mv -f sort.tmp decoys/evaluate.anglevector.rdb mv -f decoys/evaluate.anglevector.pretty decoys/evaluate.anglevector.pretty.old /projects/compbio/experiments/protein-predict/casp7/scripts/prettyscore -terse -targpfx -decpoint < decoys/evaluate.anglevector.rdb > decoys/evaluate.anglevector.pretty make[1]: Leaving directory `/projects/compbio/experiments/protein-predict/casp7/T0365'