make[1]: Entering directory `/projects/compbio/experiments/protein-predict/casp7/T0293' /projects/compbio/experiments/protein-predict/casp7/starter-directory/Make.main:725: SECONDARY_TARGET = T0293.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/T0293.} ;\ 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/T0293/ -e s/START_COL/1/ \ -e s/COSTFCN/anglevector/ \ -e s/_domain// \ -e s/read-pdb/read-pdb+servers/ \ -e s/REAL_PDB/2h00A/ \ < /projects/compbio/experiments/protein-predict/casp7/starter-directory/evaluate.under \ | nice -2 /cse/grads/jarchie/projects/cvs/karplus/undertaker/undertaker # command:# Seed set to 1183525102 # 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= 6.921 sec, elapsed time= 6.955 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= 7.006 sec, elapsed time= 7.063 sec. # command:# Prefix for input files set to # command:# Making conformation for sequence T0293 numbered 1 through 250 Created new target T0293 from T0293.a2m # command:# command:# No conformations to remove in PopConform # command:# cleared Id set # command:# command:2h00A expands to /projects/compbio/data/pdb/2h00.pdb.gz 2h00A:Skipped atom 1398, because occupancy 0.5 <= existing 0.500 in 2h00A Skipped atom 1400, because occupancy 0.500 <= existing 0.500 in 2h00A Skipped atom 1402, because occupancy 0.500 <= existing 0.500 in 2h00A Skipped atom 1404, because occupancy 0.500 <= existing 0.500 in 2h00A Skipped atom 1406, because occupancy 0.500 <= existing 0.500 in 2h00A Skipped atom 1408, because occupancy 0.500 <= existing 0.500 in 2h00A Skipped atom 1410, because occupancy 0.500 <= existing 0.500 in 2h00A Skipped atom 1412, because occupancy 0.500 <= existing 0.500 in 2h00A Skipped atom 1414, because occupancy 0.500 <= existing 0.500 in 2h00A Skipped atom 1416, because occupancy 0.500 <= existing 0.500 in 2h00A Skipped atom 1418, because occupancy 0.500 <= existing 0.500 in 2h00A Read 225 residues and 1801 atoms. # WARNING: incomplete conformation T0293 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= 10.066 sec, elapsed time= 10.262 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 240 # copying to AlignedFragments data structure # command:# fraction of real conformation used = 1.000 # GDT_score = -41.441 # GDT_score(maxd=8.000,maxw=2.900)= -42.422 # GDT_score(maxd=8.000,maxw=3.200)= -40.026 # GDT_score(maxd=8.000,maxw=3.500)= -37.815 # GDT_score(maxd=10.000,maxw=3.800)= -40.880 # GDT_score(maxd=10.000,maxw=4.000)= -39.445 # GDT_score(maxd=10.000,maxw=4.200)= -38.099 # GDT_score(maxd=12.000,maxw=4.300)= -41.509 # GDT_score(maxd=12.000,maxw=4.500)= -40.155 # GDT_score(maxd=12.000,maxw=4.700)= -38.860 # GDT_score(maxd=14.000,maxw=5.200)= -39.011 # GDT_score(maxd=14.000,maxw=5.500)= -37.236 # command:# Prefix for output files set to # command:Warning: Couldn't open file T0293.model1-real.pdb for output Error: Couldn't open file T0293.model1-real.pdb for output superimposing iter= 0 total_weight= 2670.000 rmsd (weighted)= 13.878 (unweighted)= 31.142 superimposing iter= 1 total_weight= 6386.215 rmsd (weighted)= 6.189 (unweighted)= 30.069 superimposing iter= 2 total_weight= 4011.506 rmsd (weighted)= 3.763 (unweighted)= 29.979 superimposing iter= 3 total_weight= 3118.550 rmsd (weighted)= 2.697 (unweighted)= 29.989 superimposing iter= 4 total_weight= 2780.814 rmsd (weighted)= 2.083 (unweighted)= 30.004 superimposing iter= 5 total_weight= 2335.707 rmsd (weighted)= 1.779 (unweighted)= 30.013 EXPDTA model1.ts-submitted MODEL 1 REMARK 44 REMARK 44 model 1 is called model1.ts-submitted ATOM 1 N VAL A 1 69.172 5.460 19.085 1.00 0.00 ATOM 2 CA VAL A 1 69.600 5.567 17.696 1.00 0.00 ATOM 3 CB VAL A 1 71.027 5.023 17.499 1.00 0.00 ATOM 4 CG1 VAL A 1 71.407 5.047 16.029 1.00 0.00 ATOM 5 CG2 VAL A 1 72.022 5.830 18.322 1.00 0.00 ATOM 6 O VAL A 1 68.256 5.297 15.745 1.00 0.00 ATOM 7 C VAL A 1 68.678 4.774 16.770 1.00 0.00 ATOM 8 N SER A 2 68.272 3.577 17.173 1.00 0.00 ATOM 9 CA SER A 2 67.368 2.794 16.332 1.00 0.00 ATOM 10 CB SER A 2 67.213 1.301 16.743 1.00 0.00 ATOM 11 OG SER A 2 68.532 0.830 16.579 1.00 0.00 ATOM 12 O SER A 2 65.328 3.516 15.260 1.00 0.00 ATOM 13 C SER A 2 65.942 3.369 16.318 1.00 0.00 ATOM 14 N LEU A 3 65.444 3.704 17.509 1.00 0.00 ATOM 15 CA LEU A 3 64.111 4.375 17.587 1.00 0.00 ATOM 16 CB LEU A 3 63.691 4.533 19.041 1.00 0.00 ATOM 17 CG LEU A 3 63.488 3.211 19.743 1.00 0.00 ATOM 18 CD1 LEU A 3 63.126 3.588 21.159 1.00 0.00 ATOM 19 CD2 LEU A 3 62.464 2.322 19.107 1.00 0.00 ATOM 20 O LEU A 3 63.175 6.099 16.111 1.00 0.00 ATOM 21 C LEU A 3 64.134 5.727 16.845 1.00 0.00 ATOM 22 N ASN A 4 65.200 6.541 16.988 1.00 0.00 ATOM 23 CA ASN A 4 65.257 7.797 16.273 1.00 0.00 ATOM 24 CB ASN A 4 66.574 8.506 16.407 1.00 0.00 ATOM 25 CG ASN A 4 66.767 8.992 17.841 1.00 0.00 ATOM 26 ND2 ASN A 4 67.885 8.569 18.468 1.00 0.00 ATOM 27 OD1 ASN A 4 65.935 9.752 18.355 1.00 0.00 ATOM 28 O ASN A 4 64.649 8.472 14.023 1.00 0.00 ATOM 29 C ASN A 4 65.222 7.637 14.771 1.00 0.00 ATOM 30 N PHE A 5 65.850 6.554 14.284 1.00 0.00 ATOM 31 CA PHE A 5 65.831 6.306 12.817 1.00 0.00 ATOM 32 CB PHE A 5 66.873 5.300 12.453 1.00 0.00 ATOM 33 CG PHE A 5 68.293 5.819 12.538 1.00 0.00 ATOM 34 CD1 PHE A 5 68.579 7.172 12.747 1.00 0.00 ATOM 35 CD2 PHE A 5 69.339 4.887 12.405 1.00 0.00 ATOM 36 CE1 PHE A 5 69.912 7.573 12.782 1.00 0.00 ATOM 37 CE2 PHE A 5 70.656 5.332 12.392 1.00 0.00 ATOM 38 CZ PHE A 5 70.972 6.693 12.583 1.00 0.00 ATOM 39 O PHE A 5 63.859 6.319 11.419 1.00 0.00 ATOM 40 C PHE A 5 64.424 5.888 12.425 1.00 0.00 ATOM 41 N LYS A 6 63.869 4.914 13.250 1.00 0.00 ATOM 42 CA LYS A 6 62.536 4.450 12.934 1.00 0.00 ATOM 43 CB LYS A 6 62.060 3.442 14.055 1.00 0.00 ATOM 44 CG LYS A 6 60.702 2.812 13.836 1.00 0.00 ATOM 45 CD LYS A 6 60.273 1.808 14.896 1.00 0.00 ATOM 46 CE LYS A 6 58.948 1.126 14.575 1.00 0.00 ATOM 47 NZ LYS A 6 58.687 -0.041 15.481 1.00 0.00 ATOM 48 O LYS A 6 60.667 5.534 11.873 1.00 0.00 ATOM 49 C LYS A 6 61.524 5.569 12.775 1.00 0.00 ATOM 50 N ASP A 7 61.595 6.579 13.628 1.00 0.00 ATOM 51 CA ASP A 7 60.686 7.719 13.532 1.00 0.00 ATOM 52 CB ASP A 7 60.845 8.635 14.748 1.00 0.00 ATOM 53 CG ASP A 7 60.265 8.071 16.040 1.00 0.00 ATOM 54 OD1 ASP A 7 59.582 7.079 15.977 1.00 0.00 ATOM 55 OD2 ASP A 7 60.636 8.544 17.088 1.00 0.00 ATOM 56 O ASP A 7 61.986 8.396 11.625 1.00 0.00 ATOM 57 C ASP A 7 60.931 8.511 12.250 1.00 0.00 ATOM 58 N PRO A 8 59.962 9.346 11.848 1.00 0.00 ATOM 59 CA PRO A 8 60.113 10.143 10.629 1.00 0.00 ATOM 60 CB PRO A 8 58.765 10.851 10.509 1.00 0.00 ATOM 61 CG PRO A 8 58.327 10.987 11.938 1.00 0.00 ATOM 62 CD PRO A 8 58.680 9.640 12.515 1.00 0.00 ATOM 63 O PRO A 8 61.770 11.542 9.597 1.00 0.00 ATOM 64 C PRO A 8 61.324 11.069 10.643 1.00 0.00 ATOM 65 N GLU A 9 61.862 11.313 11.847 1.00 0.00 ATOM 66 CA GLU A 9 63.024 12.191 11.997 1.00 0.00 ATOM 67 CB GLU A 9 63.278 12.496 13.475 1.00 0.00 ATOM 68 CG GLU A 9 62.235 13.400 14.117 1.00 0.00 ATOM 69 CD GLU A 9 62.479 13.552 15.594 1.00 0.00 ATOM 70 OE1 GLU A 9 63.377 12.920 16.095 1.00 0.00 ATOM 71 OE2 GLU A 9 61.844 14.382 16.199 1.00 0.00 ATOM 72 O GLU A 9 65.059 12.267 10.720 1.00 0.00 ATOM 73 C GLU A 9 64.276 11.576 11.381 1.00 0.00 ATOM 74 N ALA A 10 64.477 10.288 11.593 1.00 0.00 ATOM 75 CA ALA A 10 65.650 9.619 11.038 1.00 0.00 ATOM 76 CB ALA A 10 65.796 8.177 11.599 1.00 0.00 ATOM 77 O ALA A 10 66.590 9.923 8.840 1.00 0.00 ATOM 78 C ALA A 10 65.596 9.623 9.527 1.00 0.00 ATOM 79 N VAL A 11 64.437 9.274 8.975 1.00 0.00 ATOM 80 CA VAL A 11 64.315 9.236 7.534 1.00 0.00 ATOM 81 CB VAL A 11 62.944 8.557 7.125 1.00 0.00 ATOM 82 CG1 VAL A 11 62.582 8.749 5.655 1.00 0.00 ATOM 83 CG2 VAL A 11 63.080 7.119 7.530 1.00 0.00 ATOM 84 O VAL A 11 65.052 10.754 5.813 1.00 0.00 ATOM 85 C VAL A 11 64.427 10.605 6.885 1.00 0.00 ATOM 86 N ARG A 12 63.831 11.615 7.499 1.00 0.00 ATOM 87 CA ARG A 12 63.978 12.974 6.997 1.00 0.00 ATOM 88 CB ARG A 12 63.194 13.962 7.900 1.00 0.00 ATOM 89 CG ARG A 12 63.267 15.423 7.435 1.00 0.00 ATOM 90 CD ARG A 12 62.546 16.346 8.412 1.00 0.00 ATOM 91 NE ARG A 12 63.192 16.369 9.724 1.00 0.00 ATOM 92 CZ ARG A 12 62.533 16.435 10.875 1.00 0.00 ATOM 93 NH1 ARG A 12 61.207 16.482 10.887 1.00 0.00 ATOM 94 NH2 ARG A 12 63.204 16.443 12.020 1.00 0.00 ATOM 95 O ARG A 12 65.888 14.003 6.026 1.00 0.00 ATOM 96 C ARG A 12 65.456 13.350 6.955 1.00 0.00 ATOM 97 N ALA A 13 66.221 12.927 7.954 1.00 0.00 ATOM 98 CA ALA A 13 67.620 13.351 8.038 1.00 0.00 ATOM 99 CB ALA A 13 68.220 13.041 9.402 1.00 0.00 ATOM 100 O ALA A 13 69.390 13.239 6.428 1.00 0.00 ATOM 101 C ALA A 13 68.414 12.674 6.919 1.00 0.00 ATOM 102 N LEU A 14 68.006 11.455 6.544 1.00 0.00 ATOM 103 CA LEU A 14 68.653 10.740 5.448 1.00 0.00 ATOM 104 CB LEU A 14 68.090 9.317 5.341 1.00 0.00 ATOM 105 CG LEU A 14 68.465 8.378 6.494 1.00 0.00 ATOM 106 CD1 LEU A 14 67.704 7.065 6.368 1.00 0.00 ATOM 107 CD2 LEU A 14 69.966 8.132 6.483 1.00 0.00 ATOM 108 O LEU A 14 69.389 11.702 3.361 1.00 0.00 ATOM 109 C LEU A 14 68.458 11.522 4.149 1.00 0.00 ATOM 110 N THR A 15 67.243 12.015 3.971 1.00 0.00 ATOM 111 CA THR A 15 66.923 12.779 2.775 1.00 0.00 ATOM 112 CB THR A 15 65.450 13.231 2.769 1.00 0.00 ATOM 113 CG2 THR A 15 65.149 14.058 1.530 1.00 0.00 ATOM 114 OG1 THR A 15 64.594 12.078 2.777 1.00 0.00 ATOM 115 O THR A 15 68.282 14.364 1.586 1.00 0.00 ATOM 116 C THR A 15 67.780 14.034 2.662 1.00 0.00 ATOM 117 N CYS A 16 67.905 14.691 3.808 1.00 0.00 ATOM 118 CA CYS A 16 68.669 15.927 3.805 1.00 0.00 ATOM 119 CB CYS A 16 68.575 16.621 5.166 1.00 0.00 ATOM 120 SG CYS A 16 66.943 17.306 5.543 1.00 0.00 ATOM 121 O CYS A 16 70.698 16.448 2.674 1.00 0.00 ATOM 122 C CYS A 16 70.145 15.727 3.499 1.00 0.00 ATOM 123 N THR A 17 70.774 14.804 4.134 1.00 0.00 ATOM 124 CA THR A 17 72.192 14.563 3.880 1.00 0.00 ATOM 125 CB THR A 17 72.837 13.587 4.913 1.00 0.00 ATOM 126 CG2 THR A 17 72.759 14.156 6.345 1.00 0.00 ATOM 127 OG1 THR A 17 72.253 12.296 4.894 1.00 0.00 ATOM 128 O THR A 17 73.451 14.502 1.848 1.00 0.00 ATOM 129 C THR A 17 72.445 14.148 2.431 1.00 0.00 ATOM 130 N LEU A 18 71.515 13.398 1.861 1.00 0.00 ATOM 131 CA LEU A 18 71.670 12.859 0.525 1.00 0.00 ATOM 132 CB LEU A 18 70.674 11.624 0.342 1.00 0.00 ATOM 133 CG LEU A 18 70.900 10.373 1.193 1.00 0.00 ATOM 134 CD1 LEU A 18 69.723 9.417 1.035 1.00 0.00 ATOM 135 CD2 LEU A 18 72.198 9.695 0.780 1.00 0.00 ATOM 136 O LEU A 18 72.142 13.835 -1.627 1.00 0.00 ATOM 137 C LEU A 18 71.627 13.985 -0.513 1.00 0.00 ATOM 138 N LEU A 19 71.007 15.202 -0.237 1.00 0.00 ATOM 139 CA LEU A 19 70.949 16.316 -1.155 1.00 0.00 ATOM 140 CB LEU A 19 70.096 17.445 -0.572 1.00 0.00 ATOM 141 CG LEU A 19 68.610 17.143 -0.387 1.00 0.00 ATOM 142 CD1 LEU A 19 67.907 18.301 0.308 1.00 0.00 ATOM 143 CD2 LEU A 19 67.931 16.919 -1.732 1.00 0.00 ATOM 144 O LEU A 19 72.493 17.561 -2.503 1.00 0.00 ATOM 145 C LEU A 19 72.323 16.899 -1.476 1.00 0.00 ATOM 146 N ARG A 20 73.306 16.646 -0.629 1.00 0.00 ATOM 147 CA ARG A 20 74.619 17.194 -0.917 1.00 0.00 ATOM 148 CB ARG A 20 75.402 17.273 0.405 1.00 0.00 ATOM 149 CG ARG A 20 74.865 18.288 1.331 1.00 0.00 ATOM 150 CD ARG A 20 75.665 18.327 2.627 1.00 0.00 ATOM 151 NE ARG A 20 74.773 18.500 3.741 1.00 0.00 ATOM 152 CZ ARG A 20 74.322 17.535 4.522 1.00 0.00 ATOM 153 NH1 ARG A 20 74.686 16.278 4.358 1.00 0.00 ATOM 154 NH2 ARG A 20 73.499 17.847 5.506 1.00 0.00 ATOM 155 O ARG A 20 76.106 17.102 -2.735 1.00 0.00 ATOM 156 C ARG A 20 75.267 16.469 -2.088 1.00 0.00 ATOM 157 N GLU A 21 74.339 15.811 -2.962 1.00 0.00 ATOM 158 CA GLU A 21 74.044 16.062 -4.358 1.00 0.00 ATOM 159 CB GLU A 21 74.754 17.348 -4.844 1.00 0.00 ATOM 160 CG GLU A 21 76.250 17.169 -5.062 1.00 0.00 ATOM 161 CD GLU A 21 77.067 18.443 -5.026 1.00 0.00 ATOM 162 OE1 GLU A 21 76.539 19.556 -4.866 1.00 0.00 ATOM 163 OE2 GLU A 21 78.309 18.350 -5.171 1.00 0.00 ATOM 164 O GLU A 21 74.947 13.905 -4.874 1.00 0.00 ATOM 165 C GLU A 21 74.339 14.894 -5.282 1.00 0.00 ATOM 166 N ASP A 22 73.816 14.980 -6.502 1.00 0.00 ATOM 167 CA ASP A 22 74.021 13.930 -7.482 1.00 0.00 ATOM 168 CB ASP A 22 75.513 13.708 -7.731 1.00 0.00 ATOM 169 CG ASP A 22 76.232 14.898 -8.353 1.00 0.00 ATOM 170 OD1 ASP A 22 75.763 15.396 -9.348 1.00 0.00 ATOM 171 OD2 ASP A 22 77.149 15.396 -7.746 1.00 0.00 ATOM 172 O ASP A 22 74.108 11.556 -7.138 1.00 0.00 ATOM 173 C ASP A 22 73.464 12.598 -6.993 1.00 0.00 ATOM 174 N PHE A 23 72.241 12.692 -6.407 1.00 0.00 ATOM 175 CA PHE A 23 71.552 11.459 -6.016 1.00 0.00 ATOM 176 CB PHE A 23 71.438 11.335 -4.474 1.00 0.00 ATOM 177 CG PHE A 23 72.727 11.169 -3.724 1.00 0.00 ATOM 178 CD1 PHE A 23 73.225 9.898 -3.450 1.00 0.00 ATOM 179 CD2 PHE A 23 73.398 12.277 -3.218 1.00 0.00 ATOM 180 CE1 PHE A 23 74.375 9.733 -2.677 1.00 0.00 ATOM 181 CE2 PHE A 23 74.553 12.121 -2.445 1.00 0.00 ATOM 182 CZ PHE A 23 75.038 10.845 -2.178 1.00 0.00 ATOM 183 O PHE A 23 69.396 12.456 -6.384 1.00 0.00 ATOM 184 C PHE A 23 70.070 11.425 -6.334 1.00 0.00 ATOM 185 N GLY A 24 69.579 10.219 -6.577 1.00 0.00 ATOM 186 CA GLY A 24 68.169 9.976 -6.835 1.00 0.00 ATOM 187 O GLY A 24 68.512 7.934 -5.639 1.00 0.00 ATOM 188 C GLY A 24 67.838 8.959 -5.749 1.00 0.00 ATOM 189 N LEU A 25 66.826 9.230 -4.944 1.00 0.00 ATOM 190 CA LEU A 25 66.525 8.306 -3.864 1.00 0.00 ATOM 191 CB LEU A 25 67.342 8.663 -2.614 1.00 0.00 ATOM 192 CG LEU A 25 67.138 10.091 -2.088 1.00 0.00 ATOM 193 CD1 LEU A 25 65.893 10.151 -1.214 1.00 0.00 ATOM 194 CD2 LEU A 25 68.368 10.524 -1.303 1.00 0.00 ATOM 195 O LEU A 25 64.243 9.059 -3.859 1.00 0.00 ATOM 196 C LEU A 25 65.065 8.233 -3.453 1.00 0.00 ATOM 197 N SER A 26 64.909 7.105 -2.649 1.00 0.00 ATOM 198 CA SER A 26 63.582 6.861 -2.107 1.00 0.00 ATOM 199 CB SER A 26 62.779 5.916 -3.008 1.00 0.00 ATOM 200 OG SER A 26 61.462 5.743 -2.514 1.00 0.00 ATOM 201 O SER A 26 64.532 5.501 -0.362 1.00 0.00 ATOM 202 C SER A 26 63.725 6.381 -0.662 1.00 0.00 ATOM 203 N ILE A 27 62.922 6.948 0.222 1.00 0.00 ATOM 204 CA ILE A 27 62.969 6.622 1.638 1.00 0.00 ATOM 205 CB ILE A 27 63.293 7.826 2.513 1.00 0.00 ATOM 206 CG1 ILE A 27 64.636 8.405 2.074 1.00 0.00 ATOM 207 CG2 ILE A 27 63.318 7.402 4.006 1.00 0.00 ATOM 208 CD1 ILE A 27 65.058 9.591 2.779 1.00 0.00 ATOM 209 O ILE A 27 60.614 6.568 1.911 1.00 0.00 ATOM 210 C ILE A 27 61.663 5.974 2.079 1.00 0.00 ATOM 211 N ASP A 28 61.760 4.809 2.651 1.00 0.00 ATOM 212 CA ASP A 28 60.567 4.090 3.140 1.00 0.00 ATOM 213 CB ASP A 28 60.475 2.703 2.500 1.00 0.00 ATOM 214 CG ASP A 28 59.197 1.941 2.829 1.00 0.00 ATOM 215 OD1 ASP A 28 58.789 1.969 3.964 1.00 0.00 ATOM 216 OD2 ASP A 28 58.558 1.474 1.918 1.00 0.00 ATOM 217 O ASP A 28 61.428 3.234 5.216 1.00 0.00 ATOM 218 C ASP A 28 60.649 4.006 4.656 1.00 0.00 ATOM 219 N ILE A 29 59.833 4.809 5.299 1.00 0.00 ATOM 220 CA ILE A 29 59.909 5.006 6.741 1.00 0.00 ATOM 221 CB ILE A 29 58.968 6.114 7.259 1.00 0.00 ATOM 222 CG1 ILE A 29 59.487 7.490 6.844 1.00 0.00 ATOM 223 CG2 ILE A 29 58.880 6.068 8.776 1.00 0.00 ATOM 224 CD1 ILE A 29 58.498 8.612 7.077 1.00 0.00 ATOM 225 O ILE A 29 60.196 3.241 8.339 1.00 0.00 ATOM 226 C ILE A 29 59.480 3.730 7.463 1.00 0.00 ATOM 227 N PRO A 30 58.215 3.235 7.156 1.00 0.00 ATOM 228 CA PRO A 30 57.795 2.011 7.847 1.00 0.00 ATOM 229 CB PRO A 30 56.553 1.559 7.075 1.00 0.00 ATOM 230 CG PRO A 30 55.963 2.822 6.545 1.00 0.00 ATOM 231 CD PRO A 30 57.125 3.681 6.127 1.00 0.00 ATOM 232 O PRO A 30 58.998 0.197 8.867 1.00 0.00 ATOM 233 C PRO A 30 58.831 0.889 7.858 1.00 0.00 ATOM 234 N LEU A 31 59.522 0.713 6.739 1.00 0.00 ATOM 235 CA LEU A 31 60.521 -0.339 6.624 1.00 0.00 ATOM 236 CB LEU A 31 60.496 -0.942 5.214 1.00 0.00 ATOM 237 CG LEU A 31 59.175 -1.615 4.816 1.00 0.00 ATOM 238 CD1 LEU A 31 59.242 -2.081 3.368 1.00 0.00 ATOM 239 CD2 LEU A 31 58.899 -2.783 5.747 1.00 0.00 ATOM 240 O LEU A 31 62.874 -0.708 6.906 1.00 0.00 ATOM 241 C LEU A 31 61.946 0.101 6.956 1.00 0.00 ATOM 242 N GLU A 32 62.097 1.374 7.308 1.00 0.00 ATOM 243 CA GLU A 32 63.388 1.947 7.682 1.00 0.00 ATOM 244 CB GLU A 32 63.162 2.095 9.369 1.00 0.00 ATOM 245 CG GLU A 32 62.944 0.697 9.891 1.00 0.00 ATOM 246 CD GLU A 32 62.665 0.595 11.404 1.00 0.00 ATOM 247 OE1 GLU A 32 62.689 1.598 12.153 1.00 0.00 ATOM 248 OE2 GLU A 32 62.443 -0.537 11.855 1.00 0.00 ATOM 249 O GLU A 32 65.526 1.142 6.932 1.00 0.00 ATOM 250 C GLU A 32 64.449 1.664 6.627 1.00 0.00 ATOM 251 N ARG A 33 64.145 2.029 5.387 1.00 0.00 ATOM 252 CA ARG A 33 65.071 1.800 4.288 1.00 0.00 ATOM 253 CB ARG A 33 64.679 0.590 3.451 1.00 0.00 ATOM 254 CG ARG A 33 63.483 0.803 2.540 1.00 0.00 ATOM 255 CD ARG A 33 63.223 -0.317 1.598 1.00 0.00 ATOM 256 NE ARG A 33 62.106 -0.095 0.694 1.00 0.00 ATOM 257 CZ ARG A 33 61.574 -1.038 -0.109 1.00 0.00 ATOM 258 NH1 ARG A 33 62.077 -2.252 -0.155 1.00 0.00 ATOM 259 NH2 ARG A 33 60.548 -0.703 -0.870 1.00 0.00 ATOM 260 O ARG A 33 64.217 3.589 2.923 1.00 0.00 ATOM 261 C ARG A 33 65.212 2.974 3.328 1.00 0.00 ATOM 262 N LEU A 34 66.453 3.252 2.975 1.00 0.00 ATOM 263 CA LEU A 34 66.800 4.321 2.041 1.00 0.00 ATOM 264 CB LEU A 34 67.900 5.117 2.712 1.00 0.00 ATOM 265 CG LEU A 34 68.527 6.196 1.815 1.00 0.00 ATOM 266 CD1 LEU A 34 67.441 7.107 1.257 1.00 0.00 ATOM 267 CD2 LEU A 34 69.537 7.008 2.616 1.00 0.00 ATOM 268 O LEU A 34 68.451 2.888 1.035 1.00 0.00 ATOM 269 C LEU A 34 67.544 3.705 0.858 1.00 0.00 ATOM 270 N ILE A 35 67.124 4.098 -0.349 1.00 0.00 ATOM 271 CA ILE A 35 67.772 3.609 -1.560 1.00 0.00 ATOM 272 CB ILE A 35 66.717 2.922 -2.464 1.00 0.00 ATOM 273 CG1 ILE A 35 66.190 1.668 -1.791 1.00 0.00 ATOM 274 CG2 ILE A 35 67.337 2.592 -3.823 1.00 0.00 ATOM 275 CD1 ILE A 35 64.967 1.006 -2.466 1.00 0.00 ATOM 276 O ILE A 35 67.545 5.753 -2.610 1.00 0.00 ATOM 277 C ILE A 35 68.294 4.831 -2.291 1.00 0.00 ATOM 278 N PRO A 36 69.674 4.848 -2.520 1.00 0.00 ATOM 279 CA PRO A 36 70.301 5.981 -3.176 1.00 0.00 ATOM 280 CB PRO A 36 70.971 6.761 -2.016 1.00 0.00 ATOM 281 CG PRO A 36 70.534 6.101 -0.757 1.00 0.00 ATOM 282 CD PRO A 36 70.091 4.700 -1.139 1.00 0.00 ATOM 283 O PRO A 36 71.955 4.668 -4.307 1.00 0.00 ATOM 284 C PRO A 36 71.133 5.575 -4.382 1.00 0.00 ATOM 285 N THR A 37 70.897 6.267 -5.505 1.00 0.00 ATOM 286 CA THR A 37 71.598 5.985 -6.761 1.00 0.00 ATOM 287 CB THR A 37 70.747 5.069 -7.714 1.00 0.00 ATOM 288 CG2 THR A 37 69.977 4.011 -6.929 1.00 0.00 ATOM 289 OG1 THR A 37 69.821 5.887 -8.436 1.00 0.00 ATOM 290 O THR A 37 71.286 8.244 -7.399 1.00 0.00 ATOM 291 C THR A 37 72.015 7.259 -7.408 1.00 0.00 ATOM 292 N VAL A 38 73.337 7.204 -8.150 1.00 0.00 ATOM 293 CA VAL A 38 73.795 8.231 -9.094 1.00 0.00 ATOM 294 CB VAL A 38 73.243 9.544 -9.004 1.00 0.00 ATOM 295 CG1 VAL A 38 73.950 10.467 -9.981 1.00 0.00 ATOM 296 CG2 VAL A 38 71.762 9.460 -9.346 1.00 0.00 ATOM 297 O VAL A 38 76.056 8.453 -9.752 1.00 0.00 ATOM 298 C VAL A 38 75.298 8.151 -8.834 1.00 0.00 ATOM 299 N PRO A 39 75.697 7.705 -7.652 1.00 0.00 ATOM 300 CA PRO A 39 77.150 7.628 -7.468 1.00 0.00 ATOM 301 CB PRO A 39 77.348 7.369 -5.957 1.00 0.00 ATOM 302 CG PRO A 39 75.992 7.720 -5.314 1.00 0.00 ATOM 303 CD PRO A 39 74.974 7.387 -6.397 1.00 0.00 ATOM 304 O PRO A 39 77.166 6.220 -9.409 1.00 0.00 ATOM 305 C PRO A 39 77.810 6.695 -8.469 1.00 0.00 ATOM 306 N LEU A 40 79.091 6.414 -8.241 1.00 0.00 ATOM 307 CA LEU A 40 79.841 5.536 -9.120 1.00 0.00 ATOM 308 CB LEU A 40 80.294 6.267 -10.390 1.00 0.00 ATOM 309 CG LEU A 40 79.161 6.847 -11.248 1.00 0.00 ATOM 310 CD1 LEU A 40 79.741 7.599 -12.439 1.00 0.00 ATOM 311 CD2 LEU A 40 78.250 5.720 -11.713 1.00 0.00 ATOM 312 O LEU A 40 80.961 4.008 -7.674 1.00 0.00 ATOM 313 C LEU A 40 81.069 4.813 -8.608 1.00 0.00 ATOM 314 N ARG A 41 82.274 5.201 -9.183 1.00 0.00 ATOM 315 CA ARG A 41 83.543 4.637 -8.713 1.00 0.00 ATOM 316 CB ARG A 41 84.063 3.592 -9.765 1.00 0.00 ATOM 317 CG ARG A 41 83.056 2.487 -10.070 1.00 0.00 ATOM 318 CD ARG A 41 83.613 1.375 -10.943 1.00 0.00 ATOM 319 NE ARG A 41 84.010 1.850 -12.263 1.00 0.00 ATOM 320 CZ ARG A 41 85.255 2.161 -12.607 1.00 0.00 ATOM 321 NH1 ARG A 41 86.244 2.046 -11.727 1.00 0.00 ATOM 322 NH2 ARG A 41 85.519 2.583 -13.838 1.00 0.00 ATOM 323 O ARG A 41 84.951 6.629 -8.798 1.00 0.00 ATOM 324 C ARG A 41 84.902 5.394 -8.744 1.00 0.00 ATOM 325 N LEU A 42 86.119 4.674 -8.720 1.00 0.00 ATOM 326 CA LEU A 42 87.395 5.349 -8.907 1.00 0.00 ATOM 327 CB LEU A 42 87.460 5.982 -10.301 1.00 0.00 ATOM 328 CG LEU A 42 87.418 4.992 -11.474 1.00 0.00 ATOM 329 CD1 LEU A 42 87.368 5.747 -12.793 1.00 0.00 ATOM 330 CD2 LEU A 42 88.637 4.085 -11.415 1.00 0.00 ATOM 331 O LEU A 42 87.093 6.204 -6.683 1.00 0.00 ATOM 332 C LEU A 42 87.561 6.394 -7.807 1.00 0.00 ATOM 333 N ASN A 43 88.219 7.502 -8.141 1.00 0.00 ATOM 334 CA ASN A 43 88.448 8.589 -7.193 1.00 0.00 ATOM 335 CB ASN A 43 89.306 9.684 -7.799 1.00 0.00 ATOM 336 CG ASN A 43 90.751 9.301 -7.958 1.00 0.00 ATOM 337 ND2 ASN A 43 91.452 10.068 -8.754 1.00 0.00 ATOM 338 OD1 ASN A 43 91.244 8.369 -7.311 1.00 0.00 ATOM 339 O ASN A 43 86.949 9.339 -5.484 1.00 0.00 ATOM 340 C ASN A 43 87.135 9.166 -6.688 1.00 0.00 ATOM 341 N TYR A 44 86.215 9.423 -7.609 1.00 0.00 ATOM 342 CA TYR A 44 84.921 9.987 -7.233 1.00 0.00 ATOM 343 CB TYR A 44 84.033 10.160 -8.468 1.00 0.00 ATOM 344 CG TYR A 44 82.660 10.711 -8.163 1.00 0.00 ATOM 345 CD1 TYR A 44 82.476 12.068 -7.921 1.00 0.00 ATOM 346 CD2 TYR A 44 81.552 9.876 -8.115 1.00 0.00 ATOM 347 CE1 TYR A 44 81.226 12.581 -7.641 1.00 0.00 ATOM 348 CE2 TYR A 44 80.293 10.374 -7.837 1.00 0.00 ATOM 349 CZ TYR A 44 80.135 11.738 -7.600 1.00 0.00 ATOM 350 OH TYR A 44 78.889 12.247 -7.321 1.00 0.00 ATOM 351 O TYR A 44 83.564 9.564 -5.296 1.00 0.00 ATOM 352 C TYR A 44 84.188 9.083 -6.243 1.00 0.00 ATOM 353 N ILE A 45 84.251 7.773 -6.471 1.00 0.00 ATOM 354 CA ILE A 45 83.590 6.839 -5.569 1.00 0.00 ATOM 355 CB ILE A 45 83.598 5.406 -6.136 1.00 0.00 ATOM 356 CG1 ILE A 45 82.501 4.566 -5.478 1.00 0.00 ATOM 357 CG2 ILE A 45 84.962 4.762 -5.931 1.00 0.00 ATOM 358 CD1 ILE A 45 81.121 5.180 -5.570 1.00 0.00 ATOM 359 O ILE A 45 83.636 6.757 -3.167 1.00 0.00 ATOM 360 C ILE A 45 84.275 6.855 -4.199 1.00 0.00 ATOM 361 N HIS A 46 85.587 7.041 -4.179 1.00 0.00 ATOM 362 CA HIS A 46 86.351 7.154 -2.946 1.00 0.00 ATOM 363 CB HIS A 46 87.833 7.397 -3.248 1.00 0.00 ATOM 364 CG HIS A 46 88.528 6.211 -3.840 1.00 0.00 ATOM 365 CD2 HIS A 46 88.143 4.918 -3.954 1.00 0.00 ATOM 366 ND1 HIS A 46 89.784 6.288 -4.402 1.00 0.00 ATOM 367 CE1 HIS A 46 90.144 5.093 -4.839 1.00 0.00 ATOM 368 NE2 HIS A 46 89.164 4.245 -4.579 1.00 0.00 ATOM 369 O HIS A 46 85.587 8.204 -0.917 1.00 0.00 ATOM 370 C HIS A 46 85.774 8.321 -2.126 1.00 0.00 ATOM 371 N TRP A 47 85.448 9.391 -2.808 1.00 0.00 ATOM 372 CA TRP A 47 84.862 10.539 -2.122 1.00 0.00 ATOM 373 CB TRP A 47 84.747 11.713 -3.097 1.00 0.00 ATOM 374 CG TRP A 47 84.198 12.960 -2.471 1.00 0.00 ATOM 375 CD1 TRP A 47 84.900 13.912 -1.797 1.00 0.00 ATOM 376 CD2 TRP A 47 82.831 13.389 -2.462 1.00 0.00 ATOM 377 CE2 TRP A 47 82.781 14.609 -1.765 1.00 0.00 ATOM 378 CE3 TRP A 47 81.642 12.857 -2.979 1.00 0.00 ATOM 379 NE1 TRP A 47 84.060 14.906 -1.367 1.00 0.00 ATOM 380 CZ2 TRP A 47 81.598 15.304 -1.568 1.00 0.00 ATOM 381 CZ3 TRP A 47 80.458 13.556 -2.783 1.00 0.00 ATOM 382 CH2 TRP A 47 80.436 14.744 -2.098 1.00 0.00 ATOM 383 O TRP A 47 83.162 10.636 -0.432 1.00 0.00 ATOM 384 C TRP A 47 83.502 10.187 -1.524 1.00 0.00 ATOM 385 N VAL A 48 82.728 9.398 -2.229 1.00 0.00 ATOM 386 CA VAL A 48 81.401 8.988 -1.770 1.00 0.00 ATOM 387 CB VAL A 48 80.656 8.180 -2.848 1.00 0.00 ATOM 388 CG1 VAL A 48 79.369 7.601 -2.284 1.00 0.00 ATOM 389 CG2 VAL A 48 80.304 9.071 -4.031 1.00 0.00 ATOM 390 O VAL A 48 80.799 8.293 0.455 1.00 0.00 ATOM 391 C VAL A 48 81.520 8.106 -0.527 1.00 0.00 ATOM 392 N GLU A 49 82.411 7.120 -0.586 1.00 0.00 ATOM 393 CA GLU A 49 82.616 6.209 0.541 1.00 0.00 ATOM 394 CB GLU A 49 83.655 5.143 0.186 1.00 0.00 ATOM 395 CG GLU A 49 83.165 4.112 -0.819 1.00 0.00 ATOM 396 CD GLU A 49 84.249 3.128 -1.216 1.00 0.00 ATOM 397 OE1 GLU A 49 85.402 3.297 -0.763 1.00 0.00 ATOM 398 OE2 GLU A 49 83.948 2.190 -1.983 1.00 0.00 ATOM 399 O GLU A 49 82.721 6.749 2.883 1.00 0.00 ATOM 400 C GLU A 49 83.124 7.003 1.747 1.00 0.00 ATOM 401 N ASP A 50 83.919 7.964 1.459 1.00 0.00 ATOM 402 CA ASP A 50 84.492 8.805 2.509 1.00 0.00 ATOM 403 CB ASP A 50 85.559 9.765 1.885 1.00 0.00 ATOM 404 CG ASP A 50 86.834 9.069 1.450 1.00 0.00 ATOM 405 OD1 ASP A 50 87.133 7.968 1.960 1.00 0.00 ATOM 406 OD2 ASP A 50 87.558 9.644 0.598 1.00 0.00 ATOM 407 O ASP A 50 83.376 9.678 4.451 1.00 0.00 ATOM 408 C ASP A 50 83.422 9.637 3.219 1.00 0.00 ATOM 409 N LEU A 51 82.553 10.285 2.441 1.00 0.00 ATOM 410 CA LEU A 51 81.496 11.114 3.012 1.00 0.00 ATOM 411 CB LEU A 51 80.770 11.889 1.905 1.00 0.00 ATOM 412 CG LEU A 51 79.648 12.817 2.387 1.00 0.00 ATOM 413 CD1 LEU A 51 80.214 13.880 3.319 1.00 0.00 ATOM 414 CD2 LEU A 51 78.970 13.459 1.185 1.00 0.00 ATOM 415 O LEU A 51 80.229 10.641 4.999 1.00 0.00 ATOM 416 C LEU A 51 80.525 10.287 3.849 1.00 0.00 ATOM 417 N ILE A 52 80.036 9.207 3.263 1.00 0.00 ATOM 418 CA ILE A 52 79.095 8.336 3.960 1.00 0.00 ATOM 419 CB ILE A 52 78.583 7.193 3.065 1.00 0.00 ATOM 420 CG1 ILE A 52 77.720 7.751 1.929 1.00 0.00 ATOM 421 CG2 ILE A 52 77.798 6.184 3.888 1.00 0.00 ATOM 422 CD1 ILE A 52 77.395 6.739 0.856 1.00 0.00 ATOM 423 O ILE A 52 79.163 7.695 6.336 1.00 0.00 ATOM 424 C ILE A 52 79.761 7.747 5.237 1.00 0.00 ATOM 425 N GLY A 53 81.011 7.318 5.075 1.00 0.00 ATOM 426 CA GLY A 53 81.775 6.744 6.175 1.00 0.00 ATOM 427 O GLY A 53 81.929 7.532 8.430 1.00 0.00 ATOM 428 C GLY A 53 81.955 7.821 7.244 1.00 0.00 ATOM 429 N HIS A 54 82.168 9.052 6.829 1.00 0.00 ATOM 430 CA HIS A 54 82.351 10.133 7.786 1.00 0.00 ATOM 431 CB HIS A 54 82.725 11.433 7.069 1.00 0.00 ATOM 432 CG HIS A 54 82.878 12.605 7.988 1.00 0.00 ATOM 433 CD2 HIS A 54 82.086 13.680 8.202 1.00 0.00 ATOM 434 ND1 HIS A 54 83.963 12.756 8.825 1.00 0.00 ATOM 435 CE1 HIS A 54 83.830 13.875 9.515 1.00 0.00 ATOM 436 NE2 HIS A 54 82.699 14.453 9.157 1.00 0.00 ATOM 437 O HIS A 54 81.081 10.401 9.815 1.00 0.00 ATOM 438 C HIS A 54 81.076 10.327 8.608 1.00 0.00 ATOM 439 N GLN A 55 79.933 10.465 7.908 1.00 0.00 ATOM 440 CA GLN A 55 78.664 10.703 8.576 1.00 0.00 ATOM 441 CB GLN A 55 77.548 10.906 7.549 1.00 0.00 ATOM 442 CG GLN A 55 77.628 12.217 6.789 1.00 0.00 ATOM 443 CD GLN A 55 76.575 12.322 5.704 1.00 0.00 ATOM 444 OE1 GLN A 55 75.828 11.376 5.449 1.00 0.00 ATOM 445 NE2 GLN A 55 76.512 13.480 5.055 1.00 0.00 ATOM 446 O GLN A 55 77.905 9.698 10.619 1.00 0.00 ATOM 447 C GLN A 55 78.354 9.515 9.486 1.00 0.00 ATOM 448 N ASP A 56 78.608 8.277 9.030 1.00 0.00 ATOM 449 CA ASP A 56 78.360 7.080 9.828 1.00 0.00 ATOM 450 CB ASP A 56 78.575 5.821 8.983 1.00 0.00 ATOM 451 CG ASP A 56 77.488 5.563 7.950 1.00 0.00 ATOM 452 OD1 ASP A 56 76.460 6.195 8.027 1.00 0.00 ATOM 453 OD2 ASP A 56 77.748 4.858 7.007 1.00 0.00 ATOM 454 O ASP A 56 78.860 6.425 12.098 1.00 0.00 ATOM 455 C ASP A 56 79.255 6.971 11.055 1.00 0.00 ATOM 456 N SER A 57 80.570 7.297 10.890 1.00 0.00 ATOM 457 CA SER A 57 81.473 7.237 12.025 1.00 0.00 ATOM 458 CB SER A 57 82.885 7.605 11.665 1.00 0.00 ATOM 459 OG SER A 57 83.487 6.589 10.885 1.00 0.00 ATOM 460 O SER A 57 80.987 7.866 14.287 1.00 0.00 ATOM 461 C SER A 57 81.024 8.211 13.109 1.00 0.00 ATOM 462 N ASP A 58 80.683 9.429 12.694 1.00 0.00 ATOM 463 CA ASP A 58 80.244 10.453 13.630 1.00 0.00 ATOM 464 CB ASP A 58 79.881 11.739 12.886 1.00 0.00 ATOM 465 CG ASP A 58 81.099 12.476 12.369 1.00 0.00 ATOM 466 OD1 ASP A 58 82.227 12.125 12.782 1.00 0.00 ATOM 467 OD2 ASP A 58 80.931 13.405 11.548 1.00 0.00 ATOM 468 O ASP A 58 78.931 10.285 15.627 1.00 0.00 ATOM 469 C ASP A 58 79.017 10.024 14.428 1.00 0.00 ATOM 470 N LYS A 59 78.080 9.351 13.807 1.00 0.00 ATOM 471 CA LYS A 59 76.880 8.914 14.507 1.00 0.00 ATOM 472 CB LYS A 59 75.852 8.361 13.519 1.00 0.00 ATOM 473 CG LYS A 59 75.201 9.416 12.633 1.00 0.00 ATOM 474 CD LYS A 59 74.196 8.792 11.675 1.00 0.00 ATOM 475 CE LYS A 59 73.574 9.839 10.764 1.00 0.00 ATOM 476 NZ LYS A 59 72.606 9.239 9.807 1.00 0.00 ATOM 477 O LYS A 59 76.709 7.903 16.673 1.00 0.00 ATOM 478 C LYS A 59 77.161 7.822 15.531 1.00 0.00 ATOM 479 N SER A 60 77.914 6.833 15.193 1.00 0.00 ATOM 480 CA SER A 60 78.232 5.718 16.068 1.00 0.00 ATOM 481 CB SER A 60 78.555 4.448 15.274 1.00 0.00 ATOM 482 OG SER A 60 79.761 4.600 14.546 1.00 0.00 ATOM 483 O SER A 60 79.492 5.326 18.062 1.00 0.00 ATOM 484 C SER A 60 79.420 5.935 16.996 1.00 0.00 ATOM 485 N THR A 61 80.530 6.723 16.710 1.00 0.00 ATOM 486 CA THR A 61 81.743 6.894 17.496 1.00 0.00 ATOM 487 CB THR A 61 81.509 7.832 18.696 1.00 0.00 ATOM 488 CG2 THR A 61 81.009 9.190 18.221 1.00 0.00 ATOM 489 OG1 THR A 61 80.531 7.257 19.570 1.00 0.00 ATOM 490 O THR A 61 82.211 5.367 19.299 1.00 0.00 ATOM 491 C THR A 61 82.204 5.558 18.075 1.00 0.00 ATOM 492 N LEU A 62 82.577 4.596 17.188 1.00 0.00 ATOM 493 CA LEU A 62 83.014 3.264 17.592 1.00 0.00 ATOM 494 CB LEU A 62 82.554 2.279 16.467 1.00 0.00 ATOM 495 CG LEU A 62 81.134 2.492 15.938 1.00 0.00 ATOM 496 CD1 LEU A 62 80.885 1.559 14.739 1.00 0.00 ATOM 497 CD2 LEU A 62 80.137 2.233 17.045 1.00 0.00 ATOM 498 O LEU A 62 85.331 3.862 17.778 1.00 0.00 ATOM 499 C LEU A 62 84.401 3.194 18.213 1.00 0.00 ATOM 500 N ARG A 63 84.547 2.340 19.253 1.00 0.00 ATOM 501 CA ARG A 63 85.815 2.188 19.958 1.00 0.00 ATOM 502 CB ARG A 63 85.601 1.938 21.443 1.00 0.00 ATOM 503 CG ARG A 63 86.876 1.771 22.252 1.00 0.00 ATOM 504 CD ARG A 63 86.660 1.657 23.718 1.00 0.00 ATOM 505 NE ARG A 63 87.865 1.385 24.486 1.00 0.00 ATOM 506 CZ ARG A 63 87.892 1.161 25.814 1.00 0.00 ATOM 507 NH1 ARG A 63 86.791 1.208 26.532 1.00 0.00 ATOM 508 NH2 ARG A 63 89.060 0.915 26.384 1.00 0.00 ATOM 509 O ARG A 63 87.905 1.170 19.394 1.00 0.00 ATOM 510 C ARG A 63 86.681 1.116 19.305 1.00 0.00 ATOM 511 N ARG A 64 86.027 0.148 18.682 1.00 0.00 ATOM 512 CA ARG A 64 86.734 -0.937 18.008 1.00 0.00 ATOM 513 CB ARG A 64 86.764 -2.193 18.865 1.00 0.00 ATOM 514 CG ARG A 64 87.533 -2.060 20.170 1.00 0.00 ATOM 515 CD ARG A 64 87.499 -3.271 21.027 1.00 0.00 ATOM 516 NE ARG A 64 88.340 -3.198 22.212 1.00 0.00 ATOM 517 CZ ARG A 64 88.527 -4.209 23.081 1.00 0.00 ATOM 518 NH1 ARG A 64 87.912 -5.362 22.924 1.00 0.00 ATOM 519 NH2 ARG A 64 89.332 -4.007 24.110 1.00 0.00 ATOM 520 O ARG A 64 84.982 -1.603 16.510 1.00 0.00 ATOM 521 C ARG A 64 86.130 -1.183 16.632 1.00 0.00 ATOM 522 N GLY A 65 86.917 -0.905 15.598 1.00 0.00 ATOM 523 CA GLY A 65 86.460 -1.075 14.226 1.00 0.00 ATOM 524 O GLY A 65 88.467 -2.305 13.801 1.00 0.00 ATOM 525 C GLY A 65 87.272 -2.164 13.547 1.00 0.00 ATOM 526 N ILE A 66 86.633 -2.987 12.854 1.00 0.00 ATOM 527 CA ILE A 66 87.341 -4.024 12.116 1.00 0.00 ATOM 528 CB ILE A 66 86.918 -5.437 12.562 1.00 0.00 ATOM 529 CG1 ILE A 66 87.556 -6.494 11.656 1.00 0.00 ATOM 530 CG2 ILE A 66 85.402 -5.567 12.552 1.00 0.00 ATOM 531 CD1 ILE A 66 87.477 -7.899 12.209 1.00 0.00 ATOM 532 O ILE A 66 85.873 -3.791 10.234 1.00 0.00 ATOM 533 C ILE A 66 87.036 -3.814 10.637 1.00 0.00 ATOM 534 N ASP A 67 88.082 -3.639 9.836 1.00 0.00 ATOM 535 CA ASP A 67 87.928 -3.467 8.399 1.00 0.00 ATOM 536 CB ASP A 67 88.667 -2.272 7.834 1.00 0.00 ATOM 537 CG ASP A 67 88.248 -2.009 6.359 1.00 0.00 ATOM 538 OD1 ASP A 67 88.511 -2.907 5.458 1.00 0.00 ATOM 539 OD2 ASP A 67 87.614 -0.972 5.981 1.00 0.00 ATOM 540 O ASP A 67 89.396 -5.332 8.085 1.00 0.00 ATOM 541 C ASP A 67 88.390 -4.742 7.701 1.00 0.00 ATOM 542 N ILE A 68 87.661 -5.163 6.673 1.00 0.00 ATOM 543 CA ILE A 68 88.046 -6.345 5.917 1.00 0.00 ATOM 544 CB ILE A 68 87.010 -7.481 6.038 1.00 0.00 ATOM 545 CG1 ILE A 68 86.855 -7.910 7.499 1.00 0.00 ATOM 546 CG2 ILE A 68 87.417 -8.661 5.173 1.00 0.00 ATOM 547 CD1 ILE A 68 85.722 -8.883 7.730 1.00 0.00 ATOM 548 O ILE A 68 87.224 -5.440 3.857 1.00 0.00 ATOM 549 C ILE A 68 88.196 -5.882 4.473 1.00 0.00 ATOM 550 N GLY A 69 89.499 -5.947 3.870 1.00 0.00 ATOM 551 CA GLY A 69 89.747 -5.533 2.501 1.00 0.00 ATOM 552 O GLY A 69 89.460 -3.163 2.538 1.00 0.00 ATOM 553 C GLY A 69 90.251 -4.101 2.534 1.00 0.00 ATOM 554 N THR A 70 91.565 -3.931 2.597 1.00 0.00 ATOM 555 CA THR A 70 92.172 -2.597 2.653 1.00 0.00 ATOM 556 CB THR A 70 93.825 -2.896 2.956 1.00 0.00 ATOM 557 CG2 THR A 70 94.563 -1.707 3.564 1.00 0.00 ATOM 558 OG1 THR A 70 94.059 -4.072 3.729 1.00 0.00 ATOM 559 O THR A 70 92.279 -0.816 1.082 1.00 0.00 ATOM 560 C THR A 70 92.464 -2.022 1.295 1.00 0.00 ATOM 561 N GLY A 71 92.982 -2.886 0.389 1.00 0.00 ATOM 562 CA GLY A 71 93.316 -2.353 -0.953 1.00 0.00 ATOM 563 O GLY A 71 95.607 -1.674 -0.724 1.00 0.00 ATOM 564 C GLY A 71 94.436 -1.312 -0.863 1.00 0.00 ATOM 565 N ALA A 72 94.129 0.042 -0.955 1.00 0.00 ATOM 566 CA ALA A 72 95.146 1.092 -0.928 1.00 0.00 ATOM 567 CB ALA A 72 95.033 1.967 -2.188 1.00 0.00 ATOM 568 O ALA A 72 95.963 2.828 0.507 1.00 0.00 ATOM 569 C ALA A 72 95.075 1.994 0.303 1.00 0.00 ATOM 570 N SER A 73 94.012 1.678 1.213 1.00 0.00 ATOM 571 CA SER A 73 93.899 2.378 2.483 1.00 0.00 ATOM 572 CB SER A 73 95.262 2.854 2.940 1.00 0.00 ATOM 573 OG SER A 73 96.211 1.821 2.933 1.00 0.00 ATOM 574 O SER A 73 92.962 4.323 3.503 1.00 0.00 ATOM 575 C SER A 73 92.967 3.575 2.525 1.00 0.00 ATOM 576 N CYS A 74 92.165 3.761 1.480 1.00 0.00 ATOM 577 CA CYS A 74 91.244 4.895 1.445 1.00 0.00 ATOM 578 CB CYS A 74 90.420 4.874 0.155 1.00 0.00 ATOM 579 SG CYS A 74 89.250 6.242 -0.004 1.00 0.00 ATOM 580 O CYS A 74 90.159 5.890 3.338 1.00 0.00 ATOM 581 C CYS A 74 90.248 4.905 2.607 1.00 0.00 ATOM 582 N ILE A 75 89.505 3.820 2.765 1.00 0.00 ATOM 583 CA ILE A 75 88.535 3.750 3.849 1.00 0.00 ATOM 584 CB ILE A 75 87.654 2.490 3.736 1.00 0.00 ATOM 585 CG1 ILE A 75 86.821 2.535 2.452 1.00 0.00 ATOM 586 CG2 ILE A 75 86.751 2.363 4.954 1.00 0.00 ATOM 587 CD1 ILE A 75 85.903 3.732 2.359 1.00 0.00 ATOM 588 O ILE A 75 88.682 4.304 6.176 1.00 0.00 ATOM 589 C ILE A 75 89.217 3.748 5.214 1.00 0.00 ATOM 590 N TYR A 76 90.434 3.151 5.271 1.00 0.00 ATOM 591 CA TYR A 76 91.160 3.136 6.539 1.00 0.00 ATOM 592 CB TYR A 76 92.462 2.343 6.389 1.00 0.00 ATOM 593 CG TYR A 76 92.255 0.859 6.192 1.00 0.00 ATOM 594 CD1 TYR A 76 90.984 0.332 6.021 1.00 0.00 ATOM 595 CD2 TYR A 76 93.333 -0.013 6.180 1.00 0.00 ATOM 596 CE1 TYR A 76 90.790 -1.024 5.842 1.00 0.00 ATOM 597 CE2 TYR A 76 93.151 -1.370 6.003 1.00 0.00 ATOM 598 CZ TYR A 76 91.877 -1.873 5.832 1.00 0.00 ATOM 599 OH TYR A 76 91.691 -3.223 5.653 1.00 0.00 ATOM 600 O TYR A 76 91.142 4.950 8.119 1.00 0.00 ATOM 601 C TYR A 76 91.428 4.571 6.973 1.00 0.00 ATOM 602 N PRO A 77 91.981 5.407 6.070 1.00 0.00 ATOM 603 CA PRO A 77 92.221 6.789 6.500 1.00 0.00 ATOM 604 CB PRO A 77 92.947 7.499 5.450 1.00 0.00 ATOM 605 CG PRO A 77 93.723 6.391 4.768 1.00 0.00 ATOM 606 CD PRO A 77 92.735 5.238 4.726 1.00 0.00 ATOM 607 O PRO A 77 90.823 8.264 7.798 1.00 0.00 ATOM 608 C PRO A 77 90.905 7.483 6.843 1.00 0.00 ATOM 609 N LEU A 78 89.878 7.183 6.061 1.00 0.00 ATOM 610 CA LEU A 78 88.562 7.769 6.267 1.00 0.00 ATOM 611 CB LEU A 78 87.584 7.225 5.239 1.00 0.00 ATOM 612 CG LEU A 78 86.162 7.750 5.322 1.00 0.00 ATOM 613 CD1 LEU A 78 86.112 9.289 5.239 1.00 0.00 ATOM 614 CD2 LEU A 78 85.318 7.176 4.155 1.00 0.00 ATOM 615 O LEU A 78 87.585 8.358 8.381 1.00 0.00 ATOM 616 C LEU A 78 88.021 7.460 7.662 1.00 0.00 ATOM 617 N LEU A 79 88.083 6.190 8.055 1.00 0.00 ATOM 618 CA LEU A 79 87.577 5.784 9.360 1.00 0.00 ATOM 619 CB LEU A 79 87.418 4.263 9.424 1.00 0.00 ATOM 620 CG LEU A 79 86.359 3.658 8.503 1.00 0.00 ATOM 621 CD1 LEU A 79 86.392 2.139 8.571 1.00 0.00 ATOM 622 CD2 LEU A 79 84.967 4.121 8.908 1.00 0.00 ATOM 623 O LEU A 79 87.998 6.706 11.529 1.00 0.00 ATOM 624 C LEU A 79 88.478 6.182 10.524 1.00 0.00 ATOM 625 N GLY A 80 89.747 5.902 10.364 1.00 0.00 ATOM 626 CA GLY A 80 90.728 6.218 11.402 1.00 0.00 ATOM 627 O GLY A 80 91.016 8.001 12.969 1.00 0.00 ATOM 628 C GLY A 80 90.805 7.680 11.804 1.00 0.00 ATOM 629 N ALA A 81 90.630 8.605 10.833 1.00 0.00 ATOM 630 CA ALA A 81 90.663 10.026 11.119 1.00 0.00 ATOM 631 CB ALA A 81 90.487 10.831 9.839 1.00 0.00 ATOM 632 O ALA A 81 89.643 11.486 12.713 1.00 0.00 ATOM 633 C ALA A 81 89.541 10.449 12.062 1.00 0.00 ATOM 634 N THR A 82 88.478 9.650 12.122 1.00 0.00 ATOM 635 CA THR A 82 87.335 9.989 12.973 1.00 0.00 ATOM 636 CB THR A 82 85.998 9.718 12.260 1.00 0.00 ATOM 637 CG2 THR A 82 85.898 10.544 10.985 1.00 0.00 ATOM 638 OG1 THR A 82 85.901 8.327 11.933 1.00 0.00 ATOM 639 O THR A 82 86.507 9.405 15.147 1.00 0.00 ATOM 640 C THR A 82 87.365 9.203 14.288 1.00 0.00 ATOM 641 N LEU A 83 88.333 8.313 14.453 1.00 0.00 ATOM 642 CA LEU A 83 88.419 7.521 15.669 1.00 0.00 ATOM 643 CB LEU A 83 89.618 6.581 15.612 1.00 0.00 ATOM 644 CG LEU A 83 89.459 5.396 14.657 1.00 0.00 ATOM 645 CD1 LEU A 83 90.731 4.562 14.657 1.00 0.00 ATOM 646 CD2 LEU A 83 88.268 4.553 15.090 1.00 0.00 ATOM 647 O LEU A 83 87.952 7.989 17.982 1.00 0.00 ATOM 648 C LEU A 83 88.570 8.322 16.967 1.00 0.00 ATOM 649 N ASN A 84 89.400 9.327 16.924 1.00 0.00 ATOM 650 CA ASN A 84 89.640 10.151 18.125 1.00 0.00 ATOM 651 CB ASN A 84 88.456 11.056 18.409 1.00 0.00 ATOM 652 CG ASN A 84 88.748 12.138 19.410 1.00 0.00 ATOM 653 ND2 ASN A 84 87.724 12.553 20.110 1.00 0.00 ATOM 654 OD1 ASN A 84 89.902 12.543 19.599 1.00 0.00 ATOM 655 O ASN A 84 89.105 9.033 20.188 1.00 0.00 ATOM 656 C ASN A 84 89.941 9.207 19.300 1.00 0.00 ATOM 657 N GLY A 85 91.069 8.451 19.201 1.00 0.00 ATOM 658 CA GLY A 85 91.463 7.575 20.294 1.00 0.00 ATOM 659 O GLY A 85 90.527 5.919 21.754 1.00 0.00 ATOM 660 C GLY A 85 90.945 6.187 20.632 1.00 0.00 ATOM 661 N TRP A 86 90.506 5.268 19.683 1.00 0.00 ATOM 662 CA TRP A 86 90.024 3.907 19.920 1.00 0.00 ATOM 663 CB TRP A 86 89.107 4.732 19.009 1.00 0.00 ATOM 664 CG TRP A 86 87.959 5.366 19.730 1.00 0.00 ATOM 665 CD1 TRP A 86 87.688 5.290 21.067 1.00 0.00 ATOM 666 CD2 TRP A 86 86.929 6.180 19.154 1.00 0.00 ATOM 667 CE2 TRP A 86 86.067 6.558 20.200 1.00 0.00 ATOM 668 CE3 TRP A 86 86.652 6.623 17.857 1.00 0.00 ATOM 669 NE1 TRP A 86 86.549 6.003 21.358 1.00 0.00 ATOM 670 CZ2 TRP A 86 84.942 7.361 19.991 1.00 0.00 ATOM 671 CZ3 TRP A 86 85.541 7.418 17.655 1.00 0.00 ATOM 672 CH2 TRP A 86 84.696 7.779 18.710 1.00 0.00 ATOM 673 O TRP A 86 92.131 3.578 18.822 1.00 0.00 ATOM 674 C TRP A 86 91.014 3.122 19.065 1.00 0.00 ATOM 675 N TYR A 87 90.595 1.952 18.600 1.00 0.00 ATOM 676 CA TYR A 87 91.454 1.110 17.778 1.00 0.00 ATOM 677 CB TYR A 87 91.853 -0.154 18.543 1.00 0.00 ATOM 678 CG TYR A 87 92.677 0.111 19.781 1.00 0.00 ATOM 679 CD1 TYR A 87 92.065 0.320 21.013 1.00 0.00 ATOM 680 CD2 TYR A 87 94.065 0.155 19.718 1.00 0.00 ATOM 681 CE1 TYR A 87 92.812 0.564 22.148 1.00 0.00 ATOM 682 CE2 TYR A 87 94.825 0.396 20.843 1.00 0.00 ATOM 683 CZ TYR A 87 94.186 0.603 22.066 1.00 0.00 ATOM 684 OH TYR A 87 94.930 0.844 23.198 1.00 0.00 ATOM 685 O TYR A 87 89.580 0.384 16.477 1.00 0.00 ATOM 686 C TYR A 87 90.781 0.665 16.497 1.00 0.00 ATOM 687 N PHE A 88 91.571 0.572 15.436 1.00 0.00 ATOM 688 CA PHE A 88 91.071 0.091 14.158 1.00 0.00 ATOM 689 CB PHE A 88 91.089 1.216 13.119 1.00 0.00 ATOM 690 CG PHE A 88 90.739 0.764 11.732 1.00 0.00 ATOM 691 CD1 PHE A 88 89.427 0.470 11.392 1.00 0.00 ATOM 692 CD2 PHE A 88 91.720 0.630 10.762 1.00 0.00 ATOM 693 CE1 PHE A 88 89.103 0.054 10.115 1.00 0.00 ATOM 694 CE2 PHE A 88 91.402 0.216 9.482 1.00 0.00 ATOM 695 CZ PHE A 88 90.090 -0.074 9.160 1.00 0.00 ATOM 696 O PHE A 88 93.158 -0.956 13.618 1.00 0.00 ATOM 697 C PHE A 88 91.940 -1.083 13.740 1.00 0.00 ATOM 698 N LEU A 89 91.304 -2.232 13.558 1.00 0.00 ATOM 699 CA LEU A 89 92.003 -3.438 13.131 1.00 0.00 ATOM 700 CB LEU A 89 91.674 -4.601 14.076 1.00 0.00 ATOM 701 CG LEU A 89 92.653 -4.787 15.246 1.00 0.00 ATOM 702 CD1 LEU A 89 92.664 -3.540 16.119 1.00 0.00 ATOM 703 CD2 LEU A 89 92.249 -6.009 16.056 1.00 0.00 ATOM 704 O LEU A 89 90.351 -3.657 11.410 1.00 0.00 ATOM 705 C LEU A 89 91.550 -3.672 11.694 1.00 0.00 ATOM 706 N ALA A 90 92.550 -3.815 10.824 1.00 0.00 ATOM 707 CA ALA A 90 92.217 -4.017 9.420 1.00 0.00 ATOM 708 CB ALA A 90 92.726 -2.853 8.582 1.00 0.00 ATOM 709 O ALA A 90 94.077 -5.491 8.978 1.00 0.00 ATOM 710 C ALA A 90 92.867 -5.276 8.839 1.00 0.00 ATOM 711 N THR A 91 92.042 -6.133 8.248 1.00 0.00 ATOM 712 CA THR A 91 92.508 -7.381 7.660 1.00 0.00 ATOM 713 CB THR A 91 91.385 -8.414 7.608 1.00 0.00 ATOM 714 CG2 THR A 91 91.920 -9.731 7.069 1.00 0.00 ATOM 715 OG1 THR A 91 90.864 -8.601 8.930 1.00 0.00 ATOM 716 O THR A 91 92.014 -6.734 5.402 1.00 0.00 ATOM 717 C THR A 91 92.811 -7.277 6.168 1.00 0.00 ATOM 718 N GLU A 92 93.987 -7.768 5.776 1.00 0.00 ATOM 719 CA GLU A 92 94.427 -7.753 4.379 1.00 0.00 ATOM 720 CB GLU A 92 95.310 -6.529 4.122 1.00 0.00 ATOM 721 CG GLU A 92 95.769 -6.378 2.678 1.00 0.00 ATOM 722 CD GLU A 92 94.604 -6.152 1.756 1.00 0.00 ATOM 723 OE1 GLU A 92 93.502 -6.035 2.236 1.00 0.00 ATOM 724 OE2 GLU A 92 94.828 -5.982 0.578 1.00 0.00 ATOM 725 O GLU A 92 96.086 -9.408 4.887 1.00 0.00 ATOM 726 C GLU A 92 95.143 -9.083 4.171 1.00 0.00 ATOM 727 N VAL A 93 94.697 -9.824 3.152 1.00 0.00 ATOM 728 CA VAL A 93 95.269 -11.135 2.873 1.00 0.00 ATOM 729 CB VAL A 93 94.183 -12.004 2.087 1.00 0.00 ATOM 730 CG1 VAL A 93 94.765 -13.349 1.672 1.00 0.00 ATOM 731 CG2 VAL A 93 92.954 -12.184 2.938 1.00 0.00 ATOM 732 O VAL A 93 97.520 -11.757 2.294 1.00 0.00 ATOM 733 C VAL A 93 96.549 -11.035 2.051 1.00 0.00 ATOM 734 N ASP A 94 96.542 -10.094 1.084 1.00 0.00 ATOM 735 CA ASP A 94 97.691 -9.877 0.216 1.00 0.00 ATOM 736 CB ASP A 94 97.289 -9.054 -1.012 1.00 0.00 ATOM 737 CG ASP A 94 98.408 -8.840 -2.021 1.00 0.00 ATOM 738 OD1 ASP A 94 99.513 -9.249 -1.749 1.00 0.00 ATOM 739 OD2 ASP A 94 98.123 -8.416 -3.114 1.00 0.00 ATOM 740 O ASP A 94 98.728 -8.024 1.322 1.00 0.00 ATOM 741 C ASP A 94 98.852 -9.174 0.914 1.00 0.00 ATOM 742 N ASP A 95 100.032 -9.910 0.965 1.00 0.00 ATOM 743 CA ASP A 95 101.223 -9.361 1.611 1.00 0.00 ATOM 744 CB ASP A 95 102.375 -10.371 1.557 1.00 0.00 ATOM 745 CG ASP A 95 103.625 -9.937 2.314 1.00 0.00 ATOM 746 OD1 ASP A 95 103.541 -9.762 3.506 1.00 0.00 ATOM 747 OD2 ASP A 95 104.680 -9.940 1.726 1.00 0.00 ATOM 748 O ASP A 95 102.171 -7.159 1.715 1.00 0.00 ATOM 749 C ASP A 95 101.712 -8.053 1.001 1.00 0.00 ATOM 750 N MET A 96 101.645 -7.951 -0.326 1.00 0.00 ATOM 751 CA MET A 96 102.105 -6.753 -1.017 1.00 0.00 ATOM 752 CB MET A 96 102.031 -6.926 -2.535 1.00 0.00 ATOM 753 CG MET A 96 103.036 -7.918 -3.100 1.00 0.00 ATOM 754 SD MET A 96 104.743 -7.433 -2.779 1.00 0.00 ATOM 755 CE MET A 96 104.887 -5.985 -3.821 1.00 0.00 ATOM 756 O MET A 96 101.717 -4.491 -0.334 1.00 0.00 ATOM 757 C MET A 96 101.219 -5.573 -0.634 1.00 0.00 ATOM 758 N CYS A 97 99.915 -5.764 -0.630 1.00 0.00 ATOM 759 CA CYS A 97 99.008 -4.685 -0.253 1.00 0.00 ATOM 760 CB CYS A 97 97.563 -5.115 -0.501 1.00 0.00 ATOM 761 SG CYS A 97 97.119 -5.270 -2.248 1.00 0.00 ATOM 762 O CYS A 97 99.056 -3.166 1.596 1.00 0.00 ATOM 763 C CYS A 97 99.173 -4.332 1.219 1.00 0.00 ATOM 764 N PHE A 98 99.393 -5.341 2.057 1.00 0.00 ATOM 765 CA PHE A 98 99.559 -5.107 3.492 1.00 0.00 ATOM 766 CB PHE A 98 100.453 -6.308 4.162 1.00 0.00 ATOM 767 CG PHE A 98 100.397 -6.312 5.675 1.00 0.00 ATOM 768 CD1 PHE A 98 99.165 -6.448 6.316 1.00 0.00 ATOM 769 CD2 PHE A 98 101.549 -6.183 6.457 1.00 0.00 ATOM 770 CE1 PHE A 98 99.042 -6.469 7.704 1.00 0.00 ATOM 771 CE2 PHE A 98 101.454 -6.192 7.843 1.00 0.00 ATOM 772 CZ PHE A 98 100.209 -6.338 8.466 1.00 0.00 ATOM 773 O PHE A 98 100.725 -3.281 4.552 1.00 0.00 ATOM 774 C PHE A 98 100.767 -4.198 3.727 1.00 0.00 ATOM 775 N ASN A 99 101.840 -4.439 2.964 1.00 0.00 ATOM 776 CA ASN A 99 103.024 -3.591 3.071 1.00 0.00 ATOM 777 CB ASN A 99 104.129 -4.111 2.172 1.00 0.00 ATOM 778 CG ASN A 99 104.745 -5.396 2.652 1.00 0.00 ATOM 779 ND2 ASN A 99 105.461 -6.044 1.766 1.00 0.00 ATOM 780 OD1 ASN A 99 104.637 -5.761 3.827 1.00 0.00 ATOM 781 O ASN A 99 103.079 -1.222 3.478 1.00 0.00 ATOM 782 C ASN A 99 102.694 -2.135 2.743 1.00 0.00 ATOM 783 N TYR A 100 101.987 -1.935 1.645 1.00 0.00 ATOM 784 CA TYR A 100 101.589 -0.593 1.201 1.00 0.00 ATOM 785 CB TYR A 100 100.790 -0.658 -0.105 1.00 0.00 ATOM 786 CG TYR A 100 101.604 -1.110 -1.297 1.00 0.00 ATOM 787 CD1 TYR A 100 102.993 -1.118 -1.247 1.00 0.00 ATOM 788 CD2 TYR A 100 100.979 -1.526 -2.464 1.00 0.00 ATOM 789 CE1 TYR A 100 103.742 -1.531 -2.330 1.00 0.00 ATOM 790 CE2 TYR A 100 101.714 -1.942 -3.561 1.00 0.00 ATOM 791 CZ TYR A 100 103.107 -1.939 -3.484 1.00 0.00 ATOM 792 OH TYR A 100 103.852 -2.350 -4.566 1.00 0.00 ATOM 793 O TYR A 100 100.807 1.288 2.505 1.00 0.00 ATOM 794 C TYR A 100 100.678 0.088 2.235 1.00 0.00 ATOM 795 N ALA A 101 99.770 -0.675 2.815 1.00 0.00 ATOM 796 CA ALA A 101 98.876 -0.141 3.843 1.00 0.00 ATOM 797 CB ALA A 101 97.910 -1.222 4.298 1.00 0.00 ATOM 798 O ALA A 101 99.345 1.353 5.656 1.00 0.00 ATOM 799 C ALA A 101 99.651 0.316 5.070 1.00 0.00 ATOM 800 N LYS A 102 100.653 -0.467 5.462 1.00 0.00 ATOM 801 CA LYS A 102 101.461 -0.120 6.623 1.00 0.00 ATOM 802 CB LYS A 102 102.453 -1.238 6.939 1.00 0.00 ATOM 803 CG LYS A 102 103.315 -0.987 8.171 1.00 0.00 ATOM 804 CD LYS A 102 104.220 -2.175 8.464 1.00 0.00 ATOM 805 CE LYS A 102 105.108 -1.908 9.669 1.00 0.00 ATOM 806 NZ LYS A 102 106.019 -3.049 9.955 1.00 0.00 ATOM 807 O LYS A 102 102.193 2.097 7.186 1.00 0.00 ATOM 808 C LYS A 102 102.177 1.205 6.343 1.00 0.00 ATOM 809 N LYS A 103 102.774 1.321 5.165 1.00 0.00 ATOM 810 CA LYS A 103 103.464 2.555 4.792 1.00 0.00 ATOM 811 CB LYS A 103 104.118 2.408 3.414 1.00 0.00 ATOM 812 CG LYS A 103 105.310 1.461 3.391 1.00 0.00 ATOM 813 CD LYS A 103 105.910 1.364 1.999 1.00 0.00 ATOM 814 CE LYS A 103 107.084 0.400 1.971 1.00 0.00 ATOM 815 NZ LYS A 103 107.663 0.268 0.603 1.00 0.00 ATOM 816 O LYS A 103 102.788 4.820 5.243 1.00 0.00 ATOM 817 C LYS A 103 102.477 3.723 4.767 1.00 0.00 ATOM 818 N ASN A 104 101.288 3.472 4.228 1.00 0.00 ATOM 819 CA ASN A 104 100.278 4.526 4.161 1.00 0.00 ATOM 820 CB ASN A 104 99.053 4.052 3.400 1.00 0.00 ATOM 821 CG ASN A 104 99.279 3.900 1.921 1.00 0.00 ATOM 822 ND2 ASN A 104 98.525 3.013 1.323 1.00 0.00 ATOM 823 OD1 ASN A 104 100.076 4.626 1.317 1.00 0.00 ATOM 824 O ASN A 104 99.759 6.226 5.770 1.00 0.00 ATOM 825 C ASN A 104 99.872 5.022 5.543 1.00 0.00 ATOM 826 N VAL A 105 99.648 4.096 6.497 1.00 0.00 ATOM 827 CA VAL A 105 99.248 4.485 7.840 1.00 0.00 ATOM 828 CB VAL A 105 98.849 3.255 8.635 1.00 0.00 ATOM 829 CG1 VAL A 105 98.421 3.682 9.999 1.00 0.00 ATOM 830 CG2 VAL A 105 97.732 2.476 7.931 1.00 0.00 ATOM 831 O VAL A 105 100.114 6.213 9.272 1.00 0.00 ATOM 832 C VAL A 105 100.367 5.236 8.563 1.00 0.00 ATOM 833 N GLU A 106 101.608 4.792 8.368 1.00 0.00 ATOM 834 CA GLU A 106 102.753 5.439 8.995 1.00 0.00 ATOM 835 CB GLU A 106 104.035 4.651 8.718 1.00 0.00 ATOM 836 CG GLU A 106 104.132 3.327 9.463 1.00 0.00 ATOM 837 CD GLU A 106 105.349 2.553 9.042 1.00 0.00 ATOM 838 OE1 GLU A 106 106.038 2.997 8.155 1.00 0.00 ATOM 839 OE2 GLU A 106 105.656 1.573 9.680 1.00 0.00 ATOM 840 O GLU A 106 103.149 7.787 9.274 1.00 0.00 ATOM 841 C GLU A 106 102.909 6.878 8.482 1.00 0.00 ATOM 842 N GLN A 107 102.751 7.058 7.190 1.00 0.00 ATOM 843 CA GLN A 107 102.855 8.404 6.604 1.00 0.00 ATOM 844 CB GLN A 107 102.817 8.321 5.076 1.00 0.00 ATOM 845 CG GLN A 107 104.063 7.718 4.452 1.00 0.00 ATOM 846 CD GLN A 107 103.940 7.564 2.949 1.00 0.00 ATOM 847 OE1 GLN A 107 102.886 7.832 2.366 1.00 0.00 ATOM 848 NE2 GLN A 107 105.019 7.121 2.309 1.00 0.00 ATOM 849 O GLN A 107 101.959 10.486 7.372 1.00 0.00 ATOM 850 C GLN A 107 101.737 9.304 7.117 1.00 0.00 ATOM 851 N ASN A 108 100.543 8.725 7.272 1.00 0.00 ATOM 852 CA ASN A 108 99.385 9.484 7.740 1.00 0.00 ATOM 853 CB ASN A 108 98.090 8.865 7.251 1.00 0.00 ATOM 854 CG ASN A 108 97.867 9.015 5.774 1.00 0.00 ATOM 855 ND2 ASN A 108 97.014 8.177 5.241 1.00 0.00 ATOM 856 OD1 ASN A 108 98.404 9.925 5.132 1.00 0.00 ATOM 857 O ASN A 108 98.432 10.174 9.755 1.00 0.00 ATOM 858 C ASN A 108 99.368 9.620 9.241 1.00 0.00 ATOM 859 N ASN A 109 100.307 9.057 9.917 1.00 0.00 ATOM 860 CA ASN A 109 100.391 9.179 11.379 1.00 0.00 ATOM 861 CB ASN A 109 100.528 10.627 11.813 1.00 0.00 ATOM 862 CG ASN A 109 101.847 11.246 11.443 1.00 0.00 ATOM 863 ND2 ASN A 109 101.857 12.553 11.375 1.00 0.00 ATOM 864 OD1 ASN A 109 102.862 10.555 11.298 1.00 0.00 ATOM 865 O ASN A 109 98.855 9.020 13.237 1.00 0.00 ATOM 866 C ASN A 109 99.214 8.548 12.140 1.00 0.00 ATOM 867 N LEU A 110 98.675 7.498 11.645 1.00 0.00 ATOM 868 CA LEU A 110 97.575 6.824 12.338 1.00 0.00 ATOM 869 CB LEU A 110 96.334 6.780 11.444 1.00 0.00 ATOM 870 CG LEU A 110 95.747 8.133 11.030 1.00 0.00 ATOM 871 CD1 LEU A 110 94.597 7.941 10.055 1.00 0.00 ATOM 872 CD2 LEU A 110 95.224 8.882 12.244 1.00 0.00 ATOM 873 O LEU A 110 97.164 4.556 13.100 1.00 0.00 ATOM 874 C LEU A 110 97.997 5.383 12.695 1.00 0.00 ATOM 875 N SER A 111 99.294 5.141 12.571 1.00 0.00 ATOM 876 CA SER A 111 99.875 3.823 12.864 1.00 0.00 ATOM 877 CB SER A 111 101.375 3.854 12.656 1.00 0.00 ATOM 878 OG SER A 111 102.016 4.715 13.556 1.00 0.00 ATOM 879 O SER A 111 99.369 2.164 14.519 1.00 0.00 ATOM 880 C SER A 111 99.584 3.353 14.288 1.00 0.00 ATOM 881 N ASP A 112 99.569 4.280 15.191 1.00 0.00 ATOM 882 CA ASP A 112 99.296 3.933 16.586 1.00 0.00 ATOM 883 CB ASP A 112 99.548 5.136 17.500 1.00 0.00 ATOM 884 CG ASP A 112 101.021 5.463 17.719 1.00 0.00 ATOM 885 OD1 ASP A 112 101.846 4.649 17.374 1.00 0.00 ATOM 886 OD2 ASP A 112 101.313 6.576 18.081 1.00 0.00 ATOM 887 O ASP A 112 97.678 2.531 17.580 1.00 0.00 ATOM 888 C ASP A 112 97.888 3.408 16.751 1.00 0.00 ATOM 889 N LEU A 113 96.945 3.907 15.968 1.00 0.00 ATOM 890 CA LEU A 113 95.537 3.555 16.121 1.00 0.00 ATOM 891 CB LEU A 113 94.625 4.676 15.613 1.00 0.00 ATOM 892 CG LEU A 113 94.693 5.999 16.380 1.00 0.00 ATOM 893 CD1 LEU A 113 93.807 7.048 15.722 1.00 0.00 ATOM 894 CD2 LEU A 113 94.222 5.818 17.815 1.00 0.00 ATOM 895 O LEU A 113 94.172 1.644 15.644 1.00 0.00 ATOM 896 C LEU A 113 95.165 2.304 15.327 1.00 0.00 ATOM 897 N ILE A 114 95.949 1.983 14.307 1.00 0.00 ATOM 898 CA ILE A 114 95.641 0.848 13.444 1.00 0.00 ATOM 899 CB ILE A 114 95.575 1.266 11.963 1.00 0.00 ATOM 900 CG1 ILE A 114 94.584 2.417 11.777 1.00 0.00 ATOM 901 CG2 ILE A 114 95.189 0.080 11.093 1.00 0.00 ATOM 902 CD1 ILE A 114 94.460 2.893 10.349 1.00 0.00 ATOM 903 O ILE A 114 97.794 -0.177 13.372 1.00 0.00 ATOM 904 C ILE A 114 96.583 -0.350 13.444 1.00 0.00 ATOM 905 N LYS A 115 96.003 -1.514 13.536 1.00 0.00 ATOM 906 CA LYS A 115 96.766 -2.788 13.511 1.00 0.00 ATOM 907 CB LYS A 115 96.421 -3.582 14.771 1.00 0.00 ATOM 908 CG LYS A 115 96.810 -2.883 16.067 1.00 0.00 ATOM 909 CD LYS A 115 96.498 -3.754 17.276 1.00 0.00 ATOM 910 CE LYS A 115 96.873 -3.053 18.572 1.00 0.00 ATOM 911 NZ LYS A 115 96.655 -3.926 19.756 1.00 0.00 ATOM 912 O LYS A 115 95.220 -3.888 12.060 1.00 0.00 ATOM 913 C LYS A 115 96.389 -3.565 12.265 1.00 0.00 ATOM 914 N VAL A 116 97.376 -3.883 11.442 1.00 0.00 ATOM 915 CA VAL A 116 97.129 -4.645 10.228 1.00 0.00 ATOM 916 CB VAL A 116 97.776 -3.825 9.048 1.00 0.00 ATOM 917 CG1 VAL A 116 97.446 -2.343 9.159 1.00 0.00 ATOM 918 CG2 VAL A 116 99.294 -4.014 9.128 1.00 0.00 ATOM 919 O VAL A 116 98.275 -6.558 11.064 1.00 0.00 ATOM 920 C VAL A 116 97.280 -6.135 10.500 1.00 0.00 ATOM 921 N VAL A 117 96.269 -6.908 10.115 1.00 0.00 ATOM 922 CA VAL A 117 96.274 -8.358 10.267 1.00 0.00 ATOM 923 CB VAL A 117 94.972 -8.887 10.967 1.00 0.00 ATOM 924 CG1 VAL A 117 95.061 -10.379 11.278 1.00 0.00 ATOM 925 CG2 VAL A 117 94.651 -8.098 12.229 1.00 0.00 ATOM 926 O VAL A 117 95.617 -8.854 8.012 1.00 0.00 ATOM 927 C VAL A 117 96.492 -8.934 8.877 1.00 0.00 ATOM 928 N LYS A 118 97.661 -9.533 8.664 1.00 0.00 ATOM 929 CA LYS A 118 97.972 -10.104 7.364 1.00 0.00 ATOM 930 CB LYS A 118 99.375 -9.504 6.896 1.00 0.00 ATOM 931 CG LYS A 118 100.522 -10.021 7.749 1.00 0.00 ATOM 932 CD LYS A 118 100.653 -9.234 9.045 1.00 0.00 ATOM 933 CE LYS A 118 101.856 -9.701 9.856 1.00 0.00 ATOM 934 NZ LYS A 118 103.131 -9.569 9.096 1.00 0.00 ATOM 935 O LYS A 118 97.964 -12.419 8.040 1.00 0.00 ATOM 936 C LYS A 118 97.500 -11.555 7.299 1.00 0.00 ATOM 937 N VAL A 119 96.509 -11.869 6.340 1.00 0.00 ATOM 938 CA VAL A 119 95.985 -13.215 6.212 1.00 0.00 ATOM 939 CB VAL A 119 95.926 -13.953 7.565 1.00 0.00 ATOM 940 CG1 VAL A 119 97.335 -14.195 8.086 1.00 0.00 ATOM 941 CG2 VAL A 119 95.111 -13.166 8.580 1.00 0.00 ATOM 942 O VAL A 119 93.823 -12.212 5.858 1.00 0.00 ATOM 943 C VAL A 119 94.532 -13.219 5.743 1.00 0.00 ATOM 944 N PRO A 120 94.042 -14.369 5.343 1.00 0.00 ATOM 945 CA PRO A 120 92.658 -14.469 4.874 1.00 0.00 ATOM 946 CB PRO A 120 92.495 -15.942 4.474 1.00 0.00 ATOM 947 CG PRO A 120 93.970 -16.320 4.044 1.00 0.00 ATOM 948 CD PRO A 120 94.874 -15.561 5.075 1.00 0.00 ATOM 949 O PRO A 120 91.984 -14.615 7.167 1.00 0.00 ATOM 950 C PRO A 120 91.690 -14.239 6.031 1.00 0.00 ATOM 951 N GLN A 121 90.558 -13.644 5.743 1.00 0.00 ATOM 952 CA GLN A 121 89.567 -13.389 6.782 1.00 0.00 ATOM 953 CB GLN A 121 88.376 -12.615 6.209 1.00 0.00 ATOM 954 CG GLN A 121 87.540 -13.403 5.217 1.00 0.00 ATOM 955 CD GLN A 121 86.586 -12.524 4.435 1.00 0.00 ATOM 956 OE1 GLN A 121 85.582 -12.046 4.971 1.00 0.00 ATOM 957 NE2 GLN A 121 86.885 -12.308 3.160 1.00 0.00 ATOM 958 O GLN A 121 88.796 -14.756 8.596 1.00 0.00 ATOM 959 C GLN A 121 89.026 -14.686 7.388 1.00 0.00 ATOM 960 N ALA A 122 88.847 -15.725 6.596 1.00 0.00 ATOM 961 CA ALA A 122 88.333 -16.980 7.136 1.00 0.00 ATOM 962 CB ALA A 122 88.110 -17.979 6.011 1.00 0.00 ATOM 963 O ALA A 122 88.860 -18.243 9.099 1.00 0.00 ATOM 964 C ALA A 122 89.292 -17.594 8.145 1.00 0.00 ATOM 965 N THR A 123 90.593 -17.396 7.942 1.00 0.00 ATOM 966 CA THR A 123 91.583 -17.940 8.859 1.00 0.00 ATOM 967 CB THR A 123 92.901 -18.251 8.123 1.00 0.00 ATOM 968 CG2 THR A 123 93.943 -18.783 9.097 1.00 0.00 ATOM 969 OG1 THR A 123 92.663 -19.228 7.103 1.00 0.00 ATOM 970 O THR A 123 92.369 -17.476 11.080 1.00 0.00 ATOM 971 C THR A 123 91.917 -17.016 10.031 1.00 0.00 ATOM 972 N LEU A 124 91.665 -15.736 9.892 1.00 0.00 ATOM 973 CA LEU A 124 91.970 -14.782 10.952 1.00 0.00 ATOM 974 CB LEU A 124 92.443 -13.447 10.358 1.00 0.00 ATOM 975 CG LEU A 124 92.591 -12.301 11.367 1.00 0.00 ATOM 976 CD1 LEU A 124 93.794 -12.550 12.269 1.00 0.00 ATOM 977 CD2 LEU A 124 92.740 -10.984 10.620 1.00 0.00 ATOM 978 O LEU A 124 91.066 -14.197 13.082 1.00 0.00 ATOM 979 C LEU A 124 90.833 -14.466 11.906 1.00 0.00 ATOM 980 N LEU A 125 89.599 -14.478 11.415 1.00 0.00 ATOM 981 CA LEU A 125 88.468 -14.160 12.276 1.00 0.00 ATOM 982 CB LEU A 125 87.154 -14.288 11.496 1.00 0.00 ATOM 983 CG LEU A 125 86.924 -13.218 10.421 1.00 0.00 ATOM 984 CD1 LEU A 125 85.680 -13.550 9.610 1.00 0.00 ATOM 985 CD2 LEU A 125 86.791 -11.855 11.082 1.00 0.00 ATOM 986 O LEU A 125 88.005 -14.554 14.596 1.00 0.00 ATOM 987 C LEU A 125 88.389 -15.028 13.526 1.00 0.00 ATOM 988 N MET A 126 88.745 -16.320 13.421 1.00 0.00 ATOM 989 CA MET A 126 88.699 -17.225 14.561 1.00 0.00 ATOM 990 CB MET A 126 89.024 -18.650 14.118 1.00 0.00 ATOM 991 CG MET A 126 87.972 -19.289 13.223 1.00 0.00 ATOM 992 SD MET A 126 86.361 -19.413 14.025 1.00 0.00 ATOM 993 CE MET A 126 86.715 -20.595 15.319 1.00 0.00 ATOM 994 O MET A 126 89.554 -17.259 16.816 1.00 0.00 ATOM 995 C MET A 126 89.645 -16.798 15.671 1.00 0.00 ATOM 996 N ASP A 127 90.737 -15.972 15.381 1.00 0.00 ATOM 997 CA ASP A 127 91.793 -15.651 16.316 1.00 0.00 ATOM 998 CB ASP A 127 93.135 -15.727 15.582 1.00 0.00 ATOM 999 CG ASP A 127 93.421 -17.110 15.033 1.00 0.00 ATOM 1000 OD1 ASP A 127 93.281 -18.092 15.793 1.00 0.00 ATOM 1001 OD2 ASP A 127 93.785 -17.212 13.842 1.00 0.00 ATOM 1002 O ASP A 127 92.643 -13.903 17.725 1.00 0.00 ATOM 1003 C ASP A 127 91.759 -14.254 16.947 1.00 0.00 ATOM 1004 N ALA A 128 90.770 -13.470 16.642 1.00 0.00 ATOM 1005 CA ALA A 128 90.663 -12.114 17.184 1.00 0.00 ATOM 1006 CB ALA A 128 89.392 -11.437 16.699 1.00 0.00 ATOM 1007 O ALA A 128 91.332 -11.177 19.281 1.00 0.00 ATOM 1008 C ALA A 128 90.607 -11.985 18.703 1.00 0.00 ATOM 1009 N LEU A 129 89.765 -12.743 19.355 1.00 0.00 ATOM 1010 CA LEU A 129 89.645 -12.656 20.805 1.00 0.00 ATOM 1011 CB LEU A 129 88.480 -13.527 21.293 1.00 0.00 ATOM 1012 CG LEU A 129 88.002 -13.236 22.721 1.00 0.00 ATOM 1013 CD1 LEU A 129 86.702 -13.982 22.998 1.00 0.00 ATOM 1014 CD2 LEU A 129 89.081 -13.648 23.713 1.00 0.00 ATOM 1015 O LEU A 129 91.387 -12.352 22.437 1.00 0.00 ATOM 1016 C LEU A 129 90.921 -13.060 21.536 1.00 0.00 ATOM 1017 N LYS A 130 91.527 -14.156 21.092 1.00 0.00 ATOM 1018 CA LYS A 130 92.738 -14.666 21.715 1.00 0.00 ATOM 1019 CB LYS A 130 93.083 -16.050 21.163 1.00 0.00 ATOM 1020 CG LYS A 130 94.342 -16.658 21.754 1.00 0.00 ATOM 1021 CD LYS A 130 94.604 -18.047 21.194 1.00 0.00 ATOM 1022 CE LYS A 130 95.872 -18.647 21.771 1.00 0.00 ATOM 1023 NZ LYS A 130 96.154 -19.995 21.206 1.00 0.00 ATOM 1024 O LYS A 130 94.518 -13.194 22.411 1.00 0.00 ATOM 1025 C LYS A 130 93.972 -13.771 21.467 1.00 0.00 ATOM 1026 N GLU A 131 94.375 -13.627 20.265 1.00 0.00 ATOM 1027 CA GLU A 131 95.576 -12.865 19.932 1.00 0.00 ATOM 1028 CB GLU A 131 96.022 -13.173 18.502 1.00 0.00 ATOM 1029 CG GLU A 131 96.547 -14.589 18.297 1.00 0.00 ATOM 1030 CD GLU A 131 97.723 -14.868 19.193 1.00 0.00 ATOM 1031 OE1 GLU A 131 98.655 -14.101 19.175 1.00 0.00 ATOM 1032 OE2 GLU A 131 97.643 -15.785 19.976 1.00 0.00 ATOM 1033 O GLU A 131 96.586 -10.720 20.301 1.00 0.00 ATOM 1034 C GLU A 131 95.558 -11.336 20.017 1.00 0.00 ATOM 1035 N GLU A 132 94.426 -10.734 19.779 1.00 0.00 ATOM 1036 CA GLU A 132 94.332 -9.273 19.794 1.00 0.00 ATOM 1037 CB GLU A 132 93.746 -8.746 18.482 1.00 0.00 ATOM 1038 CG GLU A 132 94.562 -9.090 17.245 1.00 0.00 ATOM 1039 CD GLU A 132 95.920 -8.445 17.288 1.00 0.00 ATOM 1040 OE1 GLU A 132 95.994 -7.283 17.610 1.00 0.00 ATOM 1041 OE2 GLU A 132 96.891 -9.141 17.108 1.00 0.00 ATOM 1042 O GLU A 132 93.230 -7.439 20.862 1.00 0.00 ATOM 1043 C GLU A 132 93.524 -8.634 20.905 1.00 0.00 ATOM 1044 N SER A 133 93.172 -9.434 21.904 1.00 0.00 ATOM 1045 CA SER A 133 92.395 -8.955 23.039 1.00 0.00 ATOM 1046 CB SER A 133 93.230 -8.012 23.910 1.00 0.00 ATOM 1047 OG SER A 133 94.365 -8.677 24.437 1.00 0.00 ATOM 1048 O SER A 133 90.816 -7.131 23.154 1.00 0.00 ATOM 1049 C SER A 133 91.096 -8.237 22.686 1.00 0.00 ATOM 1050 N GLU A 134 90.309 -8.883 21.838 1.00 0.00 ATOM 1051 CA GLU A 134 89.034 -8.341 21.416 1.00 0.00 ATOM 1052 CB GLU A 134 88.960 -8.453 19.894 1.00 0.00 ATOM 1053 CG GLU A 134 89.989 -7.610 19.156 1.00 0.00 ATOM 1054 CD GLU A 134 89.777 -6.124 19.363 1.00 0.00 ATOM 1055 OE1 GLU A 134 88.617 -5.668 19.268 1.00 0.00 ATOM 1056 OE2 GLU A 134 90.772 -5.412 19.619 1.00 0.00 ATOM 1057 O GLU A 134 87.878 -10.338 22.053 1.00 0.00 ATOM 1058 C GLU A 134 87.882 -9.107 22.044 1.00 0.00 ATOM 1059 N ILE A 135 86.918 -8.379 22.588 1.00 0.00 ATOM 1060 CA ILE A 135 85.756 -9.006 23.178 1.00 0.00 ATOM 1061 CB ILE A 135 85.268 -8.239 24.423 1.00 0.00 ATOM 1062 CG1 ILE A 135 86.360 -8.219 25.496 1.00 0.00 ATOM 1063 CG2 ILE A 135 84.029 -8.894 25.008 1.00 0.00 ATOM 1064 CD1 ILE A 135 86.036 -7.337 26.681 1.00 0.00 ATOM 1065 O ILE A 135 84.332 -10.038 21.547 1.00 0.00 ATOM 1066 C ILE A 135 84.665 -8.999 22.103 1.00 0.00 ATOM 1067 N ILE A 136 84.155 -7.815 21.781 1.00 0.00 ATOM 1068 CA ILE A 136 83.144 -7.677 20.738 1.00 0.00 ATOM 1069 CB ILE A 136 81.818 -7.245 21.333 1.00 0.00 ATOM 1070 CG1 ILE A 136 81.173 -8.442 22.027 1.00 0.00 ATOM 1071 CG2 ILE A 136 80.922 -6.736 20.228 1.00 0.00 ATOM 1072 CD1 ILE A 136 80.013 -8.101 22.926 1.00 0.00 ATOM 1073 O ILE A 136 84.165 -5.534 20.415 1.00 0.00 ATOM 1074 C ILE A 136 83.486 -6.435 19.928 1.00 0.00 ATOM 1075 N TYR A 137 83.013 -6.389 18.690 1.00 0.00 ATOM 1076 CA TYR A 137 83.301 -5.270 17.809 1.00 0.00 ATOM 1077 CB TYR A 137 83.714 -5.769 16.423 1.00 0.00 ATOM 1078 CG TYR A 137 85.133 -6.290 16.357 1.00 0.00 ATOM 1079 CD1 TYR A 137 85.389 -7.651 16.272 1.00 0.00 ATOM 1080 CD2 TYR A 137 86.210 -5.418 16.378 1.00 0.00 ATOM 1081 CE1 TYR A 137 86.682 -8.132 16.212 1.00 0.00 ATOM 1082 CE2 TYR A 137 87.508 -5.890 16.319 1.00 0.00 ATOM 1083 CZ TYR A 137 87.742 -7.246 16.235 1.00 0.00 ATOM 1084 OH TYR A 137 89.031 -7.720 16.178 1.00 0.00 ATOM 1085 O TYR A 137 81.118 -4.600 17.088 1.00 0.00 ATOM 1086 C TYR A 137 82.177 -4.268 17.618 1.00 0.00 ATOM 1087 N ASP A 138 82.483 -3.007 17.929 1.00 0.00 ATOM 1088 CA ASP A 138 81.559 -1.888 17.772 1.00 0.00 ATOM 1089 CB ASP A 138 82.289 -0.614 18.285 1.00 0.00 ATOM 1090 CG ASP A 138 82.637 -0.637 19.760 1.00 0.00 ATOM 1091 OD1 ASP A 138 82.050 -1.444 20.528 1.00 0.00 ATOM 1092 OD2 ASP A 138 83.495 0.159 20.170 1.00 0.00 ATOM 1093 O ASP A 138 79.914 -1.415 16.090 1.00 0.00 ATOM 1094 C ASP A 138 81.086 -1.678 16.341 1.00 0.00 ATOM 1095 N PHE A 139 82.018 -1.807 15.405 1.00 0.00 ATOM 1096 CA PHE A 139 81.712 -1.602 14.009 1.00 0.00 ATOM 1097 CB PHE A 139 81.843 -0.123 13.644 1.00 0.00 ATOM 1098 CG PHE A 139 81.800 0.143 12.165 1.00 0.00 ATOM 1099 CD1 PHE A 139 80.620 -0.013 11.455 1.00 0.00 ATOM 1100 CD2 PHE A 139 82.938 0.547 11.484 1.00 0.00 ATOM 1101 CE1 PHE A 139 80.578 0.230 10.094 1.00 0.00 ATOM 1102 CE2 PHE A 139 82.898 0.793 10.126 1.00 0.00 ATOM 1103 CZ PHE A 139 81.717 0.633 9.429 1.00 0.00 ATOM 1104 O PHE A 139 83.789 -2.615 13.385 1.00 0.00 ATOM 1105 C PHE A 139 82.607 -2.421 13.099 1.00 0.00 ATOM 1106 N CYS A 140 82.008 -2.884 12.011 1.00 0.00 ATOM 1107 CA CYS A 140 82.764 -3.676 11.047 1.00 0.00 ATOM 1108 CB CYS A 140 82.298 -5.132 11.029 1.00 0.00 ATOM 1109 SG CYS A 140 83.377 -6.241 10.108 1.00 0.00 ATOM 1110 O CYS A 140 81.413 -2.866 9.231 1.00 0.00 ATOM 1111 C CYS A 140 82.547 -3.135 9.637 1.00 0.00 ATOM 1112 N MET A 141 83.603 -2.914 8.876 1.00 0.00 ATOM 1113 CA MET A 141 83.490 -2.400 7.520 1.00 0.00 ATOM 1114 CB MET A 141 84.370 -1.165 7.347 1.00 0.00 ATOM 1115 CG MET A 141 84.252 -0.493 5.983 1.00 0.00 ATOM 1116 SD MET A 141 82.687 0.377 5.774 1.00 0.00 ATOM 1117 CE MET A 141 82.773 0.813 4.038 1.00 0.00 ATOM 1118 O MET A 141 85.059 -3.841 6.411 1.00 0.00 ATOM 1119 C MET A 141 83.881 -3.503 6.537 1.00 0.00 ATOM 1120 N CYS A 142 82.901 -4.000 5.789 1.00 0.00 ATOM 1121 CA CYS A 142 83.138 -5.060 4.806 1.00 0.00 ATOM 1122 CB CYS A 142 82.166 -6.216 5.052 1.00 0.00 ATOM 1123 SG CYS A 142 82.324 -6.992 6.676 1.00 0.00 ATOM 1124 O CYS A 142 81.785 -4.334 2.968 1.00 0.00 ATOM 1125 C CYS A 142 82.922 -4.514 3.394 1.00 0.00 ATOM 1126 N ASN A 143 84.004 -4.340 2.638 1.00 0.00 ATOM 1127 CA ASN A 143 83.912 -3.823 1.267 1.00 0.00 ATOM 1128 CB ASN A 143 84.464 -2.411 1.177 1.00 0.00 ATOM 1129 CG ASN A 143 85.918 -2.305 1.545 1.00 0.00 ATOM 1130 ND2 ASN A 143 86.659 -1.615 0.716 1.00 0.00 ATOM 1131 OD1 ASN A 143 86.348 -2.778 2.602 1.00 0.00 ATOM 1132 O ASN A 143 85.693 -4.496 -0.194 1.00 0.00 ATOM 1133 C ASN A 143 84.654 -4.820 0.387 1.00 0.00 ATOM 1134 N PRO A 144 84.124 -6.068 0.264 1.00 0.00 ATOM 1135 CA PRO A 144 84.801 -7.059 -0.576 1.00 0.00 ATOM 1136 CB PRO A 144 83.959 -8.317 -0.336 1.00 0.00 ATOM 1137 CG PRO A 144 83.474 -8.121 1.048 1.00 0.00 ATOM 1138 CD PRO A 144 83.047 -6.677 1.022 1.00 0.00 ATOM 1139 O PRO A 144 83.845 -6.130 -2.574 1.00 0.00 ATOM 1140 C PRO A 144 84.723 -6.844 -2.085 1.00 0.00 ATOM 1141 N PRO A 145 85.675 -7.461 -2.820 1.00 0.00 ATOM 1142 CA PRO A 145 85.644 -7.312 -4.278 1.00 0.00 ATOM 1143 CB PRO A 145 87.001 -7.875 -4.710 1.00 0.00 ATOM 1144 CG PRO A 145 87.281 -8.910 -3.706 1.00 0.00 ATOM 1145 CD PRO A 145 86.821 -8.286 -2.397 1.00 0.00 ATOM 1146 O PRO A 145 83.850 -8.856 -3.944 1.00 0.00 ATOM 1147 C PRO A 145 84.415 -8.102 -4.734 1.00 0.00 ATOM 1148 N PHE A 146 83.998 -7.937 -5.983 1.00 0.00 ATOM 1149 CA PHE A 146 82.821 -8.651 -6.473 1.00 0.00 ATOM 1150 CB PHE A 146 82.592 -8.387 -7.961 1.00 0.00 ATOM 1151 CG PHE A 146 82.025 -7.033 -8.243 1.00 0.00 ATOM 1152 CD1 PHE A 146 80.781 -6.662 -7.734 1.00 0.00 ATOM 1153 CD2 PHE A 146 82.743 -6.115 -8.990 1.00 0.00 ATOM 1154 CE1 PHE A 146 80.273 -5.386 -7.968 1.00 0.00 ATOM 1155 CE2 PHE A 146 82.243 -4.838 -9.226 1.00 0.00 ATOM 1156 CZ PHE A 146 81.005 -4.476 -8.712 1.00 0.00 ATOM 1157 O PHE A 146 83.768 -10.759 -7.077 1.00 0.00 ATOM 1158 C PHE A 146 82.900 -10.171 -6.434 1.00 0.00 ATOM 1159 N PHE A 147 82.206 -10.885 -5.434 1.00 0.00 ATOM 1160 CA PHE A 147 82.434 -12.274 -5.152 1.00 0.00 ATOM 1161 CB PHE A 147 81.909 -12.677 -3.771 1.00 0.00 ATOM 1162 CG PHE A 147 82.782 -12.224 -2.622 1.00 0.00 ATOM 1163 CD1 PHE A 147 84.144 -12.012 -2.796 1.00 0.00 ATOM 1164 CD2 PHE A 147 82.239 -12.057 -1.350 1.00 0.00 ATOM 1165 CE1 PHE A 147 84.955 -11.640 -1.720 1.00 0.00 ATOM 1166 CE2 PHE A 147 83.041 -11.689 -0.267 1.00 0.00 ATOM 1167 CZ PHE A 147 84.405 -11.482 -0.457 1.00 0.00 ATOM 1168 O PHE A 147 82.213 -14.115 -6.679 1.00 0.00 ATOM 1169 C PHE A 147 81.787 -13.013 -6.320 1.00 0.00 ATOM 1170 N ALA A 148 80.766 -12.413 -6.913 1.00 0.00 ATOM 1171 CA ALA A 148 80.065 -13.029 -8.033 1.00 0.00 ATOM 1172 CB ALA A 148 78.553 -13.167 -7.727 1.00 0.00 ATOM 1173 O ALA A 148 79.779 -11.227 -9.590 1.00 0.00 ATOM 1174 C ALA A 148 80.299 -12.317 -9.359 1.00 0.00 ATOM 1175 N ASN A 149 81.060 -12.956 -10.244 1.00 0.00 ATOM 1176 CA ASN A 149 81.342 -12.392 -11.559 1.00 0.00 ATOM 1177 CB ASN A 149 82.600 -13.035 -12.151 1.00 0.00 ATOM 1178 CG ASN A 149 83.862 -12.638 -11.408 1.00 0.00 ATOM 1179 ND2 ASN A 149 84.921 -13.417 -11.584 1.00 0.00 ATOM 1180 OD1 ASN A 149 83.882 -11.640 -10.685 1.00 0.00 ATOM 1181 O ASN A 149 79.563 -11.703 -13.010 1.00 0.00 ATOM 1182 C ASN A 149 80.177 -12.641 -12.499 1.00 0.00 ATOM 1183 N GLN A 150 79.875 -13.916 -12.722 1.00 0.00 ATOM 1184 CA GLN A 150 78.778 -14.276 -13.600 1.00 0.00 ATOM 1185 CB GLN A 150 79.132 -15.515 -14.425 1.00 0.00 ATOM 1186 CG GLN A 150 80.381 -15.357 -15.277 1.00 0.00 ATOM 1187 CD GLN A 150 80.252 -14.246 -16.304 1.00 0.00 ATOM 1188 OE1 GLN A 150 79.302 -14.223 -17.085 1.00 0.00 ATOM 1189 NE2 GLN A 150 81.208 -13.327 -16.304 1.00 0.00 ATOM 1190 O GLN A 150 77.612 -14.935 -11.618 1.00 0.00 ATOM 1191 C GLN A 150 77.525 -14.657 -12.815 1.00 0.00 ATOM 1192 N LEU A 151 76.379 -14.660 -13.612 1.00 0.00 ATOM 1193 CA LEU A 151 75.106 -15.017 -12.968 1.00 0.00 ATOM 1194 CB LEU A 151 73.966 -14.990 -13.992 1.00 0.00 ATOM 1195 CG LEU A 151 73.595 -13.600 -14.524 1.00 0.00 ATOM 1196 CD1 LEU A 151 72.574 -13.725 -15.646 1.00 0.00 ATOM 1197 CD2 LEU A 151 73.053 -12.749 -13.388 1.00 0.00 ATOM 1198 O LEU A 151 74.572 -16.566 -11.209 1.00 0.00 ATOM 1199 C LEU A 151 75.155 -16.386 -12.283 1.00 0.00 ATOM 1200 N GLU A 152 75.955 -17.272 -12.869 1.00 0.00 ATOM 1201 CA GLU A 152 76.123 -18.631 -12.352 1.00 0.00 ATOM 1202 CB GLU A 152 76.852 -19.506 -13.375 1.00 0.00 ATOM 1203 CG GLU A 152 76.036 -19.833 -14.618 1.00 0.00 ATOM 1204 CD GLU A 152 76.842 -20.628 -15.606 1.00 0.00 ATOM 1205 OE1 GLU A 152 77.996 -20.869 -15.346 1.00 0.00 ATOM 1206 OE2 GLU A 152 76.274 -21.092 -16.567 1.00 0.00 ATOM 1207 O GLU A 152 76.719 -19.680 -10.277 1.00 0.00 ATOM 1208 C GLU A 152 76.867 -18.706 -11.019 1.00 0.00 ATOM 1209 N ALA A 153 77.668 -17.693 -10.719 1.00 0.00 ATOM 1210 CA ALA A 153 78.447 -17.678 -9.485 1.00 0.00 ATOM 1211 CB ALA A 153 79.625 -16.726 -9.646 1.00 0.00 ATOM 1212 O ALA A 153 78.191 -17.083 -7.220 1.00 0.00 ATOM 1213 C ALA A 153 77.648 -17.185 -8.321 1.00 0.00 ATOM 1214 N LYS A 154 76.350 -16.887 -8.501 1.00 0.00 ATOM 1215 CA LYS A 154 75.586 -16.297 -7.376 1.00 0.00 ATOM 1216 CB LYS A 154 74.157 -16.072 -7.685 1.00 0.00 ATOM 1217 CG LYS A 154 73.935 -14.977 -8.718 1.00 0.00 ATOM 1218 CD LYS A 154 72.450 -14.688 -8.929 1.00 0.00 ATOM 1219 CE LYS A 154 72.245 -13.564 -9.938 1.00 0.00 ATOM 1220 NZ LYS A 154 70.808 -13.217 -10.121 1.00 0.00 ATOM 1221 O LYS A 154 75.689 -16.771 -5.028 1.00 0.00 ATOM 1222 C LYS A 154 75.446 -17.204 -6.153 1.00 0.00 ATOM 1223 N GLY A 155 74.996 -18.439 -6.356 1.00 0.00 ATOM 1224 CA GLY A 155 74.819 -19.354 -5.248 1.00 0.00 ATOM 1225 O GLY A 155 73.316 -19.739 -3.439 1.00 0.00 ATOM 1226 C GLY A 155 73.498 -19.182 -4.522 1.00 0.00 ATOM 1227 N VAL A 156 72.554 -18.479 -5.092 1.00 0.00 ATOM 1228 CA VAL A 156 71.264 -18.255 -4.448 1.00 0.00 ATOM 1229 CB VAL A 156 71.129 -16.808 -3.938 1.00 0.00 ATOM 1230 CG1 VAL A 156 72.043 -16.580 -2.743 1.00 0.00 ATOM 1231 CG2 VAL A 156 71.454 -15.820 -5.049 1.00 0.00 ATOM 1232 O VAL A 156 69.089 -18.002 -5.404 1.00 0.00 ATOM 1233 C VAL A 156 70.174 -18.568 -5.469 1.00 0.00 ATOM 1234 N ASN A 157 70.474 -19.444 -6.427 1.00 0.00 ATOM 1235 CA ASN A 157 69.507 -19.774 -7.471 1.00 0.00 ATOM 1236 CB ASN A 157 70.089 -20.746 -8.479 1.00 0.00 ATOM 1237 CG ASN A 157 71.098 -20.127 -9.405 1.00 0.00 ATOM 1238 ND2 ASN A 157 71.841 -20.970 -10.077 1.00 0.00 ATOM 1239 OD1 ASN A 157 71.154 -18.902 -9.566 1.00 0.00 ATOM 1240 O ASN A 157 67.118 -20.032 -7.492 1.00 0.00 ATOM 1241 C ASN A 157 68.195 -20.362 -6.962 1.00 0.00 ATOM 1242 N SER A 158 68.261 -21.220 -5.996 1.00 0.00 ATOM 1243 CA SER A 158 67.051 -21.814 -5.411 1.00 0.00 ATOM 1244 CB SER A 158 67.427 -22.897 -4.423 1.00 0.00 ATOM 1245 OG SER A 158 68.026 -23.999 -5.048 1.00 0.00 ATOM 1246 O SER A 158 64.969 -20.700 -4.896 1.00 0.00 ATOM 1247 C SER A 158 66.204 -20.754 -4.731 1.00 0.00 ATOM 1248 N ARG A 159 66.796 -19.851 -3.965 1.00 0.00 ATOM 1249 CA ARG A 159 66.073 -18.830 -3.241 1.00 0.00 ATOM 1250 CB ARG A 159 66.948 -18.116 -2.220 1.00 0.00 ATOM 1251 CG ARG A 159 66.216 -17.123 -1.333 1.00 0.00 ATOM 1252 CD ARG A 159 67.073 -16.472 -0.308 1.00 0.00 ATOM 1253 NE ARG A 159 67.643 -17.383 0.668 1.00 0.00 ATOM 1254 CZ ARG A 159 68.941 -17.744 0.709 1.00 0.00 ATOM 1255 NH1 ARG A 159 69.795 -17.304 -0.185 1.00 0.00 ATOM 1256 NH2 ARG A 159 69.328 -18.573 1.666 1.00 0.00 ATOM 1257 O ARG A 159 64.243 -17.527 -4.091 1.00 0.00 ATOM 1258 C ARG A 159 65.424 -17.859 -4.220 1.00 0.00 ATOM 1259 N ASN A 160 66.341 -17.483 -5.200 1.00 0.00 ATOM 1260 CA ASN A 160 65.896 -16.579 -6.256 1.00 0.00 ATOM 1261 CB ASN A 160 66.689 -15.271 -6.208 1.00 0.00 ATOM 1262 CG ASN A 160 66.183 -14.246 -7.206 1.00 0.00 ATOM 1263 ND2 ASN A 160 67.030 -13.283 -7.544 1.00 0.00 ATOM 1264 OD1 ASN A 160 65.043 -14.324 -7.662 1.00 0.00 ATOM 1265 O ASN A 160 66.887 -16.645 -8.462 1.00 0.00 ATOM 1266 C ASN A 160 66.076 -17.161 -7.672 1.00 0.00 ATOM 1267 N PRO A 161 65.315 -18.210 -7.974 1.00 0.00 ATOM 1268 CA PRO A 161 65.462 -18.938 -9.235 1.00 0.00 ATOM 1269 CB PRO A 161 64.750 -20.267 -8.953 1.00 0.00 ATOM 1270 CG PRO A 161 63.638 -19.881 -8.020 1.00 0.00 ATOM 1271 CD PRO A 161 64.192 -18.729 -7.156 1.00 0.00 ATOM 1272 O PRO A 161 63.604 -17.612 -10.051 1.00 0.00 ATOM 1273 C PRO A 161 64.595 -18.309 -10.329 1.00 0.00 ATOM 1274 N ARG A 162 64.955 -18.623 -11.527 1.00 0.00 ATOM 1275 CA ARG A 162 64.239 -18.126 -12.693 1.00 0.00 ATOM 1276 CB ARG A 162 65.059 -18.036 -13.970 1.00 0.00 ATOM 1277 CG ARG A 162 66.188 -17.021 -13.936 1.00 0.00 ATOM 1278 CD ARG A 162 66.993 -16.957 -15.183 1.00 0.00 ATOM 1279 NE ARG A 162 66.253 -16.529 -16.359 1.00 0.00 ATOM 1280 CZ ARG A 162 65.856 -17.347 -17.352 1.00 0.00 ATOM 1281 NH1 ARG A 162 66.157 -18.626 -17.338 1.00 0.00 ATOM 1282 NH2 ARG A 162 65.174 -16.825 -18.358 1.00 0.00 ATOM 1283 O ARG A 162 62.811 -19.333 -14.028 1.00 0.00 ATOM 1284 C ARG A 162 62.989 -18.910 -12.939 1.00 0.00 ATOM 1285 N ARG A 163 62.142 -19.153 -11.946 1.00 0.00 ATOM 1286 CA ARG A 163 60.931 -19.960 -12.072 1.00 0.00 ATOM 1287 CB ARG A 163 61.091 -21.339 -11.449 1.00 0.00 ATOM 1288 CG ARG A 163 62.149 -22.215 -12.101 1.00 0.00 ATOM 1289 CD ARG A 163 61.819 -22.653 -13.481 1.00 0.00 ATOM 1290 NE ARG A 163 62.810 -23.522 -14.093 1.00 0.00 ATOM 1291 CZ ARG A 163 63.889 -23.090 -14.771 1.00 0.00 ATOM 1292 NH1 ARG A 163 64.102 -21.806 -14.962 1.00 0.00 ATOM 1293 NH2 ARG A 163 64.720 -23.993 -15.264 1.00 0.00 ATOM 1294 O ARG A 163 59.703 -18.931 -10.285 1.00 0.00 ATOM 1295 C ARG A 163 59.753 -19.183 -11.487 1.00 0.00 ATOM 1296 N PRO A 164 58.780 -18.891 -12.300 1.00 0.00 ATOM 1297 CA PRO A 164 57.596 -18.129 -11.880 1.00 0.00 ATOM 1298 CB PRO A 164 57.034 -17.670 -13.282 1.00 0.00 ATOM 1299 CG PRO A 164 57.635 -18.615 -14.281 1.00 0.00 ATOM 1300 CD PRO A 164 58.931 -19.061 -13.737 1.00 0.00 ATOM 1301 O PRO A 164 55.838 -18.102 -10.386 1.00 0.00 ATOM 1302 C PRO A 164 56.519 -18.856 -11.098 1.00 0.00 ATOM 1303 N PRO A 165 56.321 -20.027 -11.078 1.00 0.00 ATOM 1304 CA PRO A 165 55.276 -20.580 -10.184 1.00 0.00 ATOM 1305 CB PRO A 165 55.456 -22.064 -10.379 1.00 0.00 ATOM 1306 CG PRO A 165 55.977 -22.172 -11.831 1.00 0.00 ATOM 1307 CD PRO A 165 57.019 -21.130 -11.776 1.00 0.00 ATOM 1308 O PRO A 165 56.783 -19.539 -8.638 1.00 0.00 ATOM 1309 C PRO A 165 55.701 -20.113 -8.788 1.00 0.00 ATOM 1310 N PRO A 166 54.951 -20.317 -7.599 1.00 0.00 ATOM 1311 CA PRO A 166 55.368 -19.870 -6.264 1.00 0.00 ATOM 1312 CB PRO A 166 54.098 -20.277 -5.417 1.00 0.00 ATOM 1313 CG PRO A 166 53.845 -21.622 -5.992 1.00 0.00 ATOM 1314 CD PRO A 166 54.035 -21.392 -7.539 1.00 0.00 ATOM 1315 O PRO A 166 57.214 -21.107 -5.337 1.00 0.00 ATOM 1316 C PRO A 166 56.863 -20.102 -5.910 1.00 0.00 ATOM 1317 N SER A 167 57.724 -19.210 -6.402 1.00 0.00 ATOM 1318 CA SER A 167 59.175 -19.323 -6.336 1.00 0.00 ATOM 1319 CB SER A 167 59.843 -18.219 -7.181 1.00 0.00 ATOM 1320 OG SER A 167 59.447 -16.955 -6.714 1.00 0.00 ATOM 1321 O SER A 167 60.828 -19.845 -4.606 1.00 0.00 ATOM 1322 C SER A 167 59.755 -19.319 -4.872 1.00 0.00 ATOM 1323 N SER A 168 59.012 -18.684 -3.987 1.00 0.00 ATOM 1324 CA SER A 168 59.233 -18.657 -2.525 1.00 0.00 ATOM 1325 CB SER A 168 58.079 -17.952 -1.838 1.00 0.00 ATOM 1326 OG SER A 168 56.870 -18.641 -1.997 1.00 0.00 ATOM 1327 O SER A 168 60.158 -20.222 -0.946 1.00 0.00 ATOM 1328 C SER A 168 59.410 -20.057 -1.916 1.00 0.00 ATOM 1329 N VAL A 169 58.767 -21.103 -2.444 1.00 0.00 ATOM 1330 CA VAL A 169 58.936 -22.464 -1.938 1.00 0.00 ATOM 1331 CB VAL A 169 58.029 -23.463 -2.683 1.00 0.00 ATOM 1332 CG1 VAL A 169 58.339 -24.888 -2.250 1.00 0.00 ATOM 1333 CG2 VAL A 169 56.563 -23.138 -2.432 1.00 0.00 ATOM 1334 O VAL A 169 60.856 -23.855 -1.283 1.00 0.00 ATOM 1335 C VAL A 169 60.402 -22.953 -2.002 1.00 0.00 ATOM 1336 N ASN A 170 61.167 -22.346 -2.884 1.00 0.00 ATOM 1337 CA ASN A 170 62.565 -22.726 -3.063 1.00 0.00 ATOM 1338 CB ASN A 170 62.918 -22.777 -4.536 1.00 0.00 ATOM 1339 CG ASN A 170 62.219 -23.876 -5.289 1.00 0.00 ATOM 1340 ND2 ASN A 170 62.069 -23.673 -6.574 1.00 0.00 ATOM 1341 OD1 ASN A 170 61.887 -24.926 -4.727 1.00 0.00 ATOM 1342 O ASN A 170 64.799 -22.130 -2.481 1.00 0.00 ATOM 1343 C ASN A 170 63.621 -21.888 -2.352 1.00 0.00 ATOM 1344 N THR A 171 63.161 -20.911 -1.660 1.00 0.00 ATOM 1345 CA THR A 171 64.041 -20.013 -0.896 1.00 0.00 ATOM 1346 CB THR A 171 63.241 -18.911 -0.176 1.00 0.00 ATOM 1347 CG2 THR A 171 62.514 -18.035 -1.186 1.00 0.00 ATOM 1348 OG1 THR A 171 62.283 -19.512 0.706 1.00 0.00 ATOM 1349 O THR A 171 64.310 -21.722 0.772 1.00 0.00 ATOM 1350 C THR A 171 64.853 -20.825 0.120 1.00 0.00 ATOM 1351 N GLY A 172 66.220 -20.536 0.156 1.00 0.00 ATOM 1352 CA GLY A 172 67.131 -21.303 0.987 1.00 0.00 ATOM 1353 O GLY A 172 68.195 -23.472 1.042 1.00 0.00 ATOM 1354 C GLY A 172 67.473 -22.689 0.417 1.00 0.00 ATOM 1355 N GLY A 173 66.956 -22.980 -0.780 1.00 0.00 ATOM 1356 CA GLY A 173 67.241 -24.264 -1.397 1.00 0.00 ATOM 1357 O GLY A 173 69.223 -25.589 -1.509 1.00 0.00 ATOM 1358 C GLY A 173 68.718 -24.485 -1.680 1.00 0.00 ATOM 1359 N ILE A 174 69.461 -23.428 -2.163 1.00 0.00 ATOM 1360 CA ILE A 174 70.882 -23.553 -2.458 1.00 0.00 ATOM 1361 CB ILE A 174 71.467 -22.255 -3.033 1.00 0.00 ATOM 1362 CG1 ILE A 174 70.814 -21.968 -4.388 1.00 0.00 ATOM 1363 CG2 ILE A 174 72.991 -22.367 -3.182 1.00 0.00 ATOM 1364 CD1 ILE A 174 71.022 -23.065 -5.421 1.00 0.00 ATOM 1365 O ILE A 174 72.506 -24.807 -1.194 1.00 0.00 ATOM 1366 C ILE A 174 71.640 -23.915 -1.181 1.00 0.00 ATOM 1367 N THR A 175 71.336 -23.273 -0.051 1.00 0.00 ATOM 1368 CA THR A 175 72.000 -23.553 1.225 1.00 0.00 ATOM 1369 CB THR A 175 71.456 -22.619 2.320 1.00 0.00 ATOM 1370 CG2 THR A 175 72.137 -22.905 3.651 1.00 0.00 ATOM 1371 OG1 THR A 175 71.694 -21.255 1.951 1.00 0.00 ATOM 1372 O THR A 175 72.774 -25.607 2.075 1.00 0.00 ATOM 1373 C THR A 175 71.788 -25.007 1.635 1.00 0.00 ATOM 1374 N GLU A 176 70.567 -25.563 1.478 1.00 0.00 ATOM 1375 CA GLU A 176 70.299 -26.965 1.840 1.00 0.00 ATOM 1376 CB GLU A 176 68.797 -27.226 1.708 1.00 0.00 ATOM 1377 CG GLU A 176 67.944 -26.531 2.759 1.00 0.00 ATOM 1378 CD GLU A 176 66.477 -26.725 2.485 1.00 0.00 ATOM 1379 OE1 GLU A 176 66.151 -27.309 1.483 1.00 0.00 ATOM 1380 OE2 GLU A 176 65.686 -26.388 3.336 1.00 0.00 ATOM 1381 O GLU A 176 71.756 -28.846 1.482 1.00 0.00 ATOM 1382 C GLU A 176 71.141 -27.900 0.982 1.00 0.00 ATOM 1383 N ILE A 177 71.173 -27.639 -0.329 1.00 0.00 ATOM 1384 CA ILE A 177 71.934 -28.463 -1.253 1.00 0.00 ATOM 1385 CB ILE A 177 71.752 -27.965 -2.698 1.00 0.00 ATOM 1386 CG1 ILE A 177 70.316 -28.214 -3.143 1.00 0.00 ATOM 1387 CG2 ILE A 177 72.772 -28.662 -3.646 1.00 0.00 ATOM 1388 CD1 ILE A 177 69.954 -27.539 -4.464 1.00 0.00 ATOM 1389 O ILE A 177 73.970 -29.634 -0.773 1.00 0.00 ATOM 1390 C ILE A 177 73.424 -28.541 -0.940 1.00 0.00 ATOM 1391 N MET A 178 73.999 -27.235 -0.828 1.00 0.00 ATOM 1392 CA MET A 178 75.442 -27.161 -0.603 1.00 0.00 ATOM 1393 CB MET A 178 75.939 -25.760 -0.950 1.00 0.00 ATOM 1394 CG MET A 178 75.927 -25.437 -2.439 1.00 0.00 ATOM 1395 SD MET A 178 76.935 -26.582 -3.403 1.00 0.00 ATOM 1396 CE MET A 178 78.576 -26.147 -2.837 1.00 0.00 ATOM 1397 O MET A 178 75.015 -26.984 1.757 1.00 0.00 ATOM 1398 C MET A 178 75.733 -27.455 0.871 1.00 0.00 ATOM 1399 N ALA A 179 76.795 -28.206 1.144 1.00 0.00 ATOM 1400 CA ALA A 179 77.094 -28.556 2.535 1.00 0.00 ATOM 1401 CB ALA A 179 78.214 -29.584 2.599 1.00 0.00 ATOM 1402 O ALA A 179 77.783 -26.243 2.692 1.00 0.00 ATOM 1403 C ALA A 179 77.448 -27.267 3.292 1.00 0.00 ATOM 1404 N GLU A 180 77.335 -27.314 4.594 1.00 0.00 ATOM 1405 CA GLU A 180 77.837 -26.218 5.413 1.00 0.00 ATOM 1406 CB GLU A 180 77.604 -26.506 6.898 1.00 0.00 ATOM 1407 CG GLU A 180 78.021 -25.376 7.830 1.00 0.00 ATOM 1408 CD GLU A 180 77.719 -25.714 9.264 1.00 0.00 ATOM 1409 OE1 GLU A 180 77.180 -26.766 9.508 1.00 0.00 ATOM 1410 OE2 GLU A 180 78.128 -24.971 10.127 1.00 0.00 ATOM 1411 O GLU A 180 80.112 -26.953 5.091 1.00 0.00 ATOM 1412 C GLU A 180 79.324 -25.992 5.127 1.00 0.00 ATOM 1413 N GLY A 181 79.652 -24.707 4.898 1.00 0.00 ATOM 1414 CA GLY A 181 81.015 -24.302 4.607 1.00 0.00 ATOM 1415 O GLY A 181 82.446 -24.113 2.699 1.00 0.00 ATOM 1416 C GLY A 181 81.341 -24.445 3.125 1.00 0.00 ATOM 1417 N GLY A 182 80.360 -24.887 2.336 1.00 0.00 ATOM 1418 CA GLY A 182 80.552 -25.067 0.901 1.00 0.00 ATOM 1419 O GLY A 182 80.570 -22.683 0.523 1.00 0.00 ATOM 1420 C GLY A 182 80.817 -23.808 0.084 1.00 0.00 ATOM 1421 N GLU A 183 81.239 -24.075 -1.219 1.00 0.00 ATOM 1422 CA GLU A 183 81.528 -22.976 -2.133 1.00 0.00 ATOM 1423 CB GLU A 183 81.735 -23.503 -3.555 1.00 0.00 ATOM 1424 CG GLU A 183 82.102 -22.435 -4.575 1.00 0.00 ATOM 1425 CD GLU A 183 82.351 -23.035 -5.931 1.00 0.00 ATOM 1426 OE1 GLU A 183 82.246 -24.233 -6.058 1.00 0.00 ATOM 1427 OE2 GLU A 183 82.538 -22.291 -6.865 1.00 0.00 ATOM 1428 O GLU A 183 80.818 -20.696 -2.137 1.00 0.00 ATOM 1429 C GLU A 183 80.486 -21.884 -2.184 1.00 0.00 ATOM 1430 N LEU A 184 79.241 -22.267 -2.275 1.00 0.00 ATOM 1431 CA LEU A 184 78.164 -21.275 -2.386 1.00 0.00 ATOM 1432 CB LEU A 184 76.947 -21.890 -3.090 1.00 0.00 ATOM 1433 CG LEU A 184 77.079 -22.043 -4.609 1.00 0.00 ATOM 1434 CD1 LEU A 184 77.948 -20.925 -5.171 1.00 0.00 ATOM 1435 CD2 LEU A 184 77.675 -23.404 -4.936 1.00 0.00 ATOM 1436 O LEU A 184 77.251 -19.350 -1.338 1.00 0.00 ATOM 1437 C LEU A 184 77.854 -20.416 -1.187 1.00 0.00 ATOM 1438 N GLU A 185 78.238 -20.895 -0.002 1.00 0.00 ATOM 1439 CA GLU A 185 77.986 -20.214 1.270 1.00 0.00 ATOM 1440 CB GLU A 185 77.810 -21.289 2.343 1.00 0.00 ATOM 1441 CG GLU A 185 76.678 -22.269 2.074 1.00 0.00 ATOM 1442 CD GLU A 185 76.548 -23.273 3.186 1.00 0.00 ATOM 1443 OE1 GLU A 185 77.279 -23.172 4.140 1.00 0.00 ATOM 1444 OE2 GLU A 185 75.646 -24.076 3.131 1.00 0.00 ATOM 1445 O GLU A 185 79.046 -18.704 2.785 1.00 0.00 ATOM 1446 C GLU A 185 79.062 -19.208 1.668 1.00 0.00 ATOM 1447 N PHE A 186 80.093 -19.041 0.710 1.00 0.00 ATOM 1448 CA PHE A 186 81.223 -18.145 0.979 1.00 0.00 ATOM 1449 CB PHE A 186 81.927 -17.772 -0.328 1.00 0.00 ATOM 1450 CG PHE A 186 83.101 -16.854 -0.144 1.00 0.00 ATOM 1451 CD1 PHE A 186 84.259 -17.300 0.480 1.00 0.00 ATOM 1452 CD2 PHE A 186 83.054 -15.542 -0.594 1.00 0.00 ATOM 1453 CE1 PHE A 186 85.340 -16.457 0.650 1.00 0.00 ATOM 1454 CE2 PHE A 186 84.134 -14.699 -0.426 1.00 0.00 ATOM 1455 CZ PHE A 186 85.278 -15.157 0.197 1.00 0.00 ATOM 1456 O PHE A 186 81.176 -16.494 2.724 1.00 0.00 ATOM 1457 C PHE A 186 80.647 -16.927 1.699 1.00 0.00 ATOM 1458 N VAL A 187 79.546 -16.395 1.173 1.00 0.00 ATOM 1459 CA VAL A 187 78.890 -15.246 1.790 1.00 0.00 ATOM 1460 CB VAL A 187 77.762 -14.680 0.888 1.00 0.00 ATOM 1461 CG1 VAL A 187 76.943 -13.609 1.595 1.00 0.00 ATOM 1462 CG2 VAL A 187 78.375 -14.068 -0.365 1.00 0.00 ATOM 1463 O VAL A 187 78.494 -14.860 4.123 1.00 0.00 ATOM 1464 C VAL A 187 78.345 -15.617 3.164 1.00 0.00 ATOM 1465 N LYS A 188 77.707 -16.783 3.258 1.00 0.00 ATOM 1466 CA LYS A 188 77.151 -17.221 4.531 1.00 0.00 ATOM 1467 CB LYS A 188 76.401 -18.543 4.355 1.00 0.00 ATOM 1468 CG LYS A 188 75.730 -19.059 5.621 1.00 0.00 ATOM 1469 CD LYS A 188 74.958 -20.343 5.353 1.00 0.00 ATOM 1470 CE LYS A 188 74.194 -20.796 6.589 1.00 0.00 ATOM 1471 NZ LYS A 188 75.107 -21.191 7.694 1.00 0.00 ATOM 1472 O LYS A 188 78.002 -17.055 6.766 1.00 0.00 ATOM 1473 C LYS A 188 78.224 -17.385 5.601 1.00 0.00 ATOM 1474 N ARG A 189 79.385 -17.898 5.206 1.00 0.00 ATOM 1475 CA ARG A 189 80.473 -18.101 6.159 1.00 0.00 ATOM 1476 CB ARG A 189 81.614 -18.909 5.561 1.00 0.00 ATOM 1477 CG ARG A 189 82.824 -19.075 6.469 1.00 0.00 ATOM 1478 CD ARG A 189 82.552 -19.823 7.723 1.00 0.00 ATOM 1479 NE ARG A 189 82.133 -21.201 7.522 1.00 0.00 ATOM 1480 CZ ARG A 189 81.666 -22.008 8.495 1.00 0.00 ATOM 1481 NH1 ARG A 189 81.593 -21.593 9.743 1.00 0.00 ATOM 1482 NH2 ARG A 189 81.305 -23.235 8.168 1.00 0.00 ATOM 1483 O ARG A 189 81.079 -16.598 7.945 1.00 0.00 ATOM 1484 C ARG A 189 80.976 -16.771 6.731 1.00 0.00 ATOM 1485 N ILE A 190 81.282 -15.861 5.847 1.00 0.00 ATOM 1486 CA ILE A 190 81.778 -14.550 6.256 1.00 0.00 ATOM 1487 CB ILE A 190 82.128 -13.682 5.034 1.00 0.00 ATOM 1488 CG1 ILE A 190 83.337 -14.262 4.299 1.00 0.00 ATOM 1489 CG2 ILE A 190 82.460 -12.262 5.466 1.00 0.00 ATOM 1490 CD1 ILE A 190 83.588 -13.630 2.946 1.00 0.00 ATOM 1491 O ILE A 190 81.029 -13.204 8.112 1.00 0.00 ATOM 1492 C ILE A 190 80.713 -13.837 7.102 1.00 0.00 ATOM 1493 N ILE A 191 79.444 -13.985 6.737 1.00 0.00 ATOM 1494 CA ILE A 191 78.373 -13.349 7.494 1.00 0.00 ATOM 1495 CB ILE A 191 77.014 -13.379 6.626 1.00 0.00 ATOM 1496 CG1 ILE A 191 77.121 -12.640 5.283 1.00 0.00 ATOM 1497 CG2 ILE A 191 75.810 -12.825 7.471 1.00 0.00 ATOM 1498 CD1 ILE A 191 75.842 -12.813 4.382 1.00 0.00 ATOM 1499 O ILE A 191 78.077 -13.252 9.866 1.00 0.00 ATOM 1500 C ILE A 191 78.260 -13.966 8.882 1.00 0.00 ATOM 1501 N HIS A 192 78.383 -15.288 8.979 1.00 0.00 ATOM 1502 CA HIS A 192 78.324 -15.947 10.263 1.00 0.00 ATOM 1503 CB HIS A 192 78.411 -17.467 10.094 1.00 0.00 ATOM 1504 CG HIS A 192 78.370 -18.219 11.389 1.00 0.00 ATOM 1505 CD2 HIS A 192 79.337 -18.879 12.068 1.00 0.00 ATOM 1506 ND1 HIS A 192 77.218 -18.350 12.135 1.00 0.00 ATOM 1507 CE1 HIS A 192 77.479 -19.058 13.220 1.00 0.00 ATOM 1508 NE2 HIS A 192 78.756 -19.392 13.201 1.00 0.00 ATOM 1509 O HIS A 192 79.191 -15.133 12.351 1.00 0.00 ATOM 1510 C HIS A 192 79.431 -15.446 11.186 1.00 0.00 ATOM 1511 N ASP A 193 80.650 -15.350 10.663 1.00 0.00 ATOM 1512 CA ASP A 193 81.758 -14.891 11.489 1.00 0.00 ATOM 1513 CB ASP A 193 83.084 -15.035 10.735 1.00 0.00 ATOM 1514 CG ASP A 193 83.565 -16.473 10.581 1.00 0.00 ATOM 1515 OD1 ASP A 193 83.027 -17.331 11.239 1.00 0.00 ATOM 1516 OD2 ASP A 193 84.350 -16.721 9.699 1.00 0.00 ATOM 1517 O ASP A 193 81.870 -13.090 13.094 1.00 0.00 ATOM 1518 C ASP A 193 81.563 -13.434 11.952 1.00 0.00 ATOM 1519 N SER A 194 81.013 -12.617 11.071 1.00 0.00 ATOM 1520 CA SER A 194 80.754 -11.218 11.374 1.00 0.00 ATOM 1521 CB SER A 194 80.278 -10.443 10.114 1.00 0.00 ATOM 1522 OG SER A 194 81.296 -10.350 9.134 1.00 0.00 ATOM 1523 O SER A 194 79.926 -10.275 13.436 1.00 0.00 ATOM 1524 C SER A 194 79.732 -11.070 12.509 1.00 0.00 ATOM 1525 N LEU A 195 78.635 -11.804 12.425 1.00 0.00 ATOM 1526 CA LEU A 195 77.593 -11.743 13.449 1.00 0.00 ATOM 1527 CB LEU A 195 76.381 -12.608 13.056 1.00 0.00 ATOM 1528 CG LEU A 195 75.157 -12.396 13.944 1.00 0.00 ATOM 1529 CD1 LEU A 195 74.584 -10.980 13.881 1.00 0.00 ATOM 1530 CD2 LEU A 195 74.090 -13.417 13.582 1.00 0.00 ATOM 1531 O LEU A 195 77.663 -11.598 15.825 1.00 0.00 ATOM 1532 C LEU A 195 78.090 -12.181 14.825 1.00 0.00 ATOM 1533 N GLN A 196 78.975 -13.139 14.866 1.00 0.00 ATOM 1534 CA GLN A 196 79.535 -13.620 16.147 1.00 0.00 ATOM 1535 CB GLN A 196 80.291 -14.938 15.950 1.00 0.00 ATOM 1536 CG GLN A 196 79.418 -16.093 15.489 1.00 0.00 ATOM 1537 CD GLN A 196 78.322 -16.423 16.483 1.00 0.00 ATOM 1538 OE1 GLN A 196 78.569 -16.540 17.688 1.00 0.00 ATOM 1539 NE2 GLN A 196 77.099 -16.578 15.985 1.00 0.00 ATOM 1540 O GLN A 196 80.724 -12.668 18.004 1.00 0.00 ATOM 1541 C GLN A 196 80.460 -12.597 16.803 1.00 0.00 ATOM 1542 N LEU A 197 80.927 -11.646 16.039 1.00 0.00 ATOM 1543 CA LEU A 197 81.811 -10.611 16.565 1.00 0.00 ATOM 1544 CB LEU A 197 82.765 -10.126 15.466 1.00 0.00 ATOM 1545 CG LEU A 197 83.848 -11.132 15.052 1.00 0.00 ATOM 1546 CD1 LEU A 197 84.663 -10.574 13.893 1.00 0.00 ATOM 1547 CD2 LEU A 197 84.745 -11.432 16.247 1.00 0.00 ATOM 1548 O LEU A 197 81.607 -8.582 17.833 1.00 0.00 ATOM 1549 C LEU A 197 81.038 -9.425 17.140 1.00 0.00 ATOM 1550 N GLY A 198 79.729 -9.387 16.891 1.00 0.00 ATOM 1551 CA GLY A 198 78.889 -8.281 17.351 1.00 0.00 ATOM 1552 O GLY A 198 78.889 -8.678 19.715 1.00 0.00 ATOM 1553 C GLY A 198 78.695 -7.880 18.797 1.00 0.00 ATOM 1554 N LYS A 199 78.256 -6.558 19.046 1.00 0.00 ATOM 1555 CA LYS A 199 77.987 -5.995 20.368 1.00 0.00 ATOM 1556 CB LYS A 199 78.851 -4.772 20.648 1.00 0.00 ATOM 1557 CG LYS A 199 78.510 -4.058 21.959 1.00 0.00 ATOM 1558 CD LYS A 199 79.675 -3.206 22.488 1.00 0.00 ATOM 1559 CE LYS A 199 80.935 -4.030 22.705 1.00 0.00 ATOM 1560 NZ LYS A 199 82.044 -3.234 23.335 1.00 0.00 ATOM 1561 O LYS A 199 76.351 -4.966 18.945 1.00 0.00 ATOM 1562 C LYS A 199 76.639 -5.322 20.090 1.00 0.00 ATOM 1563 N ARG A 200 75.759 -5.271 21.088 1.00 0.00 ATOM 1564 CA ARG A 200 74.465 -4.619 20.905 1.00 0.00 ATOM 1565 CB ARG A 200 73.600 -4.696 22.155 1.00 0.00 ATOM 1566 CG ARG A 200 74.101 -3.870 23.329 1.00 0.00 ATOM 1567 CD ARG A 200 73.220 -3.910 24.525 1.00 0.00 ATOM 1568 NE ARG A 200 73.642 -3.040 25.612 1.00 0.00 ATOM 1569 CZ ARG A 200 73.378 -1.721 25.682 1.00 0.00 ATOM 1570 NH1 ARG A 200 72.729 -1.107 24.717 1.00 0.00 ATOM 1571 NH2 ARG A 200 73.810 -1.054 26.738 1.00 0.00 ATOM 1572 O ARG A 200 75.960 -2.748 20.755 1.00 0.00 ATOM 1573 C ARG A 200 74.873 -3.232 20.441 1.00 0.00 ATOM 1574 N LEU A 201 74.137 -2.617 19.649 1.00 0.00 ATOM 1575 CA LEU A 201 74.339 -1.273 19.125 1.00 0.00 ATOM 1576 CB LEU A 201 74.866 -0.347 20.309 1.00 0.00 ATOM 1577 CG LEU A 201 74.749 1.167 20.258 1.00 0.00 ATOM 1578 CD1 LEU A 201 73.379 1.585 20.751 1.00 0.00 ATOM 1579 CD2 LEU A 201 75.845 1.759 21.130 1.00 0.00 ATOM 1580 O LEU A 201 75.904 -0.164 17.672 1.00 0.00 ATOM 1581 C LEU A 201 75.470 -1.235 18.109 1.00 0.00 ATOM 1582 N ARG A 202 75.971 -2.413 17.750 1.00 0.00 ATOM 1583 CA ARG A 202 77.052 -2.495 16.788 1.00 0.00 ATOM 1584 CB ARG A 202 77.449 -3.943 16.597 1.00 0.00 ATOM 1585 CG ARG A 202 78.508 -4.156 15.546 1.00 0.00 ATOM 1586 CD ARG A 202 78.842 -5.613 15.356 1.00 0.00 ATOM 1587 NE ARG A 202 79.878 -5.815 14.355 1.00 0.00 ATOM 1588 CZ ARG A 202 80.284 -7.005 13.930 1.00 0.00 ATOM 1589 NH1 ARG A 202 79.747 -8.116 14.415 1.00 0.00 ATOM 1590 NH2 ARG A 202 81.230 -7.077 13.012 1.00 0.00 ATOM 1591 O ARG A 202 75.396 -2.281 15.071 1.00 0.00 ATOM 1592 C ARG A 202 76.583 -2.162 15.385 1.00 0.00 ATOM 1593 N TRP A 203 77.508 -1.714 14.547 1.00 0.00 ATOM 1594 CA TRP A 203 77.184 -1.349 13.181 1.00 0.00 ATOM 1595 CB TRP A 203 77.472 0.163 13.006 1.00 0.00 ATOM 1596 CG TRP A 203 76.745 1.080 13.907 1.00 0.00 ATOM 1597 CD1 TRP A 203 77.125 1.482 15.144 1.00 0.00 ATOM 1598 CD2 TRP A 203 75.539 1.753 13.588 1.00 0.00 ATOM 1599 CE2 TRP A 203 75.224 2.574 14.714 1.00 0.00 ATOM 1600 CE3 TRP A 203 74.673 1.782 12.493 1.00 0.00 ATOM 1601 NE1 TRP A 203 76.219 2.385 15.632 1.00 0.00 ATOM 1602 CZ2 TRP A 203 74.089 3.391 14.740 1.00 0.00 ATOM 1603 CZ3 TRP A 203 73.557 2.585 12.512 1.00 0.00 ATOM 1604 CH2 TRP A 203 73.266 3.382 13.635 1.00 0.00 ATOM 1605 O TRP A 203 78.992 -2.658 12.289 1.00 0.00 ATOM 1606 C TRP A 203 77.817 -2.296 12.166 1.00 0.00 ATOM 1607 N TYR A 204 77.022 -2.721 11.185 1.00 0.00 ATOM 1608 CA TYR A 204 77.517 -3.584 10.114 1.00 0.00 ATOM 1609 CB TYR A 204 76.833 -4.964 10.170 1.00 0.00 ATOM 1610 CG TYR A 204 77.452 -6.076 9.359 1.00 0.00 ATOM 1611 CD1 TYR A 204 78.566 -6.747 9.860 1.00 0.00 ATOM 1612 CD2 TYR A 204 76.907 -6.512 8.163 1.00 0.00 ATOM 1613 CE1 TYR A 204 79.144 -7.780 9.182 1.00 0.00 ATOM 1614 CE2 TYR A 204 77.486 -7.568 7.460 1.00 0.00 ATOM 1615 CZ TYR A 204 78.603 -8.184 7.986 1.00 0.00 ATOM 1616 OH TYR A 204 79.204 -9.263 7.337 1.00 0.00 ATOM 1617 O TYR A 204 76.266 -2.496 8.381 1.00 0.00 ATOM 1618 C TYR A 204 77.372 -2.868 8.775 1.00 0.00 ATOM 1619 N SER A 205 78.501 -2.592 8.131 1.00 0.00 ATOM 1620 CA SER A 205 78.514 -1.956 6.820 1.00 0.00 ATOM 1621 CB SER A 205 79.397 -0.724 6.854 1.00 0.00 ATOM 1622 OG SER A 205 79.494 -0.108 5.598 1.00 0.00 ATOM 1623 O SER A 205 80.131 -3.551 6.084 1.00 0.00 ATOM 1624 C SER A 205 79.013 -3.068 5.913 1.00 0.00 ATOM 1625 N CYS A 206 78.146 -3.552 5.032 1.00 0.00 ATOM 1626 CA CYS A 206 78.525 -4.659 4.172 1.00 0.00 ATOM 1627 CB CYS A 206 77.839 -5.945 4.625 1.00 0.00 ATOM 1628 SG CYS A 206 78.624 -7.432 3.931 1.00 0.00 ATOM 1629 O CYS A 206 77.041 -4.139 2.349 1.00 0.00 ATOM 1630 C CYS A 206 78.173 -4.489 2.697 1.00 0.00 ATOM 1631 N MET A 207 79.105 -4.785 1.921 1.00 0.00 ATOM 1632 CA MET A 207 78.910 -4.635 0.487 1.00 0.00 ATOM 1633 CB MET A 207 79.426 -3.264 0.052 1.00 0.00 ATOM 1634 CG MET A 207 80.925 -3.069 0.228 1.00 0.00 ATOM 1635 SD MET A 207 81.498 -1.479 -0.397 1.00 0.00 ATOM 1636 CE MET A 207 80.912 -0.379 0.890 1.00 0.00 ATOM 1637 O MET A 207 80.561 -6.320 -0.054 1.00 0.00 ATOM 1638 C MET A 207 79.473 -5.789 -0.326 1.00 0.00 ATOM 1639 N LEU A 208 78.698 -6.184 -1.311 1.00 0.00 ATOM 1640 CA LEU A 208 79.118 -7.325 -2.107 1.00 0.00 ATOM 1641 CB LEU A 208 78.345 -8.636 -1.919 1.00 0.00 ATOM 1642 CG LEU A 208 79.081 -9.719 -1.118 1.00 0.00 ATOM 1643 CD1 LEU A 208 78.986 -9.420 0.370 1.00 0.00 ATOM 1644 CD2 LEU A 208 78.483 -11.079 -1.437 1.00 0.00 ATOM 1645 O LEU A 208 79.426 -6.423 -4.302 1.00 0.00 ATOM 1646 C LEU A 208 79.257 -7.408 -3.599 1.00 0.00 ATOM 1647 N GLY A 209 79.120 -8.666 -4.179 1.00 0.00 ATOM 1648 CA GLY A 209 79.261 -8.860 -5.609 1.00 0.00 ATOM 1649 O GLY A 209 76.882 -8.839 -5.702 1.00 0.00 ATOM 1650 C GLY A 209 77.925 -8.701 -6.332 1.00 0.00 ATOM 1651 N LYS A 210 77.919 -8.381 -7.621 1.00 0.00 ATOM 1652 CA LYS A 210 76.624 -8.222 -8.271 1.00 0.00 ATOM 1653 CB LYS A 210 76.821 -7.660 -9.683 1.00 0.00 ATOM 1654 CG LYS A 210 75.541 -7.286 -10.400 1.00 0.00 ATOM 1655 CD LYS A 210 75.836 -6.628 -11.735 1.00 0.00 ATOM 1656 CE LYS A 210 74.556 -6.197 -12.426 1.00 0.00 ATOM 1657 NZ LYS A 210 74.838 -5.488 -13.707 1.00 0.00 ATOM 1658 O LYS A 210 74.576 -9.497 -8.065 1.00 0.00 ATOM 1659 C LYS A 210 75.806 -9.521 -8.205 1.00 0.00 ATOM 1660 N ALA A 211 76.519 -10.662 -8.311 1.00 0.00 ATOM 1661 CA ALA A 211 75.851 -11.966 -8.263 1.00 0.00 ATOM 1662 CB ALA A 211 76.839 -13.087 -8.536 1.00 0.00 ATOM 1663 O ALA A 211 74.133 -12.868 -6.854 1.00 0.00 ATOM 1664 C ALA A 211 75.132 -12.152 -6.927 1.00 0.00 ATOM 1665 N CYS A 212 75.621 -11.526 -5.882 1.00 0.00 ATOM 1666 CA CYS A 212 74.981 -11.681 -4.576 1.00 0.00 ATOM 1667 CB CYS A 212 76.079 -11.843 -3.465 1.00 0.00 ATOM 1668 SG CYS A 212 77.385 -13.029 -3.800 1.00 0.00 ATOM 1669 O CYS A 212 74.127 -9.458 -4.278 1.00 0.00 ATOM 1670 C CYS A 212 73.912 -10.603 -4.682 1.00 0.00 ATOM 1671 N SER A 213 72.831 -10.943 -5.365 1.00 0.00 ATOM 1672 CA SER A 213 71.714 -10.028 -5.605 1.00 0.00 ATOM 1673 CB SER A 213 70.568 -10.767 -6.273 1.00 0.00 ATOM 1674 OG SER A 213 69.375 -10.033 -6.229 1.00 0.00 ATOM 1675 O SER A 213 71.469 -9.870 -3.225 1.00 0.00 ATOM 1676 C SER A 213 71.223 -9.370 -4.322 1.00 0.00 ATOM 1677 N LEU A 214 70.524 -8.268 -4.470 1.00 0.00 ATOM 1678 CA LEU A 214 69.986 -7.565 -3.312 1.00 0.00 ATOM 1679 CB LEU A 214 69.423 -6.171 -3.801 1.00 0.00 ATOM 1680 CG LEU A 214 68.868 -5.300 -2.654 1.00 0.00 ATOM 1681 CD1 LEU A 214 69.938 -5.087 -1.587 1.00 0.00 ATOM 1682 CD2 LEU A 214 68.425 -3.956 -3.200 1.00 0.00 ATOM 1683 O LEU A 214 69.053 -8.471 -1.293 1.00 0.00 ATOM 1684 C LEU A 214 69.037 -8.472 -2.527 1.00 0.00 ATOM 1685 N ALA A 215 68.205 -9.273 -3.224 1.00 0.00 ATOM 1686 CA ALA A 215 67.281 -10.157 -2.511 1.00 0.00 ATOM 1687 CB ALA A 215 66.395 -10.905 -3.494 1.00 0.00 ATOM 1688 O ALA A 215 67.872 -11.330 -0.499 1.00 0.00 ATOM 1689 C ALA A 215 68.103 -11.156 -1.694 1.00 0.00 ATOM 1690 N PRO A 216 69.107 -11.782 -2.325 1.00 0.00 ATOM 1691 CA PRO A 216 69.907 -12.745 -1.559 1.00 0.00 ATOM 1692 CB PRO A 216 70.857 -13.345 -2.559 1.00 0.00 ATOM 1693 CG PRO A 216 70.140 -13.272 -3.845 1.00 0.00 ATOM 1694 CD PRO A 216 69.249 -12.054 -3.797 1.00 0.00 ATOM 1695 O PRO A 216 70.944 -12.775 0.607 1.00 0.00 ATOM 1696 C PRO A 216 70.709 -12.130 -0.417 1.00 0.00 ATOM 1697 N LEU A 217 71.138 -10.873 -0.596 1.00 0.00 ATOM 1698 CA LEU A 217 71.909 -10.192 0.436 1.00 0.00 ATOM 1699 CB LEU A 217 72.443 -8.861 -0.104 1.00 0.00 ATOM 1700 CG LEU A 217 73.704 -8.967 -0.973 1.00 0.00 ATOM 1701 CD1 LEU A 217 74.019 -7.619 -1.604 1.00 0.00 ATOM 1702 CD2 LEU A 217 74.869 -9.448 -0.120 1.00 0.00 ATOM 1703 O LEU A 217 71.517 -10.236 2.798 1.00 0.00 ATOM 1704 C LEU A 217 71.081 -9.931 1.685 1.00 0.00 ATOM 1705 N LYS A 218 69.876 -9.373 1.526 1.00 0.00 ATOM 1706 CA LYS A 218 69.016 -9.088 2.666 1.00 0.00 ATOM 1707 CB LYS A 218 67.759 -8.341 2.218 1.00 0.00 ATOM 1708 CG LYS A 218 66.830 -7.937 3.354 1.00 0.00 ATOM 1709 CD LYS A 218 65.636 -7.147 2.837 1.00 0.00 ATOM 1710 CE LYS A 218 64.769 -6.643 3.981 1.00 0.00 ATOM 1711 NZ LYS A 218 64.117 -7.758 4.719 1.00 0.00 ATOM 1712 O LYS A 218 68.550 -10.431 4.558 1.00 0.00 ATOM 1713 C LYS A 218 68.618 -10.383 3.348 1.00 0.00 ATOM 1714 N GLU A 219 68.352 -11.424 2.567 1.00 0.00 ATOM 1715 CA GLU A 219 67.985 -12.722 3.098 1.00 0.00 ATOM 1716 CB GLU A 219 67.591 -13.679 1.971 1.00 0.00 ATOM 1717 CG GLU A 219 66.298 -13.311 1.256 1.00 0.00 ATOM 1718 CD GLU A 219 65.107 -13.488 2.157 1.00 0.00 ATOM 1719 OE1 GLU A 219 64.960 -14.548 2.714 1.00 0.00 ATOM 1720 OE2 GLU A 219 64.404 -12.528 2.373 1.00 0.00 ATOM 1721 O GLU A 219 68.798 -13.852 5.051 1.00 0.00 ATOM 1722 C GLU A 219 69.076 -13.331 3.970 1.00 0.00 ATOM 1723 N GLU A 220 70.323 -13.255 3.509 1.00 0.00 ATOM 1724 CA GLU A 220 71.429 -13.804 4.283 1.00 0.00 ATOM 1725 CB GLU A 220 72.715 -13.793 3.454 1.00 0.00 ATOM 1726 CG GLU A 220 72.723 -14.783 2.296 1.00 0.00 ATOM 1727 CD GLU A 220 72.523 -16.192 2.778 1.00 0.00 ATOM 1728 OE1 GLU A 220 73.239 -16.607 3.660 1.00 0.00 ATOM 1729 OE2 GLU A 220 71.582 -16.817 2.351 1.00 0.00 ATOM 1730 O GLU A 220 71.871 -13.629 6.639 1.00 0.00 ATOM 1731 C GLU A 220 71.651 -13.045 5.575 1.00 0.00 ATOM 1732 N LEU A 221 71.478 -11.738 5.500 1.00 0.00 ATOM 1733 CA LEU A 221 71.642 -10.964 6.698 1.00 0.00 ATOM 1734 CB LEU A 221 71.656 -9.467 6.366 1.00 0.00 ATOM 1735 CG LEU A 221 72.801 -9.011 5.453 1.00 0.00 ATOM 1736 CD1 LEU A 221 72.504 -7.626 4.893 1.00 0.00 ATOM 1737 CD2 LEU A 221 74.105 -9.006 6.236 1.00 0.00 ATOM 1738 O LEU A 221 70.825 -11.408 8.915 1.00 0.00 ATOM 1739 C LEU A 221 70.551 -11.281 7.722 1.00 0.00 ATOM 1740 N ARG A 222 69.341 -11.384 7.242 1.00 0.00 ATOM 1741 CA ARG A 222 68.222 -11.695 8.125 1.00 0.00 ATOM 1742 CB ARG A 222 66.891 -11.541 7.405 1.00 0.00 ATOM 1743 CG ARG A 222 65.665 -11.739 8.280 1.00 0.00 ATOM 1744 CD ARG A 222 64.370 -11.622 7.557 1.00 0.00 ATOM 1745 NE ARG A 222 64.139 -12.661 6.566 1.00 0.00 ATOM 1746 CZ ARG A 222 63.742 -13.915 6.850 1.00 0.00 ATOM 1747 NH1 ARG A 222 63.572 -14.306 8.092 1.00 0.00 ATOM 1748 NH2 ARG A 222 63.557 -14.755 5.846 1.00 0.00 ATOM 1749 O ARG A 222 68.152 -13.292 9.983 1.00 0.00 ATOM 1750 C ARG A 222 68.394 -13.090 8.790 1.00 0.00 ATOM 1751 N ILE A 223 68.791 -14.033 7.982 1.00 0.00 ATOM 1752 CA ILE A 223 68.983 -15.386 8.479 1.00 0.00 ATOM 1753 CB ILE A 223 69.340 -16.360 7.340 1.00 0.00 ATOM 1754 CG1 ILE A 223 68.156 -16.523 6.386 1.00 0.00 ATOM 1755 CG2 ILE A 223 69.759 -17.709 7.907 1.00 0.00 ATOM 1756 CD1 ILE A 223 68.500 -17.244 5.102 1.00 0.00 ATOM 1757 O ILE A 223 69.995 -16.100 10.574 1.00 0.00 ATOM 1758 C ILE A 223 70.097 -15.431 9.522 1.00 0.00 ATOM 1759 N GLN A 224 71.150 -14.677 9.245 1.00 0.00 ATOM 1760 CA GLN A 224 72.268 -14.643 10.162 1.00 0.00 ATOM 1761 CB GLN A 224 73.464 -13.884 9.592 1.00 0.00 ATOM 1762 CG GLN A 224 74.657 -13.822 10.505 1.00 0.00 ATOM 1763 CD GLN A 224 75.245 -15.198 10.824 1.00 0.00 ATOM 1764 OE1 GLN A 224 75.883 -15.405 11.890 1.00 0.00 ATOM 1765 NE2 GLN A 224 75.000 -16.145 9.935 1.00 0.00 ATOM 1766 O GLN A 224 72.111 -14.675 12.525 1.00 0.00 ATOM 1767 C GLN A 224 71.806 -14.067 11.515 1.00 0.00 ATOM 1768 N GLY A 225 71.035 -12.970 11.492 1.00 0.00 ATOM 1769 CA GLY A 225 70.444 -12.436 12.705 1.00 0.00 ATOM 1770 O GLY A 225 69.154 -13.449 14.440 1.00 0.00 ATOM 1771 C GLY A 225 69.332 -13.314 13.230 1.00 0.00 ATOM 1772 N VAL A 226 70.680 -11.756 14.240 1.00 0.00 ATOM 1773 CA VAL A 226 70.214 -11.323 15.542 1.00 0.00 ATOM 1774 CB VAL A 226 71.354 -11.214 16.560 1.00 0.00 ATOM 1775 CG1 VAL A 226 71.945 -12.619 16.805 1.00 0.00 ATOM 1776 CG2 VAL A 226 72.442 -10.213 16.144 1.00 0.00 ATOM 1777 O VAL A 226 70.041 -9.171 14.482 1.00 0.00 ATOM 1778 C VAL A 226 69.431 -10.058 15.096 1.00 0.00 ATOM 1779 N PRO A 227 68.140 -10.066 15.287 1.00 0.00 ATOM 1780 CA PRO A 227 67.333 -9.015 14.653 1.00 0.00 ATOM 1781 CB PRO A 227 65.902 -9.477 14.944 1.00 0.00 ATOM 1782 CG PRO A 227 66.009 -10.344 16.192 1.00 0.00 ATOM 1783 CD PRO A 227 67.322 -11.046 15.998 1.00 0.00 ATOM 1784 O PRO A 227 67.388 -7.302 16.337 1.00 0.00 ATOM 1785 C PRO A 227 67.698 -7.631 15.188 1.00 0.00 ATOM 1786 N LYS A 228 68.374 -6.829 14.368 1.00 0.00 ATOM 1787 CA LYS A 228 68.774 -5.493 14.792 1.00 0.00 ATOM 1788 CB LYS A 228 69.634 -4.869 13.724 1.00 0.00 ATOM 1789 CG LYS A 228 71.034 -5.522 13.744 1.00 0.00 ATOM 1790 CD LYS A 228 72.041 -4.819 12.846 1.00 0.00 ATOM 1791 CE LYS A 228 73.301 -5.655 12.642 1.00 0.00 ATOM 1792 NZ LYS A 228 74.024 -5.978 13.900 1.00 0.00 ATOM 1793 O LYS A 228 66.683 -4.955 13.718 1.00 0.00 ATOM 1794 C LYS A 228 67.606 -4.563 14.452 1.00 0.00 ATOM 1795 N VAL A 229 67.616 -3.379 14.913 1.00 0.00 ATOM 1796 CA VAL A 229 66.498 -2.447 14.791 1.00 0.00 ATOM 1797 CB VAL A 229 66.438 -1.661 16.251 1.00 0.00 ATOM 1798 CG1 VAL A 229 65.275 -0.677 16.302 1.00 0.00 ATOM 1799 CG2 VAL A 229 66.317 -2.643 17.410 1.00 0.00 ATOM 1800 O VAL A 229 65.223 -1.174 13.180 1.00 0.00 ATOM 1801 C VAL A 229 66.340 -1.457 13.624 1.00 0.00 ATOM 1802 N THR A 230 67.414 -0.998 13.072 1.00 0.00 ATOM 1803 CA THR A 230 67.364 -0.046 11.964 1.00 0.00 ATOM 1804 CB THR A 230 67.942 1.341 12.399 1.00 0.00 ATOM 1805 CG2 THR A 230 69.431 1.209 12.670 1.00 0.00 ATOM 1806 OG1 THR A 230 67.734 2.303 11.353 1.00 0.00 ATOM 1807 O THR A 230 69.113 -1.169 10.784 1.00 0.00 ATOM 1808 C THR A 230 68.031 -0.617 10.713 1.00 0.00 ATOM 1809 N TYR A 231 67.336 -0.482 9.595 1.00 0.00 ATOM 1810 CA TYR A 231 67.851 -1.003 8.338 1.00 0.00 ATOM 1811 CB TYR A 231 67.023 -2.154 7.741 1.00 0.00 ATOM 1812 CG TYR A 231 66.868 -3.350 8.607 1.00 0.00 ATOM 1813 CD1 TYR A 231 67.750 -4.422 8.555 1.00 0.00 ATOM 1814 CD2 TYR A 231 65.768 -3.443 9.449 1.00 0.00 ATOM 1815 CE1 TYR A 231 67.545 -5.570 9.300 1.00 0.00 ATOM 1816 CE2 TYR A 231 65.541 -4.594 10.223 1.00 0.00 ATOM 1817 CZ TYR A 231 66.436 -5.671 10.142 1.00 0.00 ATOM 1818 OH TYR A 231 66.226 -6.817 10.898 1.00 0.00 ATOM 1819 O TYR A 231 67.485 1.137 7.297 1.00 0.00 ATOM 1820 C TYR A 231 68.206 0.128 7.379 1.00 0.00 ATOM 1821 N THR A 232 69.165 -0.107 6.791 1.00 0.00 ATOM 1822 CA THR A 232 69.462 0.776 5.654 1.00 0.00 ATOM 1823 CB THR A 232 70.205 2.085 6.104 1.00 0.00 ATOM 1824 CG2 THR A 232 70.467 3.019 4.930 1.00 0.00 ATOM 1825 OG1 THR A 232 69.434 2.774 7.096 1.00 0.00 ATOM 1826 O THR A 232 71.286 -0.495 4.692 1.00 0.00 ATOM 1827 C THR A 232 70.126 -0.029 4.540 1.00 0.00 ATOM 1828 N GLU A 233 69.425 -0.054 3.377 1.00 0.00 ATOM 1829 CA GLU A 233 69.945 -0.726 2.219 1.00 0.00 ATOM 1830 CB GLU A 233 68.875 -1.506 1.446 1.00 0.00 ATOM 1831 CG GLU A 233 68.437 -2.757 2.201 1.00 0.00 ATOM 1832 CD GLU A 233 67.435 -3.615 1.505 1.00 0.00 ATOM 1833 OE1 GLU A 233 66.727 -3.090 0.575 1.00 0.00 ATOM 1834 OE2 GLU A 233 67.303 -4.822 1.860 1.00 0.00 ATOM 1835 O GLU A 233 70.075 1.543 1.474 1.00 0.00 ATOM 1836 C GLU A 233 70.541 0.401 1.399 1.00 0.00 ATOM 1837 N PHE A 234 71.566 0.062 0.670 1.00 0.00 ATOM 1838 CA PHE A 234 72.221 1.044 -0.177 1.00 0.00 ATOM 1839 CB PHE A 234 73.595 1.622 0.324 1.00 0.00 ATOM 1840 CG PHE A 234 73.558 2.559 1.489 1.00 0.00 ATOM 1841 CD1 PHE A 234 73.299 2.088 2.769 1.00 0.00 ATOM 1842 CD2 PHE A 234 73.803 3.922 1.308 1.00 0.00 ATOM 1843 CE1 PHE A 234 73.280 2.952 3.857 1.00 0.00 ATOM 1844 CE2 PHE A 234 73.786 4.797 2.392 1.00 0.00 ATOM 1845 CZ PHE A 234 73.524 4.311 3.671 1.00 0.00 ATOM 1846 O PHE A 234 72.968 -0.470 -1.861 1.00 0.00 ATOM 1847 C PHE A 234 72.359 0.571 -1.609 1.00 0.00 ATOM 1848 N CYS A 235 71.937 1.409 -2.548 1.00 0.00 ATOM 1849 CA CYS A 235 72.065 1.089 -3.960 1.00 0.00 ATOM 1850 CB CYS A 235 70.679 0.633 -4.497 1.00 0.00 ATOM 1851 SG CYS A 235 69.768 -0.541 -3.490 1.00 0.00 ATOM 1852 O CYS A 235 72.256 3.340 -4.754 1.00 0.00 ATOM 1853 C CYS A 235 72.840 2.303 -4.444 1.00 0.00 ATOM 1854 N GLN A 236 74.160 2.163 -4.522 1.00 0.00 ATOM 1855 CA GLN A 236 75.057 3.229 -4.950 1.00 0.00 ATOM 1856 CB GLN A 236 76.329 2.510 -4.174 1.00 0.00 ATOM 1857 CG GLN A 236 77.514 3.426 -4.003 1.00 0.00 ATOM 1858 CD GLN A 236 78.345 3.009 -2.795 1.00 0.00 ATOM 1859 OE1 GLN A 236 79.555 2.801 -2.901 1.00 0.00 ATOM 1860 NE2 GLN A 236 77.715 2.874 -1.630 1.00 0.00 ATOM 1861 O GLN A 236 75.733 2.066 -6.932 1.00 0.00 ATOM 1862 C GLN A 236 75.382 3.133 -6.432 1.00 0.00 ATOM 1863 N GLY A 237 75.363 4.158 -7.163 1.00 0.00 ATOM 1864 CA GLY A 237 75.662 4.170 -8.580 1.00 0.00 ATOM 1865 O GLY A 237 73.898 2.497 -8.755 1.00 0.00 ATOM 1866 C GLY A 237 74.473 3.487 -9.269 1.00 0.00 ATOM 1867 N ARG A 238 74.015 4.311 -10.348 1.00 0.00 ATOM 1868 CA ARG A 238 72.839 3.761 -11.051 1.00 0.00 ATOM 1869 CB ARG A 238 72.039 4.343 -12.121 1.00 0.00 ATOM 1870 CG ARG A 238 70.578 4.713 -11.904 1.00 0.00 ATOM 1871 CD ARG A 238 69.829 4.869 -13.221 1.00 0.00 ATOM 1872 NE ARG A 238 70.121 6.115 -13.926 1.00 0.00 ATOM 1873 CZ ARG A 238 69.697 7.315 -13.541 1.00 0.00 ATOM 1874 NH1 ARG A 238 70.011 8.389 -14.252 1.00 0.00 ATOM 1875 NH2 ARG A 238 68.958 7.445 -12.446 1.00 0.00 ATOM 1876 O ARG A 238 72.612 1.669 -12.166 1.00 0.00 ATOM 1877 C ARG A 238 73.274 2.347 -11.378 1.00 0.00 ATOM 1878 N THR A 239 74.368 1.884 -10.778 1.00 0.00 ATOM 1879 CA THR A 239 74.865 0.538 -11.046 1.00 0.00 ATOM 1880 CB THR A 239 76.387 0.455 -10.919 1.00 0.00 ATOM 1881 CG2 THR A 239 77.039 1.251 -12.047 1.00 0.00 ATOM 1882 OG1 THR A 239 76.825 0.987 -9.658 1.00 0.00 ATOM 1883 O THR A 239 73.701 0.004 -9.030 1.00 0.00 ATOM 1884 C THR A 239 74.315 -0.448 -10.013 1.00 0.00 ATOM 1885 N MET A 240 74.577 -1.677 -10.156 1.00 0.00 ATOM 1886 CA MET A 240 74.077 -2.662 -9.199 1.00 0.00 ATOM 1887 CB MET A 240 72.938 -3.403 -10.322 1.00 0.00 ATOM 1888 CG MET A 240 72.586 -2.568 -11.548 1.00 0.00 ATOM 1889 SD MET A 240 71.235 -3.294 -12.496 1.00 0.00 ATOM 1890 CE MET A 240 69.836 -3.024 -11.351 1.00 0.00 ATOM 1891 O MET A 240 75.233 -4.118 -7.679 1.00 0.00 ATOM 1892 C MET A 240 74.951 -2.956 -7.987 1.00 0.00 ATOM 1893 N ARG A 241 75.448 -1.791 -7.369 1.00 0.00 ATOM 1894 CA ARG A 241 76.308 -1.971 -6.208 1.00 0.00 ATOM 1895 CB ARG A 241 77.789 -1.676 -6.398 1.00 0.00 ATOM 1896 CG ARG A 241 78.726 -2.714 -5.802 1.00 0.00 ATOM 1897 CD ARG A 241 80.168 -2.364 -5.900 1.00 0.00 ATOM 1898 NE ARG A 241 81.067 -3.335 -5.299 1.00 0.00 ATOM 1899 CZ ARG A 241 82.411 -3.241 -5.303 1.00 0.00 ATOM 1900 NH1 ARG A 241 83.016 -2.242 -5.907 1.00 0.00 ATOM 1901 NH2 ARG A 241 83.105 -4.190 -4.705 1.00 0.00 ATOM 1902 O ARG A 241 74.744 -0.656 -4.956 1.00 0.00 ATOM 1903 C ARG A 241 75.421 -1.683 -4.999 1.00 0.00 ATOM 1904 N TRP A 242 75.408 -2.606 -4.127 1.00 0.00 ATOM 1905 CA TRP A 242 74.568 -2.453 -2.945 1.00 0.00 ATOM 1906 CB TRP A 242 73.761 -3.723 -2.798 1.00 0.00 ATOM 1907 CG TRP A 242 72.537 -3.637 -3.681 1.00 0.00 ATOM 1908 CD1 TRP A 242 71.443 -2.830 -3.506 1.00 0.00 ATOM 1909 CD2 TRP A 242 72.308 -4.369 -4.889 1.00 0.00 ATOM 1910 CE2 TRP A 242 71.056 -3.959 -5.394 1.00 0.00 ATOM 1911 CE3 TRP A 242 73.039 -5.336 -5.590 1.00 0.00 ATOM 1912 NE1 TRP A 242 70.547 -3.021 -4.532 1.00 0.00 ATOM 1913 CZ2 TRP A 242 70.519 -4.484 -6.576 1.00 0.00 ATOM 1914 CZ3 TRP A 242 72.500 -5.863 -6.768 1.00 0.00 ATOM 1915 CH2 TRP A 242 71.251 -5.429 -7.242 1.00 0.00 ATOM 1916 O TRP A 242 76.345 -3.489 -1.774 1.00 0.00 ATOM 1917 C TRP A 242 75.508 -2.618 -1.741 1.00 0.00 ATOM 1918 N ALA A 243 75.235 -1.872 -0.725 1.00 0.00 ATOM 1919 CA ALA A 243 75.989 -1.994 0.528 1.00 0.00 ATOM 1920 CB ALA A 243 77.325 -1.175 0.392 1.00 0.00 ATOM 1921 O ALA A 243 74.110 -0.795 1.425 1.00 0.00 ATOM 1922 C ALA A 243 74.924 -1.689 1.590 1.00 0.00 ATOM 1923 N LEU A 244 74.936 -2.436 2.690 1.00 0.00 ATOM 1924 CA LEU A 244 73.984 -2.218 3.770 1.00 0.00 ATOM 1925 CB LEU A 244 73.282 -3.515 4.171 1.00 0.00 ATOM 1926 CG LEU A 244 72.444 -4.255 3.120 1.00 0.00 ATOM 1927 CD1 LEU A 244 71.592 -3.266 2.338 1.00 0.00 ATOM 1928 CD2 LEU A 244 73.366 -5.009 2.179 1.00 0.00 ATOM 1929 O LEU A 244 75.686 -2.146 5.410 1.00 0.00 ATOM 1930 C LEU A 244 74.624 -1.684 5.031 1.00 0.00 ATOM 1931 N ALA A 245 73.959 -0.868 5.523 1.00 0.00 ATOM 1932 CA ALA A 245 74.460 -0.414 6.810 1.00 0.00 ATOM 1933 CB ALA A 245 75.070 0.982 6.654 1.00 0.00 ATOM 1934 O ALA A 245 72.166 -0.139 7.461 1.00 0.00 ATOM 1935 C ALA A 245 73.258 -0.655 7.717 1.00 0.00 ATOM 1936 N TRP A 246 73.452 -1.485 8.748 1.00 0.00 ATOM 1937 CA TRP A 246 72.376 -1.810 9.678 1.00 0.00 ATOM 1938 CB TRP A 246 72.107 -3.267 9.688 1.00 0.00 ATOM 1939 CG TRP A 246 71.386 -3.741 8.495 1.00 0.00 ATOM 1940 CD1 TRP A 246 70.927 -2.990 7.460 1.00 0.00 ATOM 1941 CD2 TRP A 246 70.918 -5.073 8.262 1.00 0.00 ATOM 1942 CE2 TRP A 246 70.222 -5.061 7.024 1.00 0.00 ATOM 1943 CE3 TRP A 246 71.033 -6.290 8.951 1.00 0.00 ATOM 1944 NE1 TRP A 246 70.259 -3.782 6.561 1.00 0.00 ATOM 1945 CZ2 TRP A 246 69.648 -6.202 6.463 1.00 0.00 ATOM 1946 CZ3 TRP A 246 70.455 -7.428 8.396 1.00 0.00 ATOM 1947 CH2 TRP A 246 69.769 -7.369 7.152 1.00 0.00 ATOM 1948 O TRP A 246 74.090 -1.536 11.320 1.00 0.00 ATOM 1949 C TRP A 246 72.886 -1.574 11.085 1.00 0.00 ATOM 1950 N SER A 247 71.924 -1.348 11.905 1.00 0.00 ATOM 1951 CA SER A 247 72.287 -1.211 13.314 1.00 0.00 ATOM 1952 CB SER A 247 72.162 0.136 13.860 1.00 0.00 ATOM 1953 OG SER A 247 72.456 -0.062 15.216 1.00 0.00 ATOM 1954 O SER A 247 70.321 -2.271 14.187 1.00 0.00 ATOM 1955 C SER A 247 71.548 -2.180 14.224 1.00 0.00 ATOM 1956 N PHE A 248 72.321 -2.936 15.028 1.00 0.00 ATOM 1957 CA PHE A 248 71.698 -3.897 15.936 1.00 0.00 ATOM 1958 CB PHE A 248 72.762 -4.779 16.576 1.00 0.00 ATOM 1959 CG PHE A 248 72.204 -5.850 17.447 1.00 0.00 ATOM 1960 CD1 PHE A 248 71.569 -6.953 16.874 1.00 0.00 ATOM 1961 CD2 PHE A 248 72.281 -5.753 18.837 1.00 0.00 ATOM 1962 CE1 PHE A 248 71.018 -7.943 17.703 1.00 0.00 ATOM 1963 CE2 PHE A 248 71.728 -6.733 19.672 1.00 0.00 ATOM 1964 CZ PHE A 248 71.079 -7.867 19.071 1.00 0.00 ATOM 1965 O PHE A 248 69.801 -3.613 17.376 1.00 0.00 ATOM 1966 C PHE A 248 70.907 -3.187 17.023 1.00 0.00 ATOM 1967 N TYR A 249 71.467 -2.063 17.559 1.00 0.00 ATOM 1968 CA TYR A 249 70.785 -1.318 18.605 1.00 0.00 ATOM 1969 CB TYR A 249 71.655 -0.155 19.086 1.00 0.00 ATOM 1970 CG TYR A 249 71.009 0.685 20.167 1.00 0.00 ATOM 1971 CD1 TYR A 249 70.926 0.223 21.470 1.00 0.00 ATOM 1972 CD2 TYR A 249 70.495 1.938 19.878 1.00 0.00 ATOM 1973 CE1 TYR A 249 70.338 0.986 22.463 1.00 0.00 ATOM 1974 CE2 TYR A 249 69.904 2.710 20.860 1.00 0.00 ATOM 1975 CZ TYR A 249 69.829 2.230 22.151 1.00 0.00 ATOM 1976 OH TYR A 249 69.243 2.996 23.135 1.00 0.00 ATOM 1977 O TYR A 249 69.351 -0.057 17.137 1.00 0.00 ATOM 1978 C TYR A 249 69.426 -0.787 18.128 1.00 0.00 ATOM 1979 N ASP A 250 68.465 -1.080 18.931 1.00 0.00 ATOM 1980 CA ASP A 250 67.099 -0.661 18.650 1.00 0.00 ATOM 1981 CB ASP A 250 66.107 -1.404 19.539 1.00 0.00 ATOM 1982 CG ASP A 250 66.379 -1.242 21.035 1.00 0.00 ATOM 1983 OD1 ASP A 250 67.214 -0.399 21.429 1.00 0.00 ATOM 1984 OD2 ASP A 250 65.746 -1.967 21.829 1.00 0.00 ATOM 1985 O ASP A 250 65.834 1.352 18.729 1.00 0.00 ATOM 1986 C ASP A 250 66.729 0.685 19.245 1.00 0.00 ENDMDL EXPDTA 2h00A MODEL 2 REMARK 44 REMARK 44 model 2 is called 2h00A ATOM 1 N VAL 1 100.112 13.323 -16.532 1.00 0.00 ATOM 2 CA VAL 1 98.954 12.434 -16.147 1.00 0.00 ATOM 3 CB VAL 1 98.455 12.691 -14.653 1.00 0.00 ATOM 4 CG1 VAL 1 97.050 12.197 -14.439 1.00 0.00 ATOM 5 CG2 VAL 1 99.361 12.000 -13.615 1.00 0.00 ATOM 6 O VAL 1 97.370 13.660 -17.491 1.00 0.00 ATOM 7 C VAL 1 97.794 12.566 -17.173 1.00 0.00 ATOM 8 N SER 2 97.272 11.444 -17.662 1.00 0.00 ATOM 9 CA SER 2 96.119 11.439 -18.573 1.00 0.00 ATOM 10 CB SER 2 95.698 9.984 -18.791 1.00 0.00 ATOM 11 OG SER 2 94.421 9.908 -19.367 1.00 0.00 ATOM 12 O SER 2 94.591 12.225 -16.877 1.00 0.00 ATOM 13 C SER 2 94.902 12.248 -18.081 1.00 0.00 ATOM 14 N LEU 3 94.208 12.929 -19.012 1.00 0.00 ATOM 15 CA LEU 3 92.937 13.684 -18.729 1.00 0.00 ATOM 16 CB LEU 3 92.854 14.946 -19.607 1.00 0.00 ATOM 17 CG LEU 3 94.036 15.909 -19.309 1.00 0.00 ATOM 18 CD1 LEU 3 94.205 16.976 -20.384 1.00 0.00 ATOM 19 CD2 LEU 3 93.896 16.545 -17.912 1.00 0.00 ATOM 20 O LEU 3 90.562 13.301 -18.473 1.00 0.00 ATOM 21 C LEU 3 91.660 12.856 -18.851 1.00 0.00 ATOM 22 N ASN 4 91.817 11.630 -19.355 1.00 0.00 ATOM 23 CA ASN 4 90.727 10.708 -19.584 1.00 0.00 ATOM 24 CB ASN 4 91.085 9.786 -20.801 1.00 0.00 ATOM 25 CG ASN 4 90.111 8.670 -21.008 1.00 0.00 ATOM 26 ND2 ASN 4 88.889 8.818 -20.500 1.00 0.00 ATOM 27 OD1 ASN 4 90.447 7.658 -21.658 1.00 0.00 ATOM 28 O ASN 4 91.365 9.085 -17.984 1.00 0.00 ATOM 29 C ASN 4 90.501 9.869 -18.345 1.00 0.00 ATOM 30 N PHE 5 89.326 9.989 -17.730 1.00 0.00 ATOM 31 CA PHE 5 89.062 9.306 -16.441 1.00 0.00 ATOM 32 CB PHE 5 88.059 10.099 -15.577 1.00 0.00 ATOM 33 CG PHE 5 88.734 11.232 -14.869 1.00 0.00 ATOM 34 CD1 PHE 5 89.526 10.974 -13.754 1.00 0.00 ATOM 35 CD2 PHE 5 88.706 12.520 -15.390 1.00 0.00 ATOM 36 CE1 PHE 5 90.256 12.014 -13.130 1.00 0.00 ATOM 37 CE2 PHE 5 89.423 13.567 -14.770 1.00 0.00 ATOM 38 CZ PHE 5 90.186 13.300 -13.636 1.00 0.00 ATOM 39 O PHE 5 88.642 7.197 -15.478 1.00 0.00 ATOM 40 C PHE 5 88.757 7.844 -16.502 1.00 0.00 ATOM 41 N LYS 6 88.648 7.298 -17.719 1.00 0.00 ATOM 42 CA LYS 6 88.770 5.841 -17.915 1.00 0.00 ATOM 43 CB LYS 6 88.241 5.433 -19.320 1.00 0.00 ATOM 44 CG LYS 6 86.787 5.737 -19.511 1.00 0.00 ATOM 45 CD LYS 6 86.207 5.169 -20.817 1.00 0.00 ATOM 46 CE LYS 6 84.707 5.329 -20.750 1.00 0.00 ATOM 47 NZ LYS 6 83.914 4.999 -21.988 1.00 0.00 ATOM 48 O LYS 6 90.329 4.096 -17.519 1.00 0.00 ATOM 49 C LYS 6 90.184 5.284 -17.678 1.00 0.00 ATOM 50 N ASP 7 91.232 6.107 -17.703 1.00 0.00 ATOM 51 CA ASP 7 92.589 5.633 -17.513 1.00 0.00 ATOM 52 CB ASP 7 93.594 6.592 -18.197 1.00 0.00 ATOM 53 CG ASP 7 93.475 6.577 -19.790 1.00 0.00 ATOM 54 OD1 ASP 7 93.199 5.486 -20.368 1.00 0.00 ATOM 55 OD2 ASP 7 93.685 7.627 -20.440 1.00 0.00 ATOM 56 O ASP 7 92.718 6.572 -15.288 1.00 0.00 ATOM 57 C ASP 7 92.872 5.561 -15.962 1.00 0.00 ATOM 58 N PRO 8 93.271 4.387 -15.438 1.00 0.00 ATOM 59 CA PRO 8 93.627 4.234 -14.000 1.00 0.00 ATOM 60 CB PRO 8 94.214 2.850 -13.922 1.00 0.00 ATOM 61 CG PRO 8 93.490 2.092 -15.023 1.00 0.00 ATOM 62 CD PRO 8 93.354 3.104 -16.164 1.00 0.00 ATOM 63 O PRO 8 94.627 5.653 -12.397 1.00 0.00 ATOM 64 C PRO 8 94.670 5.239 -13.545 1.00 0.00 ATOM 65 N GLU 9 95.608 5.630 -14.413 1.00 0.00 ATOM 66 CA GLU 9 96.554 6.675 -14.010 1.00 0.00 ATOM 67 CB GLU 9 97.619 6.936 -15.080 1.00 0.00 ATOM 68 CG GLU 9 98.568 8.061 -14.775 1.00 0.00 ATOM 69 CD GLU 9 99.405 8.421 -16.001 1.00 0.00 ATOM 70 OE1 GLU 9 98.860 8.896 -17.014 1.00 0.00 ATOM 71 OE2 GLU 9 100.615 8.210 -15.944 1.00 0.00 ATOM 72 O GLU 9 96.257 8.633 -12.646 1.00 0.00 ATOM 73 C GLU 9 95.842 7.993 -13.614 1.00 0.00 ATOM 74 N ALA 10 94.773 8.352 -14.328 1.00 0.00 ATOM 75 CA ALA 10 93.964 9.521 -14.007 1.00 0.00 ATOM 76 CB ALA 10 93.084 9.977 -15.155 1.00 0.00 ATOM 77 O ALA 10 93.059 10.233 -11.938 1.00 0.00 ATOM 78 C ALA 10 93.116 9.315 -12.755 1.00 0.00 ATOM 79 N VAL 11 92.416 8.183 -12.633 1.00 0.00 ATOM 80 CA VAL 11 91.661 7.893 -11.389 1.00 0.00 ATOM 81 CB VAL 11 90.896 6.539 -11.451 1.00 0.00 ATOM 82 CG1 VAL 11 89.965 6.331 -10.203 1.00 0.00 ATOM 83 CG2 VAL 11 90.058 6.444 -12.774 1.00 0.00 ATOM 84 O VAL 11 92.223 8.585 -9.122 1.00 0.00 ATOM 85 C VAL 11 92.607 7.987 -10.123 1.00 0.00 ATOM 86 N ARG 12 93.764 7.319 -10.182 1.00 0.00 ATOM 87 CA ARG 12 94.753 7.302 -9.059 1.00 0.00 ATOM 88 CB ARG 12 95.966 6.387 -9.311 1.00 0.00 ATOM 89 CG ARG 12 96.925 6.336 -8.104 1.00 0.00 ATOM 90 CD ARG 12 98.147 5.462 -8.256 1.00 0.00 ATOM 91 NE ARG 12 99.031 5.918 -9.332 1.00 0.00 ATOM 92 CZ ARG 12 100.197 5.357 -9.645 1.00 0.00 ATOM 93 NH1 ARG 12 100.675 4.300 -8.947 1.00 0.00 ATOM 94 NH2 ARG 12 100.884 5.862 -10.685 1.00 0.00 ATOM 95 O ARG 12 95.265 9.042 -7.483 1.00 0.00 ATOM 96 C ARG 12 95.229 8.695 -8.694 1.00 0.00 ATOM 97 N ALA 13 95.508 9.515 -9.721 1.00 0.00 ATOM 98 CA ALA 13 95.967 10.899 -9.508 1.00 0.00 ATOM 99 CB ALA 13 96.424 11.582 -10.849 1.00 0.00 ATOM 100 O ALA 13 95.096 12.451 -7.855 1.00 0.00 ATOM 101 C ALA 13 94.843 11.712 -8.828 1.00 0.00 ATOM 102 N LEU 14 93.604 11.525 -9.295 1.00 0.00 ATOM 103 CA LEU 14 92.469 12.227 -8.704 1.00 0.00 ATOM 104 CB LEU 14 91.199 12.115 -9.536 1.00 0.00 ATOM 105 CG LEU 14 89.940 12.600 -8.814 1.00 0.00 ATOM 106 CD1 LEU 14 89.973 14.112 -8.683 1.00 0.00 ATOM 107 CD2 LEU 14 88.633 12.121 -9.475 1.00 0.00 ATOM 108 O LEU 14 92.073 12.691 -6.401 1.00 0.00 ATOM 109 C LEU 14 92.195 11.820 -7.244 1.00 0.00 ATOM 110 N THR 15 92.114 10.520 -6.978 1.00 0.00 ATOM 111 CA THR 15 91.967 9.987 -5.631 1.00 0.00 ATOM 112 CB THR 15 91.901 8.415 -5.664 1.00 0.00 ATOM 113 CG2 THR 15 92.340 7.770 -4.317 1.00 0.00 ATOM 114 OG1 THR 15 90.568 8.024 -5.997 1.00 0.00 ATOM 115 O THR 15 92.771 10.942 -3.567 1.00 0.00 ATOM 116 C THR 15 93.072 10.500 -4.687 1.00 0.00 ATOM 117 N CYS 16 94.317 10.512 -5.154 1.00 0.00 ATOM 118 CA CYS 16 95.456 10.850 -4.262 1.00 0.00 ATOM 119 CB CYS 16 96.790 10.329 -4.785 1.00 0.00 ATOM 120 SG CYS 16 96.803 8.521 -4.738 1.00 0.00 ATOM 121 O CYS 16 95.848 12.780 -2.895 1.00 0.00 ATOM 122 C CYS 16 95.501 12.347 -4.020 1.00 0.00 ATOM 123 N THR 17 95.124 13.119 -5.058 1.00 0.00 ATOM 124 CA THR 17 94.980 14.582 -4.973 1.00 0.00 ATOM 125 CB THR 17 94.944 15.258 -6.356 1.00 0.00 ATOM 126 CG2 THR 17 94.947 16.748 -6.193 1.00 0.00 ATOM 127 OG1 THR 17 96.141 14.915 -7.102 1.00 0.00 ATOM 128 O THR 17 93.988 15.942 -3.255 1.00 0.00 ATOM 129 C THR 17 93.793 15.045 -4.085 1.00 0.00 ATOM 130 N LEU 18 92.614 14.423 -4.237 1.00 0.00 ATOM 131 CA LEU 18 91.490 14.609 -3.344 1.00 0.00 ATOM 132 CB LEU 18 90.351 13.666 -3.709 1.00 0.00 ATOM 133 CG LEU 18 89.126 14.335 -4.306 1.00 0.00 ATOM 134 CD1 LEU 18 89.519 15.217 -5.485 1.00 0.00 ATOM 135 CD2 LEU 18 88.109 13.266 -4.669 1.00 0.00 ATOM 136 O LEU 18 91.407 15.166 -0.978 1.00 0.00 ATOM 137 C LEU 18 91.811 14.369 -1.854 1.00 0.00 ATOM 138 N LEU 19 92.478 13.262 -1.579 1.00 0.00 ATOM 139 CA LEU 19 92.816 12.886 -0.210 1.00 0.00 ATOM 140 CB LEU 19 93.427 11.467 -0.183 1.00 0.00 ATOM 141 CG LEU 19 92.422 10.285 -0.352 1.00 0.00 ATOM 142 CD1 LEU 19 93.199 9.004 -0.453 1.00 0.00 ATOM 143 CD2 LEU 19 91.374 10.229 0.804 1.00 0.00 ATOM 144 O LEU 19 93.590 14.333 1.575 1.00 0.00 ATOM 145 C LEU 19 93.776 13.928 0.411 1.00 0.00 ATOM 146 N ARG 20 94.794 14.348 -0.347 1.00 0.00 ATOM 147 CA ARG 20 95.681 15.464 0.114 1.00 0.00 ATOM 148 CB ARG 20 96.851 15.670 -0.796 1.00 0.00 ATOM 149 CG ARG 20 97.778 14.556 -0.808 1.00 0.00 ATOM 150 CD ARG 20 98.848 14.782 -1.899 1.00 0.00 ATOM 151 NE ARG 20 99.666 13.596 -1.816 1.00 0.00 ATOM 152 CZ ARG 20 99.697 12.619 -2.716 1.00 0.00 ATOM 153 NH1 ARG 20 99.054 12.735 -3.887 1.00 0.00 ATOM 154 NH2 ARG 20 100.459 11.571 -2.453 1.00 0.00 ATOM 155 O ARG 20 95.095 17.388 1.471 1.00 0.00 ATOM 156 C ARG 20 94.983 16.788 0.362 1.00 0.00 ATOM 157 N GLU 21 94.257 17.247 -0.642 1.00 0.00 ATOM 158 CA GLU 21 93.509 18.526 -0.577 1.00 0.00 ATOM 159 CB GLU 21 92.884 18.854 -1.967 1.00 0.00 ATOM 160 CG GLU 21 94.036 19.058 -3.031 1.00 0.00 ATOM 161 CD GLU 21 93.573 19.515 -4.427 1.00 0.00 ATOM 162 OE1 GLU 21 92.357 19.402 -4.745 1.00 0.00 ATOM 163 OE2 GLU 21 94.458 19.952 -5.217 1.00 0.00 ATOM 164 O GLU 21 92.358 19.576 1.289 1.00 0.00 ATOM 165 C GLU 21 92.421 18.600 0.527 1.00 0.00 ATOM 166 N ASP 22 91.530 17.617 0.571 1.00 0.00 ATOM 167 CA ASP 22 90.414 17.696 1.496 1.00 0.00 ATOM 168 CB ASP 22 89.164 16.921 1.030 1.00 0.00 ATOM 169 CG ASP 22 88.752 17.246 -0.413 1.00 0.00 ATOM 170 OD1 ASP 22 88.701 18.441 -0.825 1.00 0.00 ATOM 171 OD2 ASP 22 88.504 16.277 -1.158 1.00 0.00 ATOM 172 O ASP 22 90.268 17.735 3.843 1.00 0.00 ATOM 173 C ASP 22 90.816 17.231 2.905 1.00 0.00 ATOM 174 N PHE 23 91.782 16.336 3.061 1.00 0.00 ATOM 175 CA PHE 23 91.988 15.661 4.357 1.00 0.00 ATOM 176 CB PHE 23 91.522 14.172 4.313 1.00 0.00 ATOM 177 CG PHE 23 90.069 14.001 3.906 1.00 0.00 ATOM 178 CD1 PHE 23 89.051 14.648 4.605 1.00 0.00 ATOM 179 CD2 PHE 23 89.723 13.229 2.804 1.00 0.00 ATOM 180 CE1 PHE 23 87.720 14.520 4.216 1.00 0.00 ATOM 181 CE2 PHE 23 88.392 13.111 2.381 1.00 0.00 ATOM 182 CZ PHE 23 87.385 13.758 3.068 1.00 0.00 ATOM 183 O PHE 23 93.691 15.215 6.012 1.00 0.00 ATOM 184 C PHE 23 93.386 15.696 4.863 1.00 0.00 ATOM 185 N GLY 24 94.275 16.184 4.023 1.00 0.00 ATOM 186 CA GLY 24 95.698 16.028 4.328 1.00 0.00 ATOM 187 O GLY 24 97.158 14.348 5.286 1.00 0.00 ATOM 188 C GLY 24 96.221 14.606 4.494 1.00 0.00 ATOM 189 N LEU 25 95.654 13.671 3.735 1.00 0.00 ATOM 190 CA LEU 25 96.166 12.320 3.705 1.00 0.00 ATOM 191 CB LEU 25 94.969 11.346 3.757 1.00 0.00 ATOM 192 CG LEU 25 94.266 11.268 5.114 1.00 0.00 ATOM 193 CD1 LEU 25 92.902 10.605 4.934 1.00 0.00 ATOM 194 CD2 LEU 25 95.143 10.464 6.083 1.00 0.00 ATOM 195 O LEU 25 96.507 12.377 1.380 1.00 0.00 ATOM 196 C LEU 25 96.995 12.127 2.427 1.00 0.00 ATOM 197 N SER 26 98.246 11.714 2.558 1.00 0.00 ATOM 198 CA SER 26 99.101 11.410 1.433 1.00 0.00 ATOM 199 CB SER 26 100.471 12.076 1.555 1.00 0.00 ATOM 200 OG SER 26 100.979 12.296 0.258 1.00 0.00 ATOM 201 O SER 26 99.842 9.278 2.289 1.00 0.00 ATOM 202 C SER 26 99.284 9.911 1.359 1.00 0.00 ATOM 203 N ILE 27 98.749 9.320 0.287 1.00 0.00 ATOM 204 CA ILE 27 98.904 7.884 0.117 1.00 0.00 ATOM 205 CB ILE 27 97.575 7.112 0.151 1.00 0.00 ATOM 206 CG1 ILE 27 96.690 7.478 -1.027 1.00 0.00 ATOM 207 CG2 ILE 27 96.846 7.361 1.542 1.00 0.00 ATOM 208 CD1 ILE 27 95.552 6.539 -1.187 1.00 0.00 ATOM 209 O ILE 27 99.665 8.235 -2.155 1.00 0.00 ATOM 210 C ILE 27 99.687 7.499 -1.142 1.00 0.00 ATOM 211 N ASP 28 100.320 6.339 -1.062 1.00 0.00 ATOM 212 CA ASP 28 101.021 5.759 -2.189 1.00 0.00 ATOM 213 CB ASP 28 102.504 5.551 -1.860 1.00 0.00 ATOM 214 CG ASP 28 103.297 4.967 -3.031 1.00 0.00 ATOM 215 OD1 ASP 28 102.942 5.229 -4.207 1.00 0.00 ATOM 216 OD2 ASP 28 104.318 4.278 -2.778 1.00 0.00 ATOM 217 O ASP 28 100.352 3.554 -1.589 1.00 0.00 ATOM 218 C ASP 28 100.361 4.443 -2.463 1.00 0.00 ATOM 219 N ILE 29 99.806 4.295 -3.678 1.00 0.00 ATOM 220 CA ILE 29 99.160 3.050 -4.033 1.00 0.00 ATOM 221 CB ILE 29 97.633 3.154 -3.961 1.00 0.00 ATOM 222 CG1 ILE 29 97.136 4.340 -4.784 1.00 0.00 ATOM 223 CG2 ILE 29 97.119 3.252 -2.432 1.00 0.00 ATOM 224 CD1 ILE 29 95.578 4.485 -4.697 1.00 0.00 ATOM 225 O ILE 29 99.732 3.467 -6.336 1.00 0.00 ATOM 226 C ILE 29 99.577 2.609 -5.456 1.00 0.00 ATOM 227 N PRO 30 99.748 1.282 -5.652 1.00 0.00 ATOM 228 CA PRO 30 100.195 0.692 -6.911 1.00 0.00 ATOM 229 CB PRO 30 100.687 -0.669 -6.479 1.00 0.00 ATOM 230 CG PRO 30 99.762 -1.038 -5.278 1.00 0.00 ATOM 231 CD PRO 30 99.413 0.251 -4.643 1.00 0.00 ATOM 232 O PRO 30 97.875 0.223 -7.419 1.00 0.00 ATOM 233 C PRO 30 99.016 0.537 -7.855 1.00 0.00 ATOM 234 N LEU 31 99.267 0.763 -9.154 1.00 0.00 ATOM 235 CA LEU 31 98.224 0.571 -10.183 1.00 0.00 ATOM 236 CB LEU 31 98.705 1.133 -11.562 1.00 0.00 ATOM 237 CG LEU 31 98.994 2.633 -11.530 1.00 0.00 ATOM 238 CD1 LEU 31 99.763 3.054 -12.782 1.00 0.00 ATOM 239 CD2 LEU 31 97.685 3.482 -11.373 1.00 0.00 ATOM 240 O LEU 31 96.802 -1.255 -10.839 1.00 0.00 ATOM 241 C LEU 31 97.834 -0.922 -10.275 1.00 0.00 ATOM 242 N GLU 32 98.618 -1.812 -9.664 1.00 0.00 ATOM 243 CA GLU 32 98.317 -3.253 -9.627 1.00 0.00 ATOM 244 CB GLU 32 99.495 -4.044 -9.065 1.00 0.00 ATOM 245 CG GLU 32 100.662 -4.250 -10.046 1.00 0.00 ATOM 246 CD GLU 32 101.570 -3.047 -10.139 1.00 0.00 ATOM 247 OE1 GLU 32 101.325 -2.036 -9.444 1.00 0.00 ATOM 248 OE2 GLU 32 102.514 -3.098 -10.938 1.00 0.00 ATOM 249 O GLU 32 96.498 -4.729 -9.038 1.00 0.00 ATOM 250 C GLU 32 97.060 -3.636 -8.815 1.00 0.00 ATOM 251 N ARG 33 96.656 -2.763 -7.875 1.00 0.00 ATOM 252 CA ARG 33 95.508 -3.055 -6.960 1.00 0.00 ATOM 253 CB ARG 33 95.971 -3.156 -5.474 1.00 0.00 ATOM 254 CG ARG 33 97.125 -4.182 -5.189 1.00 0.00 ATOM 255 CD ARG 33 96.511 -5.518 -5.054 1.00 0.00 ATOM 256 NE ARG 33 97.421 -6.638 -4.886 1.00 0.00 ATOM 257 CZ ARG 33 98.037 -7.337 -5.836 1.00 0.00 ATOM 258 NH1 ARG 33 97.900 -7.042 -7.149 1.00 0.00 ATOM 259 NH2 ARG 33 98.802 -8.353 -5.468 1.00 0.00 ATOM 260 O ARG 33 94.663 -0.961 -7.652 1.00 0.00 ATOM 261 C ARG 33 94.426 -2.027 -7.105 1.00 0.00 ATOM 262 N LEU 34 93.224 -2.373 -6.629 1.00 0.00 ATOM 263 CA LEU 34 92.039 -1.582 -6.713 1.00 0.00 ATOM 264 CB LEU 34 90.907 -2.211 -5.851 1.00 0.00 ATOM 265 CG LEU 34 89.615 -1.410 -5.618 1.00 0.00 ATOM 266 CD1 LEU 34 88.837 -1.104 -6.917 1.00 0.00 ATOM 267 CD2 LEU 34 88.672 -2.167 -4.642 1.00 0.00 ATOM 268 O LEU 34 92.907 -0.051 -5.076 1.00 0.00 ATOM 269 C LEU 34 92.362 -0.196 -6.214 1.00 0.00 ATOM 270 N ILE 35 92.030 0.786 -7.052 1.00 0.00 ATOM 271 CA ILE 35 92.266 2.214 -6.807 1.00 0.00 ATOM 272 CB ILE 35 92.570 3.035 -8.138 1.00 0.00 ATOM 273 CG1 ILE 35 93.815 2.498 -8.890 1.00 0.00 ATOM 274 CG2 ILE 35 92.619 4.541 -7.893 1.00 0.00 ATOM 275 CD1 ILE 35 95.129 2.478 -8.083 1.00 0.00 ATOM 276 O ILE 35 89.928 2.659 -6.982 1.00 0.00 ATOM 277 C ILE 35 90.914 2.662 -6.261 1.00 0.00 ATOM 278 N PRO 36 90.852 2.987 -4.948 1.00 0.00 ATOM 279 CA PRO 36 89.549 3.375 -4.424 1.00 0.00 ATOM 280 CB PRO 36 89.788 3.461 -2.886 1.00 0.00 ATOM 281 CG PRO 36 91.174 3.881 -2.760 1.00 0.00 ATOM 282 CD PRO 36 91.907 3.055 -3.900 1.00 0.00 ATOM 283 O PRO 36 89.858 5.595 -5.289 1.00 0.00 ATOM 284 C PRO 36 89.070 4.724 -4.967 1.00 0.00 ATOM 285 N THR 37 87.784 4.928 -5.027 1.00 0.00 ATOM 286 CA THR 37 87.315 6.243 -5.276 1.00 0.00 ATOM 287 CB THR 37 86.338 6.266 -6.455 1.00 0.00 ATOM 288 CG2 THR 37 87.070 5.805 -7.783 1.00 0.00 ATOM 289 OG1 THR 37 85.216 5.424 -6.167 1.00 0.00 ATOM 290 O THR 37 85.835 6.131 -3.360 1.00 0.00 ATOM 291 C THR 37 86.652 6.823 -4.002 1.00 0.00 ATOM 292 N VAL 38 86.972 8.078 -3.707 1.00 0.00 ATOM 293 CA VAL 38 86.803 8.643 -2.356 1.00 0.00 ATOM 294 CB VAL 38 87.717 9.907 -2.059 1.00 0.00 ATOM 295 CG1 VAL 38 87.462 10.479 -0.616 1.00 0.00 ATOM 296 CG2 VAL 38 89.182 9.630 -2.256 1.00 0.00 ATOM 297 O VAL 38 84.953 8.481 -0.916 1.00 0.00 ATOM 298 C VAL 38 85.331 8.875 -1.991 1.00 0.00 ATOM 299 N PRO 39 84.483 9.466 -2.890 1.00 0.00 ATOM 300 CA PRO 39 83.115 9.728 -2.558 1.00 0.00 ATOM 301 CB PRO 39 82.548 10.328 -3.886 1.00 0.00 ATOM 302 CG PRO 39 83.641 11.033 -4.446 1.00 0.00 ATOM 303 CD PRO 39 84.777 10.013 -4.244 1.00 0.00 ATOM 304 O PRO 39 81.577 8.607 -1.054 1.00 0.00 ATOM 305 C PRO 39 82.308 8.511 -2.084 1.00 0.00 ATOM 306 N LEU 40 82.449 7.379 -2.790 1.00 0.00 ATOM 307 CA LEU 40 81.765 6.152 -2.359 1.00 0.00 ATOM 308 CB LEU 40 81.905 5.014 -3.389 1.00 0.00 ATOM 309 CG LEU 40 80.663 4.179 -3.757 1.00 0.00 ATOM 310 CD1 LEU 40 80.238 3.361 -2.596 1.00 0.00 ATOM 311 CD2 LEU 40 79.478 4.996 -4.229 1.00 0.00 ATOM 312 O LEU 40 81.530 5.134 -0.207 1.00 0.00 ATOM 313 C LEU 40 82.313 5.632 -0.998 1.00 0.00 ATOM 314 N ARG 41 83.621 5.718 -0.782 1.00 0.00 ATOM 315 CA ARG 41 84.236 5.285 0.503 1.00 0.00 ATOM 316 CB ARG 41 85.759 5.293 0.460 1.00 0.00 ATOM 317 CG ARG 41 86.429 4.420 -0.599 1.00 0.00 ATOM 318 CD ARG 41 85.809 3.029 -0.685 1.00 0.00 ATOM 319 NE ARG 41 86.630 2.111 -1.454 1.00 0.00 ATOM 320 CZ ARG 41 86.480 1.919 -2.787 1.00 0.00 ATOM 321 NH1 ARG 41 87.224 1.011 -3.427 1.00 0.00 ATOM 322 NH2 ARG 41 85.540 2.593 -3.428 1.00 0.00 ATOM 323 O ARG 41 83.465 5.646 2.763 1.00 0.00 ATOM 324 C ARG 41 83.720 6.162 1.655 1.00 0.00 ATOM 325 N LEU 42 83.557 7.462 1.405 1.00 0.00 ATOM 326 CA LEU 42 82.945 8.358 2.370 1.00 0.00 ATOM 327 CB LEU 42 83.059 9.842 1.984 1.00 0.00 ATOM 328 CG LEU 42 84.473 10.407 2.131 1.00 0.00 ATOM 329 CD1 LEU 42 84.574 11.720 1.326 1.00 0.00 ATOM 330 CD2 LEU 42 84.805 10.608 3.641 1.00 0.00 ATOM 331 O LEU 42 81.121 8.124 3.878 1.00 0.00 ATOM 332 C LEU 42 81.498 8.035 2.698 1.00 0.00 ATOM 333 N ASN 43 80.684 7.656 1.695 1.00 0.00 ATOM 334 CA ASN 43 79.275 7.370 1.970 1.00 0.00 ATOM 335 CB ASN 43 78.474 6.881 0.746 1.00 0.00 ATOM 336 CG ASN 43 78.414 7.907 -0.416 1.00 0.00 ATOM 337 ND2 ASN 43 78.531 7.387 -1.628 1.00 0.00 ATOM 338 OD1 ASN 43 78.213 9.145 -0.214 1.00 0.00 ATOM 339 O ASN 43 78.224 6.280 3.839 1.00 0.00 ATOM 340 C ASN 43 79.143 6.270 3.016 1.00 0.00 ATOM 341 N TYR 44 79.968 5.249 2.851 1.00 0.00 ATOM 342 CA TYR 44 79.971 4.098 3.744 1.00 0.00 ATOM 343 CB TYR 44 80.903 3.042 3.192 1.00 0.00 ATOM 344 CG TYR 44 80.715 1.626 3.718 1.00 0.00 ATOM 345 CD1 TYR 44 79.813 1.305 4.760 1.00 0.00 ATOM 346 CD2 TYR 44 81.512 0.634 3.228 1.00 0.00 ATOM 347 CE1 TYR 44 79.727 -0.051 5.248 1.00 0.00 ATOM 348 CE2 TYR 44 81.447 -0.685 3.666 1.00 0.00 ATOM 349 CZ TYR 44 80.555 -1.007 4.694 1.00 0.00 ATOM 350 OH TYR 44 80.564 -2.302 5.063 1.00 0.00 ATOM 351 O TYR 44 79.857 4.088 6.151 1.00 0.00 ATOM 352 C TYR 44 80.444 4.498 5.175 1.00 0.00 ATOM 353 N ILE 45 81.547 5.236 5.269 1.00 0.00 ATOM 354 CA ILE 45 81.969 5.803 6.563 1.00 0.00 ATOM 355 CB ILE 45 83.172 6.728 6.439 1.00 0.00 ATOM 356 CG1 ILE 45 84.404 5.980 5.940 1.00 0.00 ATOM 357 CG2 ILE 45 83.432 7.535 7.824 1.00 0.00 ATOM 358 CD1 ILE 45 85.158 5.018 6.986 1.00 0.00 ATOM 359 O ILE 45 80.631 6.268 8.458 1.00 0.00 ATOM 360 C ILE 45 80.850 6.519 7.263 1.00 0.00 ATOM 361 N HIS 46 80.139 7.423 6.571 1.00 0.00 ATOM 362 CA HIS 46 78.995 8.080 7.182 1.00 0.00 ATOM 363 CB HIS 46 78.486 9.294 6.382 1.00 0.00 ATOM 364 CG HIS 46 79.544 10.315 6.159 1.00 0.00 ATOM 365 CD2 HIS 46 80.522 10.767 6.982 1.00 0.00 ATOM 366 ND1 HIS 46 79.785 10.882 4.924 1.00 0.00 ATOM 367 CE1 HIS 46 80.819 11.698 5.026 1.00 0.00 ATOM 368 NE2 HIS 46 81.285 11.639 6.262 1.00 0.00 ATOM 369 O HIS 46 77.186 7.363 8.558 1.00 0.00 ATOM 370 C HIS 46 77.868 7.144 7.534 1.00 0.00 ATOM 371 N TRP 47 77.649 6.101 6.716 1.00 0.00 ATOM 372 CA TRP 47 76.578 5.150 7.076 1.00 0.00 ATOM 373 CB TRP 47 76.297 4.139 5.975 1.00 0.00 ATOM 374 CG TRP 47 74.968 3.400 6.199 1.00 0.00 ATOM 375 CD1 TRP 47 73.757 3.961 6.527 1.00 0.00 ATOM 376 CD2 TRP 47 74.733 1.989 6.119 1.00 0.00 ATOM 377 CE2 TRP 47 73.373 1.773 6.384 1.00 0.00 ATOM 378 CE3 TRP 47 75.533 0.890 5.801 1.00 0.00 ATOM 379 NE1 TRP 47 72.803 2.987 6.639 1.00 0.00 ATOM 380 CZ2 TRP 47 72.800 0.511 6.337 1.00 0.00 ATOM 381 CZ3 TRP 47 74.973 -0.356 5.792 1.00 0.00 ATOM 382 CH2 TRP 47 73.622 -0.541 6.042 1.00 0.00 ATOM 383 O TRP 47 76.030 4.147 9.204 1.00 0.00 ATOM 384 C TRP 47 76.923 4.390 8.403 1.00 0.00 ATOM 385 N VAL 48 78.198 4.037 8.578 1.00 0.00 ATOM 386 CA VAL 48 78.741 3.468 9.835 1.00 0.00 ATOM 387 CB VAL 48 80.211 3.037 9.680 1.00 0.00 ATOM 388 CG1 VAL 48 80.821 2.552 11.035 1.00 0.00 ATOM 389 CG2 VAL 48 80.362 1.916 8.577 1.00 0.00 ATOM 390 O VAL 48 78.017 4.019 12.081 1.00 0.00 ATOM 391 C VAL 48 78.499 4.452 11.023 1.00 0.00 ATOM 392 N GLU 49 78.789 5.745 10.837 1.00 0.00 ATOM 393 CA GLU 49 78.435 6.774 11.808 1.00 0.00 ATOM 394 CB GLU 49 78.663 8.176 11.270 1.00 0.00 ATOM 395 CG GLU 49 80.126 8.580 11.085 1.00 0.00 ATOM 396 CD GLU 49 80.290 9.870 10.299 1.00 0.00 ATOM 397 OE1 GLU 49 79.340 10.698 10.317 1.00 0.00 ATOM 398 OE2 GLU 49 81.374 10.051 9.692 1.00 0.00 ATOM 399 O GLU 49 76.731 6.606 13.474 1.00 0.00 ATOM 400 C GLU 49 76.982 6.649 12.271 1.00 0.00 ATOM 401 N ASP 50 76.049 6.612 11.315 1.00 0.00 ATOM 402 CA ASP 50 74.599 6.465 11.595 1.00 0.00 ATOM 403 CB ASP 50 73.766 6.539 10.302 1.00 0.00 ATOM 404 CG ASP 50 73.901 7.900 9.583 1.00 0.00 ATOM 405 OD1 ASP 50 74.352 8.886 10.231 1.00 0.00 ATOM 406 OD2 ASP 50 73.554 7.972 8.377 1.00 0.00 ATOM 407 O ASP 50 73.484 5.183 13.304 1.00 0.00 ATOM 408 C ASP 50 74.279 5.178 12.340 1.00 0.00 ATOM 409 N LEU 51 74.927 4.096 11.932 1.00 0.00 ATOM 410 CA LEU 51 74.714 2.815 12.565 1.00 0.00 ATOM 411 CB LEU 51 75.394 1.698 11.759 1.00 0.00 ATOM 412 CG LEU 51 74.745 1.353 10.410 1.00 0.00 ATOM 413 CD1 LEU 51 75.639 0.355 9.662 1.00 0.00 ATOM 414 CD2 LEU 51 73.331 0.795 10.629 1.00 0.00 ATOM 415 O LEU 51 74.499 2.198 14.887 1.00 0.00 ATOM 416 C LEU 51 75.192 2.759 14.055 1.00 0.00 ATOM 417 N ILE 52 76.363 3.315 14.351 1.00 0.00 ATOM 418 CA ILE 52 76.963 3.161 15.673 1.00 0.00 ATOM 419 CB ILE 52 78.497 3.043 15.640 1.00 0.00 ATOM 420 CG1 ILE 52 79.164 4.393 15.354 1.00 0.00 ATOM 421 CG2 ILE 52 78.902 1.886 14.685 1.00 0.00 ATOM 422 CD1 ILE 52 80.709 4.348 15.427 1.00 0.00 ATOM 423 O ILE 52 76.758 4.013 17.889 1.00 0.00 ATOM 424 C ILE 52 76.498 4.184 16.691 1.00 0.00 ATOM 425 N GLY 53 75.819 5.232 16.234 1.00 0.00 ATOM 426 CA GLY 53 75.123 6.157 17.129 1.00 0.00 ATOM 427 O GLY 53 77.169 7.299 17.586 1.00 0.00 ATOM 428 C GLY 53 75.959 7.388 17.462 1.00 0.00 ATOM 429 N HIS 54 75.293 8.533 17.596 1.00 0.00 ATOM 430 CA HIS 54 75.893 9.762 18.143 1.00 0.00 ATOM 431 CB HIS 54 74.981 10.949 17.859 1.00 0.00 ATOM 432 CG HIS 54 75.456 12.225 18.489 1.00 0.00 ATOM 433 CD2 HIS 54 76.586 12.946 18.284 1.00 0.00 ATOM 434 ND1 HIS 54 74.785 12.843 19.533 1.00 0.00 ATOM 435 CE1 HIS 54 75.457 13.925 19.900 1.00 0.00 ATOM 436 NE2 HIS 54 76.554 14.010 19.159 1.00 0.00 ATOM 437 O HIS 54 75.144 9.166 20.384 1.00 0.00 ATOM 438 C HIS 54 76.065 9.634 19.685 1.00 0.00 ATOM 439 N GLN 55 77.207 10.064 20.209 1.00 0.00 ATOM 440 CA GLN 55 77.430 10.053 21.697 1.00 0.00 ATOM 441 CB GLN 55 78.780 9.411 22.052 1.00 0.00 ATOM 442 CG GLN 55 78.844 7.944 21.711 1.00 0.00 ATOM 443 CD GLN 55 80.209 7.325 21.867 1.00 0.00 ATOM 444 OE1 GLN 55 81.251 7.944 21.609 1.00 0.00 ATOM 445 NE2 GLN 55 80.219 6.114 22.308 1.00 0.00 ATOM 446 O GLN 55 78.010 12.369 21.776 1.00 0.00 ATOM 447 C GLN 55 77.371 11.465 22.279 1.00 0.00 ATOM 448 N ASP 56 76.607 11.660 23.348 1.00 0.00 ATOM 449 CA ASP 56 76.783 12.862 24.160 1.00 0.00 ATOM 450 CB ASP 56 75.692 12.953 25.220 1.00 0.00 ATOM 451 CG ASP 56 74.296 13.187 24.582 1.00 0.00 ATOM 452 OD1 ASP 56 74.237 13.944 23.556 1.00 0.00 ATOM 453 OD2 ASP 56 73.282 12.594 25.060 1.00 0.00 ATOM 454 O ASP 56 78.941 11.949 24.806 1.00 0.00 ATOM 455 C ASP 56 78.225 12.953 24.692 1.00 0.00 ATOM 456 N SER 57 78.666 14.186 24.877 1.00 0.00 ATOM 457 CA SER 57 80.012 14.516 25.311 1.00 0.00 ATOM 458 CB SER 57 80.059 16.029 25.539 1.00 0.00 ATOM 459 OG SER 57 81.364 16.432 25.888 1.00 0.00 ATOM 460 O SER 57 81.583 13.368 26.740 1.00 0.00 ATOM 461 C SER 57 80.431 13.774 26.602 1.00 0.00 ATOM 462 N ASP 58 79.485 13.591 27.525 1.00 0.00 ATOM 463 CA ASP 58 79.770 12.860 28.789 1.00 0.00 ATOM 464 CB ASP 58 78.745 13.194 29.883 1.00 0.00 ATOM 465 CG ASP 58 77.309 12.916 29.459 1.00 0.00 ATOM 466 OD1 ASP 58 77.013 12.886 28.242 1.00 0.00 ATOM 467 OD2 ASP 58 76.450 12.731 30.337 1.00 0.00 ATOM 468 O ASP 58 80.326 10.656 29.553 1.00 0.00 ATOM 469 C ASP 58 79.886 11.343 28.620 1.00 0.00 ATOM 470 N LYS 59 79.476 10.798 27.462 1.00 0.00 ATOM 471 CA LYS 59 79.686 9.363 27.206 1.00 0.00 ATOM 472 CB LYS 59 78.386 8.565 27.316 1.00 0.00 ATOM 473 CG LYS 59 77.206 9.213 26.641 1.00 0.00 ATOM 474 CD LYS 59 76.096 8.232 26.471 1.00 0.00 ATOM 475 CE LYS 59 75.401 8.452 25.148 1.00 0.00 ATOM 476 NZ LYS 59 75.052 7.125 24.559 1.00 0.00 ATOM 477 O LYS 59 80.371 7.961 25.355 1.00 0.00 ATOM 478 C LYS 59 80.437 9.070 25.906 1.00 0.00 ATOM 479 N SER 60 81.167 10.074 25.441 1.00 0.00 ATOM 480 CA SER 60 82.130 9.916 24.360 1.00 0.00 ATOM 481 CB SER 60 82.868 11.243 24.132 1.00 0.00 ATOM 482 OG SER 60 83.336 11.341 22.785 1.00 0.00 ATOM 483 O SER 60 83.658 8.644 25.825 1.00 0.00 ATOM 484 C SER 60 83.128 8.772 24.678 1.00 0.00 ATOM 485 N THR 61 83.342 7.901 23.696 1.00 0.00 ATOM 486 CA THR 61 84.303 6.813 23.853 1.00 0.00 ATOM 487 CB THR 61 83.622 5.403 24.070 1.00 0.00 ATOM 488 CG2 THR 61 82.790 5.348 25.353 1.00 0.00 ATOM 489 OG1 THR 61 82.774 5.058 22.960 1.00 0.00 ATOM 490 O THR 61 84.799 7.321 21.555 1.00 0.00 ATOM 491 C THR 61 85.154 6.732 22.586 1.00 0.00 ATOM 492 N LEU 62 86.242 5.985 22.658 1.00 0.00 ATOM 493 CA LEU 62 86.988 5.676 21.459 1.00 0.00 ATOM 494 CB LEU 62 88.364 5.092 21.817 1.00 0.00 ATOM 495 CG LEU 62 89.207 4.576 20.644 1.00 0.00 ATOM 496 CD1 LEU 62 89.736 5.771 19.816 1.00 0.00 ATOM 497 CD2 LEU 62 90.336 3.701 21.167 1.00 0.00 ATOM 498 O LEU 62 85.913 3.548 21.167 1.00 0.00 ATOM 499 C LEU 62 86.153 4.644 20.676 1.00 0.00 ATOM 500 N ARG 63 85.669 4.999 19.482 1.00 0.00 ATOM 501 CA ARG 63 84.939 3.983 18.667 1.00 0.00 ATOM 502 CB ARG 63 83.971 4.620 17.688 1.00 0.00 ATOM 503 CG ARG 63 83.137 5.675 18.361 1.00 0.00 ATOM 504 CD ARG 63 82.152 5.025 19.433 1.00 0.00 ATOM 505 NE ARG 63 80.888 5.651 19.202 1.00 0.00 ATOM 506 CZ ARG 63 79.745 5.043 19.019 1.00 0.00 ATOM 507 NH1 ARG 63 79.612 3.738 19.143 1.00 0.00 ATOM 508 NH2 ARG 63 78.713 5.790 18.758 1.00 0.00 ATOM 509 O ARG 63 87.048 3.435 17.735 1.00 0.00 ATOM 510 C ARG 63 85.938 3.035 18.025 1.00 0.00 ATOM 511 N ARG 64 85.583 1.763 17.891 1.00 0.00 ATOM 512 CA ARG 64 86.541 0.743 17.463 1.00 0.00 ATOM 513 CB ARG 64 86.975 -0.231 18.582 1.00 0.00 ATOM 514 CG ARG 64 87.828 0.413 19.705 1.00 0.00 ATOM 515 CD ARG 64 88.187 -0.603 20.806 1.00 0.00 ATOM 516 NE ARG 64 88.758 0.083 21.999 1.00 0.00 ATOM 517 CZ ARG 64 88.027 0.607 23.000 1.00 0.00 ATOM 518 NH1 ARG 64 86.693 0.566 22.965 1.00 0.00 ATOM 519 NH2 ARG 64 88.628 1.202 24.041 1.00 0.00 ATOM 520 O ARG 64 84.803 -0.586 16.488 1.00 0.00 ATOM 521 C ARG 64 85.890 -0.103 16.347 1.00 0.00 ATOM 522 N GLY 65 86.606 -0.304 15.248 1.00 0.00 ATOM 523 CA GLY 65 86.028 -1.059 14.150 1.00 0.00 ATOM 524 O GLY 65 88.207 -1.825 13.752 1.00 0.00 ATOM 525 C GLY 65 87.037 -1.949 13.499 1.00 0.00 ATOM 526 N ILE 66 86.560 -2.817 12.602 1.00 0.00 ATOM 527 CA ILE 66 87.397 -3.809 11.979 1.00 0.00 ATOM 528 CB ILE 66 87.020 -5.255 12.388 1.00 0.00 ATOM 529 CG1 ILE 66 87.220 -5.529 13.919 1.00 0.00 ATOM 530 CG2 ILE 66 87.825 -6.322 11.578 1.00 0.00 ATOM 531 CD1 ILE 66 86.400 -6.723 14.351 1.00 0.00 ATOM 532 O ILE 66 85.944 -3.510 10.003 1.00 0.00 ATOM 533 C ILE 66 87.095 -3.578 10.435 1.00 0.00 ATOM 534 N ASP 67 88.142 -3.380 9.657 1.00 0.00 ATOM 535 CA ASP 67 87.935 -3.284 8.180 1.00 0.00 ATOM 536 CB ASP 67 88.641 -2.057 7.642 1.00 0.00 ATOM 537 CG ASP 67 88.548 -1.942 6.076 1.00 0.00 ATOM 538 OD1 ASP 67 87.615 -2.509 5.486 1.00 0.00 ATOM 539 OD2 ASP 67 89.362 -1.213 5.517 1.00 0.00 ATOM 540 O ASP 67 89.708 -4.697 7.639 1.00 0.00 ATOM 541 C ASP 67 88.530 -4.544 7.605 1.00 0.00 ATOM 542 N ILE 68 87.681 -5.454 7.143 1.00 0.00 ATOM 543 CA ILE 68 88.101 -6.709 6.485 1.00 0.00 ATOM 544 CB ILE 68 86.889 -7.709 6.411 1.00 0.00 ATOM 545 CG1 ILE 68 86.262 -7.943 7.826 1.00 0.00 ATOM 546 CG2 ILE 68 87.286 -9.053 5.696 1.00 0.00 ATOM 547 CD1 ILE 68 84.743 -8.364 7.731 1.00 0.00 ATOM 548 O ILE 68 87.704 -6.002 4.214 1.00 0.00 ATOM 549 C ILE 68 88.535 -6.420 5.007 1.00 0.00 ATOM 550 N GLY 69 89.810 -6.624 4.697 1.00 0.00 ATOM 551 CA GLY 69 90.289 -6.520 3.307 1.00 0.00 ATOM 552 O GLY 69 89.841 -4.435 2.285 1.00 0.00 ATOM 553 C GLY 69 90.550 -5.060 3.051 1.00 0.00 ATOM 554 N THR 70 91.538 -4.541 3.756 1.00 0.00 ATOM 555 CA THR 70 91.765 -3.114 3.854 1.00 0.00 ATOM 556 CB THR 70 92.604 -2.691 5.120 1.00 0.00 ATOM 557 CG2 THR 70 94.182 -2.742 4.853 1.00 0.00 ATOM 558 OG1 THR 70 92.259 -1.327 5.407 1.00 0.00 ATOM 559 O THR 70 92.161 -1.276 2.377 1.00 0.00 ATOM 560 C THR 70 92.375 -2.459 2.591 1.00 0.00 ATOM 561 N GLY 71 93.082 -3.237 1.754 1.00 0.00 ATOM 562 CA GLY 71 93.549 -2.729 0.437 1.00 0.00 ATOM 563 O GLY 71 95.407 -1.894 1.731 1.00 0.00 ATOM 564 C GLY 71 94.901 -2.073 0.598 1.00 0.00 ATOM 565 N ALA 72 95.527 -1.727 -0.520 1.00 0.00 ATOM 566 CA ALA 72 96.790 -1.047 -0.502 1.00 0.00 ATOM 567 CB ALA 72 97.459 -0.982 -1.938 1.00 0.00 ATOM 568 O ALA 72 97.552 0.854 0.689 1.00 0.00 ATOM 569 C ALA 72 96.631 0.357 0.068 1.00 0.00 ATOM 570 N SER 73 95.492 0.973 -0.195 1.00 0.00 ATOM 571 CA SER 73 95.165 2.346 0.204 1.00 0.00 ATOM 572 CB SER 73 93.939 2.801 -0.568 1.00 0.00 ATOM 573 OG SER 73 92.704 2.174 -0.122 1.00 0.00 ATOM 574 O SER 73 95.074 3.576 2.313 1.00 0.00 ATOM 575 C SER 73 94.916 2.480 1.758 1.00 0.00 ATOM 576 N CYS 74 94.483 1.370 2.357 1.00 0.00 ATOM 577 CA CYS 74 93.909 1.295 3.729 1.00 0.00 ATOM 578 CB CYS 74 95.049 1.469 4.750 1.00 0.00 ATOM 579 SG CYS 74 94.661 1.034 6.514 1.00 0.00 ATOM 580 O CYS 74 92.842 3.106 4.891 1.00 0.00 ATOM 581 C CYS 74 92.884 2.400 3.869 1.00 0.00 ATOM 582 N ILE 75 92.056 2.581 2.826 1.00 0.00 ATOM 583 CA ILE 75 91.222 3.726 2.727 1.00 0.00 ATOM 584 CB ILE 75 90.519 3.908 1.348 1.00 0.00 ATOM 585 CG1 ILE 75 89.783 5.272 1.341 1.00 0.00 ATOM 586 CG2 ILE 75 89.483 2.792 1.083 1.00 0.00 ATOM 587 CD1 ILE 75 90.652 6.541 1.239 1.00 0.00 ATOM 588 O ILE 75 89.994 5.075 4.309 1.00 0.00 ATOM 589 C ILE 75 90.167 3.941 3.851 1.00 0.00 ATOM 590 N TYR 76 89.435 2.898 4.209 1.00 0.00 ATOM 591 CA TYR 76 88.420 3.123 5.199 1.00 0.00 ATOM 592 CB TYR 76 87.392 1.998 5.347 1.00 0.00 ATOM 593 CG TYR 76 86.517 1.651 4.135 1.00 0.00 ATOM 594 CD1 TYR 76 85.590 2.564 3.625 1.00 0.00 ATOM 595 CD2 TYR 76 86.506 0.352 3.621 1.00 0.00 ATOM 596 CE1 TYR 76 84.716 2.186 2.627 1.00 0.00 ATOM 597 CE2 TYR 76 85.662 -0.019 2.550 1.00 0.00 ATOM 598 CZ TYR 76 84.794 0.927 2.067 1.00 0.00 ATOM 599 OH TYR 76 83.952 0.584 1.055 1.00 0.00 ATOM 600 O TYR 76 88.579 4.459 7.161 1.00 0.00 ATOM 601 C TYR 76 89.045 3.500 6.576 1.00 0.00 ATOM 602 N PRO 77 90.044 2.763 7.076 1.00 0.00 ATOM 603 CA PRO 77 90.626 3.289 8.349 1.00 0.00 ATOM 604 CB PRO 77 91.687 2.247 8.719 1.00 0.00 ATOM 605 CG PRO 77 91.181 0.923 8.012 1.00 0.00 ATOM 606 CD PRO 77 90.666 1.489 6.690 1.00 0.00 ATOM 607 O PRO 77 91.027 5.440 9.171 1.00 0.00 ATOM 608 C PRO 77 91.237 4.679 8.266 1.00 0.00 ATOM 609 N LEU 78 91.992 5.015 7.208 1.00 0.00 ATOM 610 CA LEU 78 92.505 6.375 7.041 1.00 0.00 ATOM 611 CB LEU 78 93.377 6.571 5.771 1.00 0.00 ATOM 612 CG LEU 78 94.657 5.751 5.624 1.00 0.00 ATOM 613 CD1 LEU 78 95.278 6.107 4.240 1.00 0.00 ATOM 614 CD2 LEU 78 95.686 6.066 6.693 1.00 0.00 ATOM 615 O LEU 78 91.645 8.459 7.830 1.00 0.00 ATOM 616 C LEU 78 91.443 7.445 7.118 1.00 0.00 ATOM 617 N LEU 79 90.326 7.246 6.425 1.00 0.00 ATOM 618 CA LEU 79 89.204 8.139 6.495 1.00 0.00 ATOM 619 CB LEU 79 88.156 7.811 5.419 1.00 0.00 ATOM 620 CG LEU 79 88.526 8.030 3.900 1.00 0.00 ATOM 621 CD1 LEU 79 87.281 7.693 3.066 1.00 0.00 ATOM 622 CD2 LEU 79 88.960 9.445 3.614 1.00 0.00 ATOM 623 O LEU 79 88.237 9.143 8.457 1.00 0.00 ATOM 624 C LEU 79 88.513 8.104 7.908 1.00 0.00 ATOM 625 N GLY 80 88.185 6.923 8.406 1.00 0.00 ATOM 626 CA GLY 80 87.500 6.760 9.734 1.00 0.00 ATOM 627 O GLY 80 87.792 8.194 11.638 1.00 0.00 ATOM 628 C GLY 80 88.320 7.426 10.841 1.00 0.00 ATOM 629 N ALA 81 89.615 7.138 10.852 1.00 0.00 ATOM 630 CA ALA 81 90.538 7.626 11.867 1.00 0.00 ATOM 631 CB ALA 81 91.843 6.826 11.817 1.00 0.00 ATOM 632 O ALA 81 90.907 9.897 12.725 1.00 0.00 ATOM 633 C ALA 81 90.782 9.144 11.723 1.00 0.00 ATOM 634 N THR 82 90.802 9.634 10.485 1.00 0.00 ATOM 635 CA THR 82 91.055 11.041 10.237 1.00 0.00 ATOM 636 CB THR 82 91.606 11.318 8.779 1.00 0.00 ATOM 637 CG2 THR 82 91.846 12.810 8.528 1.00 0.00 ATOM 638 OG1 THR 82 92.831 10.611 8.603 1.00 0.00 ATOM 639 O THR 82 89.929 12.916 11.148 1.00 0.00 ATOM 640 C THR 82 89.842 11.871 10.497 1.00 0.00 ATOM 641 N LEU 83 88.689 11.433 10.009 1.00 0.00 ATOM 642 CA LEU 83 87.514 12.270 10.159 1.00 0.00 ATOM 643 CB LEU 83 86.386 11.906 9.199 1.00 0.00 ATOM 644 CG LEU 83 86.654 12.013 7.669 1.00 0.00 ATOM 645 CD1 LEU 83 85.357 11.938 6.859 1.00 0.00 ATOM 646 CD2 LEU 83 87.432 13.223 7.341 1.00 0.00 ATOM 647 O LEU 83 86.582 13.185 12.163 1.00 0.00 ATOM 648 C LEU 83 87.004 12.181 11.608 1.00 0.00 ATOM 649 N ASN 84 87.008 10.974 12.179 1.00 0.00 ATOM 650 CA ASN 84 86.162 10.695 13.336 1.00 0.00 ATOM 651 CB ASN 84 85.094 9.634 13.023 1.00 0.00 ATOM 652 CG ASN 84 84.131 10.060 11.890 1.00 0.00 ATOM 653 ND2 ASN 84 83.674 9.094 11.107 1.00 0.00 ATOM 654 OD1 ASN 84 83.812 11.243 11.735 1.00 0.00 ATOM 655 O ASN 84 86.384 10.166 15.639 1.00 0.00 ATOM 656 C ASN 84 86.962 10.299 14.568 1.00 0.00 ATOM 657 N GLY 85 88.263 10.111 14.411 1.00 0.00 ATOM 658 CA GLY 85 89.139 9.579 15.451 1.00 0.00 ATOM 659 O GLY 85 89.049 7.764 16.961 1.00 0.00 ATOM 660 C GLY 85 88.818 8.132 15.839 1.00 0.00 ATOM 661 N TRP 86 88.260 7.331 14.906 1.00 0.00 ATOM 662 CA TRP 86 88.052 5.907 15.122 1.00 0.00 ATOM 663 CB TRP 86 87.099 5.315 14.077 1.00 0.00 ATOM 664 CG TRP 86 85.726 5.864 14.089 1.00 0.00 ATOM 665 CD1 TRP 86 85.143 6.618 15.081 1.00 0.00 ATOM 666 CD2 TRP 86 84.730 5.699 13.061 1.00 0.00 ATOM 667 CE2 TRP 86 83.572 6.373 13.503 1.00 0.00 ATOM 668 CE3 TRP 86 84.723 5.063 11.784 1.00 0.00 ATOM 669 NE1 TRP 86 83.854 6.926 14.744 1.00 0.00 ATOM 670 CZ2 TRP 86 82.402 6.414 12.751 1.00 0.00 ATOM 671 CZ3 TRP 86 83.556 5.088 11.035 1.00 0.00 ATOM 672 CH2 TRP 86 82.402 5.756 11.511 1.00 0.00 ATOM 673 O TRP 86 90.256 5.445 14.313 1.00 0.00 ATOM 674 C TRP 86 89.373 5.140 15.104 1.00 0.00 ATOM 675 N TYR 87 89.484 4.175 16.012 1.00 0.00 ATOM 676 CA TYR 87 90.406 3.053 15.970 1.00 0.00 ATOM 677 CB TYR 87 90.560 2.440 17.397 1.00 0.00 ATOM 678 CG TYR 87 91.468 1.242 17.465 1.00 0.00 ATOM 679 CD1 TYR 87 92.843 1.400 17.660 1.00 0.00 ATOM 680 CD2 TYR 87 90.951 -0.049 17.350 1.00 0.00 ATOM 681 CE1 TYR 87 93.679 0.327 17.700 1.00 0.00 ATOM 682 CE2 TYR 87 91.784 -1.146 17.409 1.00 0.00 ATOM 683 CZ TYR 87 93.152 -0.936 17.571 1.00 0.00 ATOM 684 OH TYR 87 94.002 -2.019 17.615 1.00 0.00 ATOM 685 O TYR 87 88.762 1.508 15.045 1.00 0.00 ATOM 686 C TYR 87 89.912 1.893 15.019 1.00 0.00 ATOM 687 N PHE 88 90.848 1.285 14.337 1.00 0.00 ATOM 688 CA PHE 88 90.607 0.162 13.416 1.00 0.00 ATOM 689 CB PHE 88 90.751 0.668 11.947 1.00 0.00 ATOM 690 CG PHE 88 89.563 1.422 11.432 1.00 0.00 ATOM 691 CD1 PHE 88 88.574 0.754 10.684 1.00 0.00 ATOM 692 CD2 PHE 88 89.427 2.804 11.643 1.00 0.00 ATOM 693 CE1 PHE 88 87.457 1.501 10.168 1.00 0.00 ATOM 694 CE2 PHE 88 88.325 3.515 11.141 1.00 0.00 ATOM 695 CZ PHE 88 87.339 2.866 10.416 1.00 0.00 ATOM 696 O PHE 88 92.805 -0.763 13.649 1.00 0.00 ATOM 697 C PHE 88 91.588 -0.965 13.604 1.00 0.00 ATOM 698 N LEU 89 91.062 -2.181 13.670 1.00 0.00 ATOM 699 CA LEU 89 91.861 -3.349 13.271 1.00 0.00 ATOM 700 CB LEU 89 91.352 -4.610 13.955 1.00 0.00 ATOM 701 CG LEU 89 92.158 -5.883 13.685 1.00 0.00 ATOM 702 CD1 LEU 89 93.650 -5.756 14.073 1.00 0.00 ATOM 703 CD2 LEU 89 91.495 -7.004 14.439 1.00 0.00 ATOM 704 O LEU 89 90.427 -3.410 11.366 1.00 0.00 ATOM 705 C LEU 89 91.577 -3.456 11.747 1.00 0.00 ATOM 706 N ALA 90 92.610 -3.479 10.917 1.00 0.00 ATOM 707 CA ALA 90 92.434 -3.515 9.425 1.00 0.00 ATOM 708 CB ALA 90 93.052 -2.241 8.734 1.00 0.00 ATOM 709 O ALA 90 94.296 -4.914 9.213 1.00 0.00 ATOM 710 C ALA 90 93.133 -4.768 8.972 1.00 0.00 ATOM 711 N THR 91 92.420 -5.720 8.353 1.00 0.00 ATOM 712 CA THR 91 93.064 -6.962 7.925 1.00 0.00 ATOM 713 CB THR 91 92.234 -8.191 8.320 1.00 0.00 ATOM 714 CG2 THR 91 91.982 -8.226 9.840 1.00 0.00 ATOM 715 OG1 THR 91 90.963 -8.122 7.701 1.00 0.00 ATOM 716 O THR 91 92.563 -6.369 5.663 1.00 0.00 ATOM 717 C THR 91 93.297 -7.014 6.411 1.00 0.00 ATOM 718 N GLU 92 94.319 -7.779 6.011 1.00 0.00 ATOM 719 CA GLU 92 94.632 -8.092 4.581 1.00 0.00 ATOM 720 CB GLU 92 95.728 -7.188 4.003 1.00 0.00 ATOM 721 CG GLU 92 95.270 -6.195 2.929 1.00 0.00 ATOM 722 CD GLU 92 94.438 -6.844 1.832 1.00 0.00 ATOM 723 OE1 GLU 92 93.501 -6.211 1.391 1.00 0.00 ATOM 724 OE2 GLU 92 94.702 -7.998 1.426 1.00 0.00 ATOM 725 O GLU 92 95.770 -9.970 5.491 1.00 0.00 ATOM 726 C GLU 92 95.153 -9.513 4.521 1.00 0.00 ATOM 727 N VAL 93 94.914 -10.193 3.389 1.00 0.00 ATOM 728 CA VAL 93 95.601 -11.443 3.067 1.00 0.00 ATOM 729 CB VAL 93 94.644 -12.567 2.594 1.00 0.00 ATOM 730 CG1 VAL 93 93.693 -12.939 3.696 1.00 0.00 ATOM 731 CG2 VAL 93 93.870 -12.192 1.277 1.00 0.00 ATOM 732 O VAL 93 97.620 -12.003 1.944 1.00 0.00 ATOM 733 C VAL 93 96.678 -11.225 2.016 1.00 0.00 ATOM 734 N ASP 94 96.556 -10.157 1.216 1.00 0.00 ATOM 735 CA ASP 94 97.505 -9.900 0.116 1.00 0.00 ATOM 736 CB ASP 94 96.811 -9.110 -0.992 1.00 0.00 ATOM 737 CG ASP 94 97.720 -8.868 -2.200 1.00 0.00 ATOM 738 OD1 ASP 94 98.052 -9.848 -2.903 1.00 0.00 ATOM 739 OD2 ASP 94 98.145 -7.711 -2.423 1.00 0.00 ATOM 740 O ASP 94 98.749 -8.151 1.213 1.00 0.00 ATOM 741 C ASP 94 98.798 -9.209 0.591 1.00 0.00 ATOM 742 N ASP 95 99.961 -9.796 0.322 1.00 0.00 ATOM 743 CA ASP 95 101.220 -9.202 0.786 1.00 0.00 ATOM 744 CB ASP 95 102.440 -10.004 0.328 1.00 0.00 ATOM 745 CG ASP 95 103.017 -10.863 1.422 1.00 0.00 ATOM 746 OD1 ASP 95 103.375 -10.308 2.503 1.00 0.00 ATOM 747 OD2 ASP 95 103.132 -12.109 1.170 1.00 0.00 ATOM 748 O ASP 95 101.902 -6.914 0.973 1.00 0.00 ATOM 749 C ASP 95 101.421 -7.787 0.263 1.00 0.00 ATOM 750 N MET 96 101.145 -7.571 -1.014 1.00 0.00 ATOM 751 CA MET 96 101.414 -6.239 -1.580 1.00 0.00 ATOM 752 CB MET 96 101.254 -6.224 -3.114 1.00 0.00 ATOM 753 CG MET 96 101.340 -4.854 -3.705 1.00 0.00 ATOM 754 SD MET 96 100.952 -4.801 -5.522 1.00 0.00 ATOM 755 CE MET 96 102.198 -5.912 -6.129 1.00 0.00 ATOM 756 O MET 96 100.884 -4.123 -0.619 1.00 0.00 ATOM 757 C MET 96 100.474 -5.218 -0.943 1.00 0.00 ATOM 758 N CYS 97 99.212 -5.566 -0.783 1.00 0.00 ATOM 759 CA CYS 97 98.288 -4.637 -0.153 1.00 0.00 ATOM 760 CB CYS 97 96.856 -5.171 -0.192 1.00 0.00 ATOM 761 SG CYS 97 95.969 -4.999 -1.833 1.00 0.00 ATOM 762 O CYS 97 98.639 -3.189 1.824 1.00 0.00 ATOM 763 C CYS 97 98.703 -4.331 1.354 1.00 0.00 ATOM 764 N PHE 98 99.082 -5.380 2.061 1.00 0.00 ATOM 765 CA PHE 98 99.535 -5.303 3.442 1.00 0.00 ATOM 766 CB PHE 98 99.937 -6.696 3.946 1.00 0.00 ATOM 767 CG PHE 98 100.540 -6.702 5.345 1.00 0.00 ATOM 768 CD1 PHE 98 99.772 -6.337 6.444 1.00 0.00 ATOM 769 CD2 PHE 98 101.869 -7.055 5.541 1.00 0.00 ATOM 770 CE1 PHE 98 100.314 -6.356 7.759 1.00 0.00 ATOM 771 CE2 PHE 98 102.421 -7.096 6.871 1.00 0.00 ATOM 772 CZ PHE 98 101.624 -6.736 7.958 1.00 0.00 ATOM 773 O PHE 98 100.593 -3.365 4.360 1.00 0.00 ATOM 774 C PHE 98 100.691 -4.315 3.572 1.00 0.00 ATOM 775 N ASN 99 101.728 -4.480 2.745 1.00 0.00 ATOM 776 CA ASN 99 102.900 -3.645 2.780 1.00 0.00 ATOM 777 CB ASN 99 103.962 -4.123 1.760 1.00 0.00 ATOM 778 CG ASN 99 104.641 -5.443 2.196 1.00 0.00 ATOM 779 ND2 ASN 99 104.894 -5.577 3.487 1.00 0.00 ATOM 780 OD1 ASN 99 104.913 -6.328 1.376 1.00 0.00 ATOM 781 O ASN 99 102.977 -1.345 3.294 1.00 0.00 ATOM 782 C ASN 99 102.539 -2.219 2.562 1.00 0.00 ATOM 783 N TYR 100 101.692 -1.976 1.560 1.00 0.00 ATOM 784 CA TYR 100 101.280 -0.653 1.212 1.00 0.00 ATOM 785 CB TYR 100 100.535 -0.673 -0.138 1.00 0.00 ATOM 786 CG TYR 100 101.456 -0.471 -1.330 1.00 0.00 ATOM 787 CD1 TYR 100 101.856 -1.542 -2.119 1.00 0.00 ATOM 788 CD2 TYR 100 101.917 0.800 -1.642 1.00 0.00 ATOM 789 CE1 TYR 100 102.710 -1.329 -3.239 1.00 0.00 ATOM 790 CE2 TYR 100 102.722 1.038 -2.727 1.00 0.00 ATOM 791 CZ TYR 100 103.118 -0.030 -3.531 1.00 0.00 ATOM 792 OH TYR 100 103.952 0.257 -4.564 1.00 0.00 ATOM 793 O TYR 100 100.595 1.187 2.592 1.00 0.00 ATOM 794 C TYR 100 100.400 0.012 2.287 1.00 0.00 ATOM 795 N ALA 101 99.445 -0.736 2.819 1.00 0.00 ATOM 796 CA ALA 101 98.568 -0.266 3.884 1.00 0.00 ATOM 797 CB ALA 101 97.532 -1.317 4.224 1.00 0.00 ATOM 798 O ALA 101 99.046 1.308 5.699 1.00 0.00 ATOM 799 C ALA 101 99.341 0.205 5.151 1.00 0.00 ATOM 800 N LYS 102 100.316 -0.617 5.574 1.00 0.00 ATOM 801 CA LYS 102 101.243 -0.311 6.690 1.00 0.00 ATOM 802 CB LYS 102 102.286 -1.423 6.857 1.00 0.00 ATOM 803 CG LYS 102 101.800 -2.571 7.735 1.00 0.00 ATOM 804 CD LYS 102 102.737 -3.780 7.725 1.00 0.00 ATOM 805 CE LYS 102 104.225 -3.467 7.889 1.00 0.00 ATOM 806 NZ LYS 102 105.069 -4.744 7.765 1.00 0.00 ATOM 807 O LYS 102 102.025 1.923 7.265 1.00 0.00 ATOM 808 C LYS 102 101.978 1.007 6.421 1.00 0.00 ATOM 809 N LYS 103 102.533 1.109 5.215 1.00 0.00 ATOM 810 CA LYS 103 103.264 2.290 4.819 1.00 0.00 ATOM 811 CB LYS 103 103.883 2.115 3.422 1.00 0.00 ATOM 812 CG LYS 103 104.971 3.118 3.112 1.00 0.00 ATOM 813 CD LYS 103 104.698 3.892 1.816 1.00 0.00 ATOM 814 CE LYS 103 105.903 4.748 1.411 1.00 0.00 ATOM 815 NZ LYS 103 105.576 5.767 0.348 1.00 0.00 ATOM 816 O LYS 103 102.773 4.596 5.291 1.00 0.00 ATOM 817 C LYS 103 102.347 3.508 4.825 1.00 0.00 ATOM 818 N ASN 104 101.123 3.365 4.270 1.00 0.00 ATOM 819 CA ASN 104 100.176 4.482 4.280 1.00 0.00 ATOM 820 CB ASN 104 98.973 4.223 3.376 1.00 0.00 ATOM 821 CG ASN 104 99.343 4.225 1.868 1.00 0.00 ATOM 822 ND2 ASN 104 100.268 5.030 1.507 1.00 0.00 ATOM 823 OD1 ASN 104 98.801 3.454 1.071 1.00 0.00 ATOM 824 O ASN 104 99.559 6.049 6.014 1.00 0.00 ATOM 825 C ASN 104 99.740 4.883 5.723 1.00 0.00 ATOM 826 N VAL 105 99.557 3.913 6.605 1.00 0.00 ATOM 827 CA VAL 105 99.272 4.280 8.045 1.00 0.00 ATOM 828 CB VAL 105 98.913 3.073 8.884 1.00 0.00 ATOM 829 CG1 VAL 105 98.842 3.464 10.469 1.00 0.00 ATOM 830 CG2 VAL 105 97.602 2.543 8.438 1.00 0.00 ATOM 831 O VAL 105 100.170 6.226 9.129 1.00 0.00 ATOM 832 C VAL 105 100.415 5.116 8.656 1.00 0.00 ATOM 833 N GLU 106 101.656 4.620 8.524 1.00 0.00 ATOM 834 CA GLU 106 102.834 5.240 9.094 1.00 0.00 ATOM 835 CB GLU 106 104.075 4.388 8.847 1.00 0.00 ATOM 836 CG GLU 106 104.057 3.113 9.649 1.00 0.00 ATOM 837 CD GLU 106 104.904 2.021 9.053 1.00 0.00 ATOM 838 OE1 GLU 106 105.546 2.270 7.991 1.00 0.00 ATOM 839 OE2 GLU 106 104.919 0.907 9.640 1.00 0.00 ATOM 840 O GLU 106 103.387 7.551 9.286 1.00 0.00 ATOM 841 C GLU 106 103.072 6.608 8.544 1.00 0.00 ATOM 842 N GLN 107 102.884 6.749 7.229 1.00 0.00 ATOM 843 CA GLN 107 103.226 7.993 6.595 1.00 0.00 ATOM 844 CB GLN 107 103.335 7.759 5.072 1.00 0.00 ATOM 845 CG GLN 107 102.267 8.380 4.208 1.00 0.00 ATOM 846 CD GLN 107 102.613 8.231 2.676 1.00 0.00 ATOM 847 OE1 GLN 107 102.212 7.264 2.027 1.00 0.00 ATOM 848 NE2 GLN 107 103.377 9.176 2.139 1.00 0.00 ATOM 849 O GLN 107 102.460 10.201 6.773 1.00 0.00 ATOM 850 C GLN 107 102.207 9.036 6.931 1.00 0.00 ATOM 851 N ASN 108 101.015 8.648 7.351 1.00 0.00 ATOM 852 CA ASN 108 100.086 9.673 7.811 1.00 0.00 ATOM 853 CB ASN 108 98.723 9.494 7.172 1.00 0.00 ATOM 854 CG ASN 108 98.812 9.653 5.673 1.00 0.00 ATOM 855 ND2 ASN 108 98.796 10.875 5.219 1.00 0.00 ATOM 856 OD1 ASN 108 98.969 8.664 4.946 1.00 0.00 ATOM 857 O ASN 108 99.051 10.336 9.882 1.00 0.00 ATOM 858 C ASN 108 99.994 9.777 9.345 1.00 0.00 ATOM 859 N ASN 109 100.995 9.193 9.982 1.00 0.00 ATOM 860 CA ASN 109 101.162 9.142 11.449 1.00 0.00 ATOM 861 CB ASN 109 101.538 10.537 11.987 1.00 0.00 ATOM 862 CG ASN 109 102.836 11.067 11.396 1.00 0.00 ATOM 863 ND2 ASN 109 103.888 10.285 11.469 1.00 0.00 ATOM 864 OD1 ASN 109 102.866 12.159 10.843 1.00 0.00 ATOM 865 O ASN 109 99.441 9.342 13.041 1.00 0.00 ATOM 866 C ASN 109 99.942 8.655 12.176 1.00 0.00 ATOM 867 N LEU 110 99.466 7.460 11.855 1.00 0.00 ATOM 868 CA LEU 110 98.207 7.003 12.404 1.00 0.00 ATOM 869 CB LEU 110 97.121 7.030 11.331 1.00 0.00 ATOM 870 CG LEU 110 96.485 8.388 11.096 1.00 0.00 ATOM 871 CD1 LEU 110 95.774 8.366 9.733 1.00 0.00 ATOM 872 CD2 LEU 110 95.526 8.799 12.267 1.00 0.00 ATOM 873 O LEU 110 97.375 4.957 13.177 1.00 0.00 ATOM 874 C LEU 110 98.334 5.632 12.987 1.00 0.00 ATOM 875 N SER 111 99.554 5.216 13.262 1.00 0.00 ATOM 876 CA SER 111 99.815 3.926 13.858 1.00 0.00 ATOM 877 CB SER 111 101.300 3.780 14.027 1.00 0.00 ATOM 878 OG SER 111 101.826 3.777 12.719 1.00 0.00 ATOM 879 O SER 111 98.855 2.578 15.560 1.00 0.00 ATOM 880 C SER 111 99.141 3.703 15.215 1.00 0.00 ATOM 881 N ASP 112 98.844 4.783 15.933 1.00 0.00 ATOM 882 CA ASP 112 98.075 4.686 17.202 1.00 0.00 ATOM 883 CB ASP 112 98.232 6.003 17.999 1.00 0.00 ATOM 884 CG ASP 112 99.671 6.205 18.500 1.00 0.00 ATOM 885 OD1 ASP 112 100.382 5.184 18.664 1.00 0.00 ATOM 886 OD2 ASP 112 100.088 7.365 18.719 1.00 0.00 ATOM 887 O ASP 112 95.929 3.763 17.872 1.00 0.00 ATOM 888 C ASP 112 96.591 4.351 16.985 1.00 0.00 ATOM 889 N LEU 113 96.056 4.724 15.818 1.00 0.00 ATOM 890 CA LEU 113 94.645 4.482 15.593 1.00 0.00 ATOM 891 CB LEU 113 93.931 5.761 15.153 1.00 0.00 ATOM 892 CG LEU 113 93.653 6.914 16.153 1.00 0.00 ATOM 893 CD1 LEU 113 92.879 8.038 15.512 1.00 0.00 ATOM 894 CD2 LEU 113 92.906 6.427 17.367 1.00 0.00 ATOM 895 O LEU 113 93.298 2.812 14.599 1.00 0.00 ATOM 896 C LEU 113 94.384 3.306 14.651 1.00 0.00 ATOM 897 N ILE 114 95.406 2.815 13.953 1.00 0.00 ATOM 898 CA ILE 114 95.161 1.739 13.006 1.00 0.00 ATOM 899 CB ILE 114 95.159 2.264 11.498 1.00 0.00 ATOM 900 CG1 ILE 114 94.254 3.469 11.339 1.00 0.00 ATOM 901 CG2 ILE 114 94.847 1.082 10.542 1.00 0.00 ATOM 902 CD1 ILE 114 94.488 4.260 9.979 1.00 0.00 ATOM 903 O ILE 114 97.367 0.888 12.971 1.00 0.00 ATOM 904 C ILE 114 96.164 0.667 13.113 1.00 0.00 ATOM 905 N LYS 115 95.673 -0.527 13.311 1.00 0.00 ATOM 906 CA LYS 115 96.568 -1.637 13.420 1.00 0.00 ATOM 907 CB LYS 115 96.265 -2.423 14.703 1.00 0.00 ATOM 908 CG LYS 115 97.093 -3.643 14.913 1.00 0.00 ATOM 909 CD LYS 115 96.556 -4.433 16.126 1.00 0.00 ATOM 910 CE LYS 115 97.512 -5.524 16.565 1.00 0.00 ATOM 911 NZ LYS 115 96.824 -6.462 17.498 1.00 0.00 ATOM 912 O LYS 115 95.256 -3.136 12.122 1.00 0.00 ATOM 913 C LYS 115 96.315 -2.531 12.207 1.00 0.00 ATOM 914 N VAL 116 97.312 -2.633 11.320 1.00 0.00 ATOM 915 CA VAL 116 97.170 -3.430 10.079 1.00 0.00 ATOM 916 CB VAL 116 97.848 -2.760 8.827 1.00 0.00 ATOM 917 CG1 VAL 116 97.498 -3.603 7.569 1.00 0.00 ATOM 918 CG2 VAL 116 97.356 -1.294 8.632 1.00 0.00 ATOM 919 O VAL 116 98.853 -4.956 10.725 1.00 0.00 ATOM 920 C VAL 116 97.733 -4.816 10.311 1.00 0.00 ATOM 921 N VAL 117 96.925 -5.842 10.085 1.00 0.00 ATOM 922 CA VAL 117 97.371 -7.192 10.297 1.00 0.00 ATOM 923 CB VAL 117 96.636 -7.891 11.488 1.00 0.00 ATOM 924 CG1 VAL 117 97.003 -7.192 12.830 1.00 0.00 ATOM 925 CG2 VAL 117 95.138 -7.870 11.290 1.00 0.00 ATOM 926 O VAL 117 96.254 -7.838 8.269 1.00 0.00 ATOM 927 C VAL 117 97.216 -8.004 9.019 1.00 0.00 ATOM 928 N LYS 118 98.209 -8.838 8.766 1.00 0.00 ATOM 929 CA LYS 118 98.100 -9.873 7.748 1.00 0.00 ATOM 930 CB LYS 118 99.440 -10.103 7.061 1.00 0.00 ATOM 931 CG LYS 118 99.249 -10.793 5.727 1.00 0.00 ATOM 932 CD LYS 118 100.547 -10.983 5.041 1.00 0.00 ATOM 933 CE LYS 118 100.449 -12.253 4.238 1.00 0.00 ATOM 934 NZ LYS 118 101.715 -12.528 3.531 1.00 0.00 ATOM 935 O LYS 118 98.225 -11.710 9.291 1.00 0.00 ATOM 936 C LYS 118 97.582 -11.161 8.391 1.00 0.00 ATOM 937 N VAL 119 96.401 -11.600 7.948 1.00 0.00 ATOM 938 CA VAL 119 95.740 -12.815 8.425 1.00 0.00 ATOM 939 CB VAL 119 94.211 -12.564 8.670 1.00 0.00 ATOM 940 CG1 VAL 119 94.040 -11.379 9.607 1.00 0.00 ATOM 941 CG2 VAL 119 93.443 -12.336 7.348 1.00 0.00 ATOM 942 O VAL 119 96.505 -13.702 6.330 1.00 0.00 ATOM 943 C VAL 119 95.994 -13.955 7.415 1.00 0.00 ATOM 944 N PRO 120 95.697 -15.216 7.777 1.00 0.00 ATOM 945 CA PRO 120 95.736 -16.287 6.743 1.00 0.00 ATOM 946 CB PRO 120 95.981 -17.552 7.564 1.00 0.00 ATOM 947 CG PRO 120 95.376 -17.263 8.911 1.00 0.00 ATOM 948 CD PRO 120 95.391 -15.742 9.124 1.00 0.00 ATOM 949 O PRO 120 93.379 -15.999 6.434 1.00 0.00 ATOM 950 C PRO 120 94.435 -16.359 5.918 1.00 0.00 ATOM 951 N GLN 121 94.504 -16.790 4.647 1.00 0.00 ATOM 952 CA GLN 121 93.381 -16.577 3.681 1.00 0.00 ATOM 953 CB GLN 121 93.833 -16.800 2.217 1.00 0.00 ATOM 954 CG GLN 121 93.285 -15.747 1.185 1.00 0.00 ATOM 955 CD GLN 121 91.789 -15.906 0.800 1.00 0.00 ATOM 956 OE1 GLN 121 91.473 -16.496 -0.249 1.00 0.00 ATOM 957 NE2 GLN 121 90.878 -15.359 1.621 1.00 0.00 ATOM 958 O GLN 121 90.994 -17.000 3.565 1.00 0.00 ATOM 959 C GLN 121 92.107 -17.384 3.968 1.00 0.00 ATOM 960 N THR 123 90.875 -17.336 6.753 1.00 0.00 ATOM 961 CA THR 123 90.318 -16.678 7.939 1.00 0.00 ATOM 962 CB THR 123 91.356 -16.457 9.088 1.00 0.00 ATOM 963 CG2 THR 123 92.071 -17.768 9.483 1.00 0.00 ATOM 964 OG1 THR 123 92.322 -15.478 8.707 1.00 0.00 ATOM 965 O THR 123 89.809 -14.738 6.581 1.00 0.00 ATOM 966 C THR 123 89.574 -15.383 7.619 1.00 0.00 ATOM 967 N LEU 124 88.660 -15.034 8.522 1.00 0.00 ATOM 968 CA LEU 124 87.896 -13.829 8.401 1.00 0.00 ATOM 969 CB LEU 124 86.482 -14.128 7.908 1.00 0.00 ATOM 970 CG LEU 124 85.906 -13.148 6.870 1.00 0.00 ATOM 971 CD1 LEU 124 86.745 -13.171 5.594 1.00 0.00 ATOM 972 CD2 LEU 124 84.496 -13.563 6.533 1.00 0.00 ATOM 973 O LEU 124 88.936 -12.405 9.997 1.00 0.00 ATOM 974 C LEU 124 87.905 -13.038 9.710 1.00 0.00 ATOM 975 N LEU 125 86.787 -13.034 10.458 1.00 0.00 ATOM 976 CA LEU 125 86.689 -12.280 11.722 1.00 0.00 ATOM 977 CB LEU 125 85.267 -11.775 11.991 1.00 0.00 ATOM 978 CG LEU 125 84.799 -10.537 11.254 1.00 0.00 ATOM 979 CD1 LEU 125 83.298 -10.313 11.464 1.00 0.00 ATOM 980 CD2 LEU 125 85.640 -9.308 11.661 1.00 0.00 ATOM 981 O LEU 125 87.766 -12.610 13.824 1.00 0.00 ATOM 982 C LEU 125 87.100 -13.112 12.916 1.00 0.00 ATOM 983 N MET 126 86.669 -14.374 12.917 1.00 0.00 ATOM 984 CA MET 126 86.829 -15.253 14.051 1.00 0.00 ATOM 985 CB MET 126 86.122 -16.583 13.814 1.00 0.00 ATOM 986 CG MET 126 84.726 -16.565 14.365 1.00 0.00 ATOM 987 SD MET 126 84.580 -17.188 16.078 1.00 0.00 ATOM 988 CE MET 126 85.743 -16.247 17.087 1.00 0.00 ATOM 989 O MET 126 88.596 -15.443 15.628 1.00 0.00 ATOM 990 C MET 126 88.274 -15.450 14.442 1.00 0.00 ATOM 991 N ASP 127 89.158 -15.576 13.466 1.00 0.00 ATOM 992 CA ASP 127 90.574 -15.722 13.787 1.00 0.00 ATOM 993 CB ASP 127 91.369 -16.292 12.619 1.00 0.00 ATOM 994 CG ASP 127 92.759 -16.748 13.042 1.00 0.00 ATOM 995 OD1 ASP 127 92.882 -17.854 13.616 1.00 0.00 ATOM 996 OD2 ASP 127 93.728 -15.998 12.833 1.00 0.00 ATOM 997 O ASP 127 92.154 -14.460 15.071 1.00 0.00 ATOM 998 C ASP 127 91.232 -14.436 14.256 1.00 0.00 ATOM 999 N ALA 128 90.786 -13.310 13.726 1.00 0.00 ATOM 1000 CA ALA 128 91.352 -12.034 14.155 1.00 0.00 ATOM 1001 CB ALA 128 91.017 -10.943 13.149 1.00 0.00 ATOM 1002 O ALA 128 91.610 -11.079 16.343 1.00 0.00 ATOM 1003 C ALA 128 90.879 -11.670 15.581 1.00 0.00 ATOM 1004 N LEU 129 89.660 -12.052 15.927 1.00 0.00 ATOM 1005 CA LEU 129 89.050 -11.694 17.219 1.00 0.00 ATOM 1006 CB LEU 129 87.613 -11.250 16.989 1.00 0.00 ATOM 1007 CG LEU 129 87.446 -9.974 16.176 1.00 0.00 ATOM 1008 CD1 LEU 129 85.994 -9.604 16.170 1.00 0.00 ATOM 1009 CD2 LEU 129 88.313 -8.871 16.766 1.00 0.00 ATOM 1010 O LEU 129 88.316 -12.740 19.264 1.00 0.00 ATOM 1011 C LEU 129 89.043 -12.824 18.259 1.00 0.00 ATOM 1012 N LYS 130 89.823 -13.882 18.032 1.00 0.00 ATOM 1013 CA LYS 130 89.760 -15.049 18.921 1.00 0.00 ATOM 1014 CB LYS 130 90.442 -16.278 18.285 1.00 0.00 ATOM 1015 CG LYS 130 91.927 -16.073 18.038 1.00 0.00 ATOM 1016 CD LYS 130 92.625 -17.234 17.337 1.00 0.00 ATOM 1017 CE LYS 130 94.109 -16.885 17.209 1.00 0.00 ATOM 1018 NZ LYS 130 94.860 -17.750 16.268 1.00 0.00 ATOM 1019 O LYS 130 91.434 -14.019 20.368 1.00 0.00 ATOM 1020 C LYS 130 90.381 -14.690 20.285 1.00 0.00 ATOM 1021 N GLU 131 89.728 -15.142 21.350 1.00 0.00 ATOM 1022 CA GLU 131 90.058 -14.697 22.715 1.00 0.00 ATOM 1023 CB GLU 131 91.192 -15.565 23.343 1.00 0.00 ATOM 1024 CG GLU 131 90.674 -16.830 24.123 1.00 0.00 ATOM 1025 CD GLU 131 91.767 -17.898 24.411 1.00 0.00 ATOM 1026 OE1 GLU 131 92.960 -17.529 24.652 1.00 0.00 ATOM 1027 OE2 GLU 131 91.428 -19.118 24.406 1.00 0.00 ATOM 1028 O GLU 131 91.257 -12.679 23.461 1.00 0.00 ATOM 1029 C GLU 131 90.279 -13.160 22.841 1.00 0.00 ATOM 1030 N GLU 132 89.375 -12.396 22.212 1.00 0.00 ATOM 1031 CA GLU 132 89.183 -11.000 22.570 1.00 0.00 ATOM 1032 CB GLU 132 88.870 -10.111 21.366 1.00 0.00 ATOM 1033 CG GLU 132 88.400 -8.717 21.744 1.00 0.00 ATOM 1034 CD GLU 132 89.478 -7.876 22.439 1.00 0.00 ATOM 1035 OE1 GLU 132 89.378 -7.615 23.663 1.00 0.00 ATOM 1036 OE2 GLU 132 90.432 -7.463 21.761 1.00 0.00 ATOM 1037 O GLU 132 86.909 -11.422 23.271 1.00 0.00 ATOM 1038 C GLU 132 88.036 -11.000 23.567 1.00 0.00 ATOM 1039 N SER 133 88.330 -10.563 24.776 1.00 0.00 ATOM 1040 CA SER 133 87.337 -10.644 25.840 1.00 0.00 ATOM 1041 CB SER 133 87.671 -11.795 26.798 1.00 0.00 ATOM 1042 OG SER 133 89.001 -11.624 27.282 1.00 0.00 ATOM 1043 O SER 133 86.547 -9.203 27.565 1.00 0.00 ATOM 1044 C SER 133 87.294 -9.322 26.600 1.00 0.00 ATOM 1045 N GLU 134 88.084 -8.338 26.167 1.00 0.00 ATOM 1046 CA GLU 134 88.094 -7.047 26.859 1.00 0.00 ATOM 1047 CB GLU 134 89.511 -6.556 27.046 1.00 0.00 ATOM 1048 CG GLU 134 90.225 -7.429 28.070 1.00 0.00 ATOM 1049 CD GLU 134 91.493 -6.824 28.586 1.00 0.00 ATOM 1050 OE1 GLU 134 91.915 -5.774 28.057 1.00 0.00 ATOM 1051 OE2 GLU 134 92.072 -7.414 29.532 1.00 0.00 ATOM 1052 O GLU 134 86.662 -5.127 27.109 1.00 0.00 ATOM 1053 C GLU 134 87.180 -5.944 26.318 1.00 0.00 ATOM 1054 N ILE 135 86.986 -5.880 24.995 1.00 0.00 ATOM 1055 CA ILE 135 86.065 -4.874 24.460 1.00 0.00 ATOM 1056 CB ILE 135 86.778 -3.604 23.960 1.00 0.00 ATOM 1057 CG1 ILE 135 85.752 -2.409 23.790 1.00 0.00 ATOM 1058 CG2 ILE 135 87.590 -3.935 22.660 1.00 0.00 ATOM 1059 CD1 ILE 135 84.415 -2.234 24.843 1.00 0.00 ATOM 1060 O ILE 135 85.329 -6.512 22.878 1.00 0.00 ATOM 1061 C ILE 135 85.117 -5.412 23.411 1.00 0.00 ATOM 1062 N ILE 136 84.031 -4.661 23.214 1.00 0.00 ATOM 1063 CA ILE 136 83.146 -4.891 22.134 1.00 0.00 ATOM 1064 CB ILE 136 81.647 -5.273 22.553 1.00 0.00 ATOM 1065 CG1 ILE 136 80.526 -4.651 21.706 1.00 0.00 ATOM 1066 CG2 ILE 136 81.391 -5.270 24.131 1.00 0.00 ATOM 1067 CD1 ILE 136 80.829 -3.359 21.154 1.00 0.00 ATOM 1068 O ILE 136 83.636 -2.691 21.217 1.00 0.00 ATOM 1069 C ILE 136 83.444 -3.885 20.986 1.00 0.00 ATOM 1070 N TYR 137 83.625 -4.417 19.789 1.00 0.00 ATOM 1071 CA TYR 137 83.894 -3.576 18.629 1.00 0.00 ATOM 1072 CB TYR 137 84.454 -4.450 17.497 1.00 0.00 ATOM 1073 CG TYR 137 85.896 -4.615 17.619 1.00 0.00 ATOM 1074 CD1 TYR 137 86.443 -5.637 18.394 1.00 0.00 ATOM 1075 CD2 TYR 137 86.761 -3.709 16.998 1.00 0.00 ATOM 1076 CE1 TYR 137 87.839 -5.752 18.523 1.00 0.00 ATOM 1077 CE2 TYR 137 88.121 -3.838 17.091 1.00 0.00 ATOM 1078 CZ TYR 137 88.649 -4.879 17.849 1.00 0.00 ATOM 1079 OH TYR 137 90.013 -4.965 17.974 1.00 0.00 ATOM 1080 O TYR 137 81.509 -3.580 18.382 1.00 0.00 ATOM 1081 C TYR 137 82.566 -2.949 18.279 1.00 0.00 ATOM 1082 N ASP 138 82.605 -1.691 17.892 1.00 0.00 ATOM 1083 CA ASP 138 81.396 -1.042 17.385 1.00 0.00 ATOM 1084 CB ASP 138 81.557 0.468 17.351 1.00 0.00 ATOM 1085 CG ASP 138 81.795 1.038 18.770 1.00 0.00 ATOM 1086 OD1 ASP 138 80.836 1.033 19.561 1.00 0.00 ATOM 1087 OD2 ASP 138 82.916 1.386 19.082 1.00 0.00 ATOM 1088 O ASP 138 79.709 -1.594 15.815 1.00 0.00 ATOM 1089 C ASP 138 80.901 -1.561 16.019 1.00 0.00 ATOM 1090 N PHE 139 81.811 -1.951 15.136 1.00 0.00 ATOM 1091 CA PHE 139 81.403 -2.296 13.732 1.00 0.00 ATOM 1092 CB PHE 139 81.068 -1.002 12.921 1.00 0.00 ATOM 1093 CG PHE 139 82.267 -0.110 12.690 1.00 0.00 ATOM 1094 CD1 PHE 139 83.105 -0.293 11.557 1.00 0.00 ATOM 1095 CD2 PHE 139 82.562 0.926 13.576 1.00 0.00 ATOM 1096 CE1 PHE 139 84.208 0.551 11.334 1.00 0.00 ATOM 1097 CE2 PHE 139 83.665 1.738 13.379 1.00 0.00 ATOM 1098 CZ PHE 139 84.493 1.565 12.266 1.00 0.00 ATOM 1099 O PHE 139 83.588 -3.199 13.448 1.00 0.00 ATOM 1100 C PHE 139 82.446 -3.119 13.027 1.00 0.00 ATOM 1101 N CYS 140 82.037 -3.827 11.973 1.00 0.00 ATOM 1102 CA CYS 140 82.996 -4.163 10.962 1.00 0.00 ATOM 1103 CB CYS 140 83.321 -5.674 10.875 1.00 0.00 ATOM 1104 SG CYS 140 82.008 -6.651 10.125 1.00 0.00 ATOM 1105 O CYS 140 81.233 -3.377 9.483 1.00 0.00 ATOM 1106 C CYS 140 82.413 -3.611 9.627 1.00 0.00 ATOM 1107 N MET 141 83.307 -3.315 8.727 1.00 0.00 ATOM 1108 CA MET 141 82.917 -2.878 7.395 1.00 0.00 ATOM 1109 CB MET 141 83.046 -1.342 7.255 1.00 0.00 ATOM 1110 CG MET 141 84.421 -0.717 7.358 1.00 0.00 ATOM 1111 SD MET 141 84.272 1.095 7.648 1.00 0.00 ATOM 1112 CE MET 141 83.341 1.640 6.177 1.00 0.00 ATOM 1113 O MET 141 84.804 -4.282 6.815 1.00 0.00 ATOM 1114 C MET 141 83.761 -3.718 6.420 1.00 0.00 ATOM 1115 N CYS 142 83.288 -3.832 5.167 1.00 0.00 ATOM 1116 CA CYS 142 84.027 -4.609 4.205 1.00 0.00 ATOM 1117 CB CYS 142 83.724 -6.102 4.399 1.00 0.00 ATOM 1118 SG CYS 142 84.497 -7.181 3.132 1.00 0.00 ATOM 1119 O CYS 142 82.418 -4.047 2.527 1.00 0.00 ATOM 1120 C CYS 142 83.604 -4.180 2.814 1.00 0.00 ATOM 1121 N ASN 143 84.597 -3.881 1.992 1.00 0.00 ATOM 1122 CA ASN 143 84.378 -3.891 0.519 1.00 0.00 ATOM 1123 CB ASN 143 85.070 -2.703 -0.092 1.00 0.00 ATOM 1124 CG ASN 143 84.838 -2.597 -1.620 1.00 0.00 ATOM 1125 ND2 ASN 143 85.656 -1.768 -2.271 1.00 0.00 ATOM 1126 OD1 ASN 143 83.934 -3.232 -2.177 1.00 0.00 ATOM 1127 O ASN 143 86.114 -5.397 -0.100 1.00 0.00 ATOM 1128 C ASN 143 84.939 -5.237 -0.010 1.00 0.00 ATOM 1129 N PRO 144 84.063 -6.230 -0.272 1.00 0.00 ATOM 1130 CA PRO 144 84.477 -7.601 -0.540 1.00 0.00 ATOM 1131 CB PRO 144 83.146 -8.358 -0.654 1.00 0.00 ATOM 1132 CG PRO 144 82.153 -7.342 -0.941 1.00 0.00 ATOM 1133 CD PRO 144 82.624 -6.046 -0.379 1.00 0.00 ATOM 1134 O PRO 144 85.203 -7.012 -2.793 1.00 0.00 ATOM 1135 C PRO 144 85.332 -7.797 -1.848 1.00 0.00 ATOM 1136 N PRO 145 86.229 -8.795 -1.841 1.00 0.00 ATOM 1137 CA PRO 145 86.905 -9.162 -3.092 1.00 0.00 ATOM 1138 CB PRO 145 88.061 -10.050 -2.645 1.00 0.00 ATOM 1139 CG PRO 145 87.539 -10.690 -1.341 1.00 0.00 ATOM 1140 CD PRO 145 86.622 -9.670 -0.708 1.00 0.00 ATOM 1141 O PRO 145 84.911 -10.446 -3.648 1.00 0.00 ATOM 1142 C PRO 145 85.977 -9.932 -4.045 1.00 0.00 ATOM 1143 N PHE 146 86.382 -9.938 -5.313 1.00 0.00 ATOM 1144 CA PHE 146 85.668 -10.647 -6.397 1.00 0.00 ATOM 1145 CB PHE 146 85.509 -9.758 -7.622 1.00 0.00 ATOM 1146 CG PHE 146 84.331 -8.841 -7.552 1.00 0.00 ATOM 1147 CD1 PHE 146 83.361 -8.988 -6.546 1.00 0.00 ATOM 1148 CD2 PHE 146 84.169 -7.845 -8.515 1.00 0.00 ATOM 1149 CE1 PHE 146 82.269 -8.146 -6.481 1.00 0.00 ATOM 1150 CE2 PHE 146 83.099 -6.993 -8.464 1.00 0.00 ATOM 1151 CZ PHE 146 82.125 -7.139 -7.454 1.00 0.00 ATOM 1152 O PHE 146 87.466 -11.647 -7.514 1.00 0.00 ATOM 1153 C PHE 146 86.510 -11.815 -6.768 1.00 0.00 ATOM 1154 N PHE 147 86.200 -12.964 -6.156 1.00 0.00 ATOM 1155 CA PHE 147 86.915 -14.218 -6.343 1.00 0.00 ATOM 1156 CB PHE 147 87.235 -14.925 -5.010 1.00 0.00 ATOM 1157 CG PHE 147 88.325 -14.271 -4.186 1.00 0.00 ATOM 1158 CD1 PHE 147 88.211 -14.214 -2.780 1.00 0.00 ATOM 1159 CD2 PHE 147 89.494 -13.741 -4.788 1.00 0.00 ATOM 1160 CE1 PHE 147 89.252 -13.627 -1.991 1.00 0.00 ATOM 1161 CE2 PHE 147 90.510 -13.144 -4.011 1.00 0.00 ATOM 1162 CZ PHE 147 90.386 -13.088 -2.612 1.00 0.00 ATOM 1163 O PHE 147 86.391 -15.535 -8.266 1.00 0.00 ATOM 1164 C PHE 147 85.993 -15.118 -7.166 1.00 0.00 ATOM 1165 N GLY 173 85.972 -19.409 -18.081 1.00 0.00 ATOM 1166 CA GLY 173 86.769 -18.956 -19.237 1.00 0.00 ATOM 1167 O GLY 173 86.961 -16.580 -18.919 1.00 0.00 ATOM 1168 C GLY 173 86.479 -17.506 -19.596 1.00 0.00 ATOM 1169 N ILE 174 85.679 -17.312 -20.651 1.00 0.00 ATOM 1170 CA ILE 174 85.171 -15.981 -21.053 1.00 0.00 ATOM 1171 CB ILE 174 84.417 -16.008 -22.473 1.00 0.00 ATOM 1172 CG1 ILE 174 82.968 -16.530 -22.366 1.00 0.00 ATOM 1173 CG2 ILE 174 85.202 -16.836 -23.538 1.00 0.00 ATOM 1174 CD1 ILE 174 81.919 -15.728 -23.187 1.00 0.00 ATOM 1175 O ILE 174 84.056 -14.094 -20.010 1.00 0.00 ATOM 1176 C ILE 174 84.273 -15.315 -19.974 1.00 0.00 ATOM 1177 N THR 175 83.776 -16.121 -19.020 1.00 0.00 ATOM 1178 CA THR 175 82.693 -15.707 -18.098 1.00 0.00 ATOM 1179 CB THR 175 81.454 -16.709 -18.082 1.00 0.00 ATOM 1180 CG2 THR 175 81.016 -17.159 -19.494 1.00 0.00 ATOM 1181 OG1 THR 175 81.728 -17.849 -17.248 1.00 0.00 ATOM 1182 O THR 175 82.164 -15.576 -15.768 1.00 0.00 ATOM 1183 C THR 175 83.034 -15.391 -16.620 1.00 0.00 ATOM 1184 N GLU 176 84.236 -14.904 -16.284 1.00 0.00 ATOM 1185 CA GLU 176 84.359 -14.290 -14.925 1.00 0.00 ATOM 1186 CB GLU 176 85.722 -14.376 -14.212 1.00 0.00 ATOM 1187 CG GLU 176 86.941 -14.703 -15.054 1.00 0.00 ATOM 1188 CD GLU 176 86.816 -16.021 -15.773 1.00 0.00 ATOM 1189 OE1 GLU 176 87.780 -16.815 -15.755 1.00 0.00 ATOM 1190 OE2 GLU 176 85.738 -16.261 -16.357 1.00 0.00 ATOM 1191 O GLU 176 84.334 -11.892 -14.790 1.00 0.00 ATOM 1192 C GLU 176 83.688 -12.940 -14.818 1.00 0.00 ATOM 1193 N ILE 177 82.363 -13.039 -14.933 1.00 0.00 ATOM 1194 CA ILE 177 81.355 -12.350 -14.145 1.00 0.00 ATOM 1195 CB ILE 177 80.165 -11.922 -15.043 1.00 0.00 ATOM 1196 CG1 ILE 177 79.483 -13.127 -15.713 1.00 0.00 ATOM 1197 CG2 ILE 177 80.634 -10.924 -16.115 1.00 0.00 ATOM 1198 CD1 ILE 177 78.405 -12.727 -16.726 1.00 0.00 ATOM 1199 O ILE 177 80.026 -13.018 -12.163 1.00 0.00 ATOM 1200 C ILE 177 80.890 -13.337 -12.998 1.00 0.00 ATOM 1201 N MET 178 81.487 -14.533 -13.001 1.00 0.00 ATOM 1202 CA MET 178 81.488 -15.480 -11.884 1.00 0.00 ATOM 1203 CB MET 178 82.248 -16.755 -12.262 1.00 0.00 ATOM 1204 CG MET 178 81.607 -17.577 -13.377 1.00 0.00 ATOM 1205 SD MET 178 80.396 -18.756 -12.771 1.00 0.00 ATOM 1206 CE MET 178 81.497 -19.953 -11.976 1.00 0.00 ATOM 1207 O MET 178 81.756 -15.026 -9.550 1.00 0.00 ATOM 1208 C MET 178 82.183 -14.830 -10.690 1.00 0.00 ATOM 1209 N ALA 179 83.253 -14.073 -10.978 1.00 0.00 ATOM 1210 CA ALA 179 83.983 -13.256 -9.979 1.00 0.00 ATOM 1211 CB ALA 179 85.057 -12.426 -10.653 1.00 0.00 ATOM 1212 O ALA 179 83.038 -12.354 -7.954 1.00 0.00 ATOM 1213 C ALA 179 83.031 -12.347 -9.191 1.00 0.00 ATOM 1214 N GLU 180 82.213 -11.581 -9.923 1.00 0.00 ATOM 1215 CA GLU 180 81.178 -10.723 -9.333 1.00 0.00 ATOM 1216 CB GLU 180 80.418 -9.936 -10.413 1.00 0.00 ATOM 1217 CG GLU 180 81.248 -8.874 -11.115 1.00 0.00 ATOM 1218 CD GLU 180 80.631 -8.449 -12.450 1.00 0.00 ATOM 1219 OE1 GLU 180 79.518 -8.935 -12.795 1.00 0.00 ATOM 1220 OE2 GLU 180 81.273 -7.634 -13.146 1.00 0.00 ATOM 1221 O GLU 180 79.861 -11.063 -7.377 1.00 0.00 ATOM 1222 C GLU 180 80.192 -11.500 -8.477 1.00 0.00 ATOM 1223 N GLY 181 79.730 -12.649 -8.976 1.00 0.00 ATOM 1224 CA GLY 181 78.848 -13.526 -8.203 1.00 0.00 ATOM 1225 O GLY 181 78.681 -14.422 -5.981 1.00 0.00 ATOM 1226 C GLY 181 79.438 -14.085 -6.898 1.00 0.00 ATOM 1227 N GLY 182 80.779 -14.180 -6.824 1.00 0.00 ATOM 1228 CA GLY 182 81.503 -14.691 -5.653 1.00 0.00 ATOM 1229 O GLY 182 81.659 -14.287 -3.271 1.00 0.00 ATOM 1230 C GLY 182 81.328 -13.834 -4.399 1.00 0.00 ATOM 1231 N GLU 183 80.829 -12.605 -4.589 1.00 0.00 ATOM 1232 CA GLU 183 80.627 -11.663 -3.500 1.00 0.00 ATOM 1233 CB GLU 183 80.239 -10.255 -4.006 1.00 0.00 ATOM 1234 CG GLU 183 78.822 -9.768 -3.629 1.00 0.00 ATOM 1235 CD GLU 183 78.445 -8.407 -4.230 1.00 0.00 ATOM 1236 OE1 GLU 183 79.321 -7.538 -4.359 1.00 0.00 ATOM 1237 OE2 GLU 183 77.254 -8.210 -4.558 1.00 0.00 ATOM 1238 O GLU 183 79.755 -12.112 -1.295 1.00 0.00 ATOM 1239 C GLU 183 79.620 -12.269 -2.517 1.00 0.00 ATOM 1240 N LEU 184 78.665 -13.029 -3.054 1.00 0.00 ATOM 1241 CA LEU 184 77.668 -13.704 -2.257 1.00 0.00 ATOM 1242 CB LEU 184 76.689 -14.456 -3.144 1.00 0.00 ATOM 1243 CG LEU 184 75.203 -14.435 -2.757 1.00 0.00 ATOM 1244 CD1 LEU 184 74.920 -15.250 -1.517 1.00 0.00 ATOM 1245 CD2 LEU 184 74.699 -12.988 -2.588 1.00 0.00 ATOM 1246 O LEU 184 77.993 -14.590 -0.038 1.00 0.00 ATOM 1247 C LEU 184 78.303 -14.659 -1.237 1.00 0.00 ATOM 1248 N GLU 185 79.206 -15.516 -1.698 1.00 0.00 ATOM 1249 CA GLU 185 79.829 -16.466 -0.813 1.00 0.00 ATOM 1250 CB GLU 185 80.574 -17.566 -1.569 1.00 0.00 ATOM 1251 CG GLU 185 79.653 -18.625 -2.294 1.00 0.00 ATOM 1252 CD GLU 185 78.593 -19.306 -1.392 1.00 0.00 ATOM 1253 OE1 GLU 185 78.985 -19.951 -0.380 1.00 0.00 ATOM 1254 OE2 GLU 185 77.370 -19.209 -1.703 1.00 0.00 ATOM 1255 O GLU 185 80.803 -16.175 1.348 1.00 0.00 ATOM 1256 C GLU 185 80.742 -15.757 0.191 1.00 0.00 ATOM 1257 N PHE 186 81.426 -14.684 -0.228 1.00 0.00 ATOM 1258 CA PHE 186 82.187 -13.898 0.745 1.00 0.00 ATOM 1259 CB PHE 186 83.034 -12.787 0.098 1.00 0.00 ATOM 1260 CG PHE 186 84.131 -12.272 0.996 1.00 0.00 ATOM 1261 CD1 PHE 186 85.415 -12.857 0.976 1.00 0.00 ATOM 1262 CD2 PHE 186 83.878 -11.225 1.875 1.00 0.00 ATOM 1263 CE1 PHE 186 86.415 -12.382 1.795 1.00 0.00 ATOM 1264 CE2 PHE 186 84.892 -10.725 2.723 1.00 0.00 ATOM 1265 CZ PHE 186 86.138 -11.284 2.679 1.00 0.00 ATOM 1266 O PHE 186 81.613 -13.553 3.053 1.00 0.00 ATOM 1267 C PHE 186 81.297 -13.361 1.890 1.00 0.00 ATOM 1268 N VAL 187 80.191 -12.725 1.561 1.00 0.00 ATOM 1269 CA VAL 187 79.336 -12.122 2.591 1.00 0.00 ATOM 1270 CB VAL 187 78.215 -11.270 1.979 1.00 0.00 ATOM 1271 CG1 VAL 187 77.329 -10.644 3.064 1.00 0.00 ATOM 1272 CG2 VAL 187 78.846 -10.151 1.130 1.00 0.00 ATOM 1273 O VAL 187 78.892 -13.093 4.734 1.00 0.00 ATOM 1274 C VAL 187 78.811 -13.214 3.513 1.00 0.00 ATOM 1275 N LYS 188 78.302 -14.300 2.917 1.00 0.00 ATOM 1276 CA LYS 188 77.907 -15.468 3.709 1.00 0.00 ATOM 1277 CB LYS 188 77.548 -16.659 2.818 1.00 0.00 ATOM 1278 CG LYS 188 76.230 -16.590 2.168 1.00 0.00 ATOM 1279 CD LYS 188 76.182 -17.783 1.202 1.00 0.00 ATOM 1280 CE LYS 188 74.807 -18.404 1.019 1.00 0.00 ATOM 1281 NZ LYS 188 73.735 -17.429 0.687 1.00 0.00 ATOM 1282 O LYS 188 78.519 -16.357 5.791 1.00 0.00 ATOM 1283 C LYS 188 78.933 -15.933 4.745 1.00 0.00 ATOM 1284 N ARG 189 80.226 -15.919 4.413 1.00 0.00 ATOM 1285 CA ARG 189 81.320 -16.160 5.375 1.00 0.00 ATOM 1286 CB ARG 189 82.707 -16.067 4.707 1.00 0.00 ATOM 1287 CG ARG 189 83.197 -17.268 3.873 1.00 0.00 ATOM 1288 CD ARG 189 84.474 -16.931 3.049 1.00 0.00 ATOM 1289 NE ARG 189 85.735 -16.921 3.802 1.00 0.00 ATOM 1290 CZ ARG 189 86.906 -16.467 3.335 1.00 0.00 ATOM 1291 NH1 ARG 189 87.014 -15.959 2.095 1.00 0.00 ATOM 1292 NH2 ARG 189 87.989 -16.502 4.103 1.00 0.00 ATOM 1293 O ARG 189 81.604 -15.553 7.731 1.00 0.00 ATOM 1294 C ARG 189 81.311 -15.166 6.567 1.00 0.00 ATOM 1295 N ILE 190 81.038 -13.896 6.269 1.00 0.00 ATOM 1296 CA ILE 190 80.946 -12.846 7.307 1.00 0.00 ATOM 1297 CB ILE 190 80.782 -11.394 6.702 1.00 0.00 ATOM 1298 CG1 ILE 190 82.028 -10.977 5.891 1.00 0.00 ATOM 1299 CG2 ILE 190 80.522 -10.353 7.816 1.00 0.00 ATOM 1300 CD1 ILE 190 81.872 -9.626 5.157 1.00 0.00 ATOM 1301 O ILE 190 79.818 -13.042 9.424 1.00 0.00 ATOM 1302 C ILE 190 79.748 -13.150 8.184 1.00 0.00 ATOM 1303 N ILE 191 78.635 -13.492 7.539 1.00 0.00 ATOM 1304 CA ILE 191 77.441 -13.918 8.269 1.00 0.00 ATOM 1305 CB ILE 191 76.274 -14.247 7.312 1.00 0.00 ATOM 1306 CG1 ILE 191 75.800 -12.972 6.595 1.00 0.00 ATOM 1307 CG2 ILE 191 75.143 -14.992 8.053 1.00 0.00 ATOM 1308 CD1 ILE 191 74.710 -13.210 5.544 1.00 0.00 ATOM 1309 O ILE 191 77.384 -15.167 10.329 1.00 0.00 ATOM 1310 C ILE 191 77.785 -15.132 9.174 1.00 0.00 ATOM 1311 N HIS 192 78.522 -16.099 8.644 1.00 0.00 ATOM 1312 CA HIS 192 78.935 -17.304 9.408 1.00 0.00 ATOM 1313 CB HIS 192 79.762 -18.246 8.530 1.00 0.00 ATOM 1314 CG HIS 192 80.101 -19.555 9.176 1.00 0.00 ATOM 1315 CD2 HIS 192 79.360 -20.671 9.370 1.00 0.00 ATOM 1316 ND1 HIS 192 81.355 -19.836 9.683 1.00 0.00 ATOM 1317 CE1 HIS 192 81.366 -21.063 10.172 1.00 0.00 ATOM 1318 NE2 HIS 192 80.168 -21.593 9.987 1.00 0.00 ATOM 1319 O HIS 192 79.477 -17.429 11.752 1.00 0.00 ATOM 1320 C HIS 192 79.735 -16.913 10.652 1.00 0.00 ATOM 1321 N ASP 193 80.698 -16.001 10.500 1.00 0.00 ATOM 1322 CA ASP 193 81.502 -15.587 11.650 1.00 0.00 ATOM 1323 CB ASP 193 82.690 -14.762 11.228 1.00 0.00 ATOM 1324 CG ASP 193 83.804 -15.611 10.714 1.00 0.00 ATOM 1325 OD1 ASP 193 83.547 -16.792 10.370 1.00 0.00 ATOM 1326 OD2 ASP 193 84.922 -15.117 10.653 1.00 0.00 ATOM 1327 O ASP 193 80.850 -15.009 13.886 1.00 0.00 ATOM 1328 C ASP 193 80.671 -14.826 12.664 1.00 0.00 ATOM 1329 N SER 194 79.751 -14.004 12.160 1.00 0.00 ATOM 1330 CA SER 194 78.921 -13.186 12.998 1.00 0.00 ATOM 1331 CB SER 194 78.109 -12.181 12.174 1.00 0.00 ATOM 1332 OG SER 194 76.845 -12.655 11.752 1.00 0.00 ATOM 1333 O SER 194 77.781 -13.689 15.025 1.00 0.00 ATOM 1334 C SER 194 78.025 -14.049 13.881 1.00 0.00 ATOM 1335 N LEU 195 77.570 -15.194 13.350 1.00 0.00 ATOM 1336 CA LEU 195 76.696 -16.117 14.087 1.00 0.00 ATOM 1337 CB LEU 195 76.090 -17.205 13.178 1.00 0.00 ATOM 1338 CG LEU 195 74.997 -16.720 12.228 1.00 0.00 ATOM 1339 CD1 LEU 195 74.766 -17.742 11.099 1.00 0.00 ATOM 1340 CD2 LEU 195 73.686 -16.334 12.947 1.00 0.00 ATOM 1341 O LEU 195 76.666 -17.120 16.233 1.00 0.00 ATOM 1342 C LEU 195 77.359 -16.741 15.291 1.00 0.00 ATOM 1343 N GLN 196 78.689 -16.852 15.274 1.00 0.00 ATOM 1344 CA GLN 196 79.408 -17.263 16.481 1.00 0.00 ATOM 1345 CB GLN 196 80.560 -18.194 16.213 1.00 0.00 ATOM 1346 CG GLN 196 81.342 -17.887 15.009 1.00 0.00 ATOM 1347 CD GLN 196 81.735 -19.159 14.275 1.00 0.00 ATOM 1348 OE1 GLN 196 80.900 -20.061 14.076 1.00 0.00 ATOM 1349 NE2 GLN 196 83.012 -19.245 13.872 1.00 0.00 ATOM 1350 O GLN 196 79.872 -16.246 18.581 1.00 0.00 ATOM 1351 C GLN 196 79.883 -16.124 17.346 1.00 0.00 ATOM 1352 N LEU 197 80.281 -15.017 16.727 1.00 0.00 ATOM 1353 CA LEU 197 80.732 -13.865 17.507 1.00 0.00 ATOM 1354 CB LEU 197 81.548 -12.901 16.647 1.00 0.00 ATOM 1355 CG LEU 197 82.904 -13.389 16.208 1.00 0.00 ATOM 1356 CD1 LEU 197 83.375 -12.473 15.092 1.00 0.00 ATOM 1357 CD2 LEU 197 83.897 -13.409 17.344 1.00 0.00 ATOM 1358 O LEU 197 79.822 -12.516 19.242 1.00 0.00 ATOM 1359 C LEU 197 79.601 -13.109 18.192 1.00 0.00 ATOM 1360 N LYS 199 78.422 -13.107 17.575 1.00 0.00 ATOM 1361 CA LYS 199 77.234 -12.425 18.096 1.00 0.00 ATOM 1362 O LYS 199 77.935 -10.150 17.764 1.00 0.00 ATOM 1363 C LYS 199 77.558 -11.011 18.572 1.00 0.00 ATOM 1364 N ARG 200 79.801 -9.645 20.436 1.00 0.00 ATOM 1365 CA ARG 200 81.171 -9.166 20.401 1.00 0.00 ATOM 1366 CB ARG 200 82.135 -10.357 20.123 1.00 0.00 ATOM 1367 CG ARG 200 83.640 -10.051 20.037 1.00 0.00 ATOM 1368 CD ARG 200 84.280 -9.529 21.415 1.00 0.00 ATOM 1369 NE ARG 200 83.926 -10.450 22.500 1.00 0.00 ATOM 1370 CZ ARG 200 83.942 -10.137 23.813 1.00 0.00 ATOM 1371 NH1 ARG 200 84.214 -8.909 24.236 1.00 0.00 ATOM 1372 NH2 ARG 200 83.594 -11.044 24.694 1.00 0.00 ATOM 1373 O ARG 200 82.336 -7.206 19.602 1.00 0.00 ATOM 1374 C ARG 200 81.395 -7.953 19.432 1.00 0.00 ATOM 1375 N LEU 201 80.524 -7.741 18.452 1.00 0.00 ATOM 1376 CA LEU 201 80.562 -6.487 17.697 1.00 0.00 ATOM 1377 CB LEU 201 81.054 -6.639 16.242 1.00 0.00 ATOM 1378 CG LEU 201 82.136 -7.502 15.651 1.00 0.00 ATOM 1379 CD1 LEU 201 82.801 -6.594 14.591 1.00 0.00 ATOM 1380 CD2 LEU 201 83.137 -8.047 16.598 1.00 0.00 ATOM 1381 O LEU 201 78.288 -6.867 17.562 1.00 0.00 ATOM 1382 C LEU 201 79.166 -6.042 17.634 1.00 0.00 ATOM 1383 N ARG 202 78.948 -4.732 17.636 1.00 0.00 ATOM 1384 CA ARG 202 77.591 -4.185 17.639 1.00 0.00 ATOM 1385 CB ARG 202 77.566 -2.786 18.277 1.00 0.00 ATOM 1386 CG ARG 202 77.748 -2.818 19.810 1.00 0.00 ATOM 1387 CD ARG 202 77.966 -1.432 20.434 1.00 0.00 ATOM 1388 NE ARG 202 78.620 -1.538 21.746 1.00 0.00 ATOM 1389 CZ ARG 202 78.008 -1.849 22.886 1.00 0.00 ATOM 1390 NH1 ARG 202 76.699 -2.049 22.918 1.00 0.00 ATOM 1391 NH2 ARG 202 78.721 -1.942 24.001 1.00 0.00 ATOM 1392 O ARG 202 75.658 -4.260 16.196 1.00 0.00 ATOM 1393 C ARG 202 76.892 -4.170 16.266 1.00 0.00 ATOM 1394 N TRP 203 77.677 -4.022 15.194 1.00 0.00 ATOM 1395 CA TRP 203 77.131 -3.944 13.836 1.00 0.00 ATOM 1396 CB TRP 203 76.931 -2.497 13.419 1.00 0.00 ATOM 1397 CG TRP 203 75.650 -1.883 13.911 1.00 0.00 ATOM 1398 CD1 TRP 203 75.519 -0.923 14.907 1.00 0.00 ATOM 1399 CD2 TRP 203 74.320 -2.153 13.443 1.00 0.00 ATOM 1400 CE2 TRP 203 73.440 -1.337 14.199 1.00 0.00 ATOM 1401 CE3 TRP 203 73.779 -2.987 12.432 1.00 0.00 ATOM 1402 NE1 TRP 203 74.201 -0.581 15.054 1.00 0.00 ATOM 1403 CZ2 TRP 203 72.058 -1.322 13.972 1.00 0.00 ATOM 1404 CZ3 TRP 203 72.414 -3.019 12.254 1.00 0.00 ATOM 1405 CH2 TRP 203 71.558 -2.172 13.007 1.00 0.00 ATOM 1406 O TRP 203 79.304 -4.376 12.965 1.00 0.00 ATOM 1407 C TRP 203 78.101 -4.641 12.930 1.00 0.00 ATOM 1408 N TYR 204 77.605 -5.634 12.207 1.00 0.00 ATOM 1409 CA TYR 204 78.425 -6.231 11.141 1.00 0.00 ATOM 1410 CB TYR 204 78.152 -7.738 11.056 1.00 0.00 ATOM 1411 CG TYR 204 78.503 -8.487 12.328 1.00 0.00 ATOM 1412 CD1 TYR 204 79.741 -9.069 12.475 1.00 0.00 ATOM 1413 CD2 TYR 204 77.578 -8.570 13.394 1.00 0.00 ATOM 1414 CE1 TYR 204 80.063 -9.748 13.625 1.00 0.00 ATOM 1415 CE2 TYR 204 77.885 -9.250 14.547 1.00 0.00 ATOM 1416 CZ TYR 204 79.112 -9.814 14.671 1.00 0.00 ATOM 1417 OH TYR 204 79.446 -10.485 15.822 1.00 0.00 ATOM 1418 O TYR 204 76.768 -5.270 9.789 1.00 0.00 ATOM 1419 C TYR 204 77.924 -5.562 9.861 1.00 0.00 ATOM 1420 N SER 205 78.791 -5.326 8.877 1.00 0.00 ATOM 1421 CA SER 205 78.356 -4.738 7.580 1.00 0.00 ATOM 1422 CB SER 205 78.150 -3.204 7.597 1.00 0.00 ATOM 1423 OG SER 205 79.390 -2.508 7.679 1.00 0.00 ATOM 1424 O SER 205 80.396 -5.552 6.619 1.00 0.00 ATOM 1425 C SER 205 79.268 -5.138 6.428 1.00 0.00 ATOM 1426 N CYS 206 78.734 -4.952 5.228 1.00 0.00 ATOM 1427 CA CYS 206 79.487 -5.217 4.015 1.00 0.00 ATOM 1428 CB CYS 206 79.460 -6.742 3.715 1.00 0.00 ATOM 1429 SG CYS 206 80.615 -7.264 2.445 1.00 0.00 ATOM 1430 O CYS 206 77.640 -4.248 2.831 1.00 0.00 ATOM 1431 C CYS 206 78.842 -4.426 2.865 1.00 0.00 ATOM 1432 N MET 207 79.670 -3.914 1.958 1.00 0.00 ATOM 1433 CA MET 207 79.164 -3.246 0.776 1.00 0.00 ATOM 1434 CB MET 207 80.139 -2.167 0.278 1.00 0.00 ATOM 1435 CG MET 207 79.655 -1.551 -1.008 1.00 0.00 ATOM 1436 SD MET 207 80.291 0.081 -1.293 1.00 0.00 ATOM 1437 CE MET 207 81.976 -0.280 -1.705 1.00 0.00 ATOM 1438 O MET 207 79.714 -5.235 -0.507 1.00 0.00 ATOM 1439 C MET 207 78.911 -4.303 -0.317 1.00 0.00 ATOM 1440 N LEU 208 77.798 -4.161 -1.023 1.00 0.00 ATOM 1441 CA LEU 208 77.476 -5.082 -2.110 1.00 0.00 ATOM 1442 CB LEU 208 76.089 -5.671 -1.891 1.00 0.00 ATOM 1443 CG LEU 208 75.822 -6.507 -0.647 1.00 0.00 ATOM 1444 CD1 LEU 208 74.332 -6.810 -0.660 1.00 0.00 ATOM 1445 CD2 LEU 208 76.636 -7.785 -0.585 1.00 0.00 ATOM 1446 O LEU 208 77.075 -3.277 -3.617 1.00 0.00 ATOM 1447 C LEU 208 77.524 -4.391 -3.479 1.00 0.00 ATOM 1448 N GLY 209 78.012 -5.129 -4.470 1.00 0.00 ATOM 1449 CA GLY 209 78.282 -4.644 -5.813 1.00 0.00 ATOM 1450 O GLY 209 77.073 -3.953 -7.727 1.00 0.00 ATOM 1451 C GLY 209 77.107 -4.713 -6.762 1.00 0.00 ATOM 1452 N LYS 210 76.143 -5.605 -6.504 1.00 0.00 ATOM 1453 CA LYS 210 74.844 -5.630 -7.270 1.00 0.00 ATOM 1454 CB LYS 210 74.833 -6.618 -8.450 1.00 0.00 ATOM 1455 CG LYS 210 75.336 -8.018 -8.161 1.00 0.00 ATOM 1456 CD LYS 210 76.858 -8.124 -8.271 1.00 0.00 ATOM 1457 CE LYS 210 77.280 -9.565 -8.489 1.00 0.00 ATOM 1458 NZ LYS 210 77.276 -10.413 -7.247 1.00 0.00 ATOM 1459 O LYS 210 73.662 -6.684 -5.476 1.00 0.00 ATOM 1460 C LYS 210 73.621 -5.863 -6.404 1.00 0.00 ATOM 1461 N CYS 212 71.170 -7.423 -6.677 1.00 0.00 ATOM 1462 CA CYS 212 70.650 -8.782 -6.713 1.00 0.00 ATOM 1463 CB CYS 212 70.610 -9.321 -8.154 1.00 0.00 ATOM 1464 SG CYS 212 72.179 -10.063 -8.771 1.00 0.00 ATOM 1465 O CYS 212 71.100 -10.900 -5.660 1.00 0.00 ATOM 1466 C CYS 212 71.424 -9.719 -5.777 1.00 0.00 ATOM 1467 N SER 213 72.455 -9.198 -5.119 1.00 0.00 ATOM 1468 CA SER 213 73.072 -9.902 -4.011 1.00 0.00 ATOM 1469 CB SER 213 74.463 -9.343 -3.743 1.00 0.00 ATOM 1470 OG SER 213 75.477 -10.132 -4.341 1.00 0.00 ATOM 1471 O SER 213 72.330 -10.638 -1.839 1.00 0.00 ATOM 1472 C SER 213 72.224 -9.793 -2.737 1.00 0.00 ATOM 1473 N LEU 214 71.386 -8.764 -2.672 1.00 0.00 ATOM 1474 CA LEU 214 70.680 -8.392 -1.452 1.00 0.00 ATOM 1475 CB LEU 214 70.071 -6.980 -1.558 1.00 0.00 ATOM 1476 CG LEU 214 70.657 -5.758 -0.825 1.00 0.00 ATOM 1477 CD1 LEU 214 69.850 -4.521 -1.165 1.00 0.00 ATOM 1478 CD2 LEU 214 70.746 -5.914 0.718 1.00 0.00 ATOM 1479 O LEU 214 69.590 -9.705 0.226 1.00 0.00 ATOM 1480 C LEU 214 69.611 -9.366 -0.962 1.00 0.00 ATOM 1481 N ALA 215 68.718 -9.786 -1.852 1.00 0.00 ATOM 1482 CA ALA 215 67.599 -10.653 -1.470 1.00 0.00 ATOM 1483 CB ALA 215 66.604 -10.866 -2.660 1.00 0.00 ATOM 1484 O ALA 215 67.453 -12.365 0.180 1.00 0.00 ATOM 1485 C ALA 215 68.013 -11.991 -0.832 1.00 0.00 ATOM 1486 N PRO 216 68.972 -12.718 -1.428 1.00 0.00 ATOM 1487 CA PRO 216 69.420 -13.949 -0.764 1.00 0.00 ATOM 1488 CB PRO 216 70.392 -14.577 -1.773 1.00 0.00 ATOM 1489 CG PRO 216 70.774 -13.474 -2.698 1.00 0.00 ATOM 1490 CD PRO 216 69.632 -12.515 -2.735 1.00 0.00 ATOM 1491 O PRO 216 70.029 -14.593 1.465 1.00 0.00 ATOM 1492 C PRO 216 70.126 -13.740 0.591 1.00 0.00 ATOM 1493 N LEU 217 70.856 -12.631 0.743 1.00 0.00 ATOM 1494 CA LEU 217 71.571 -12.363 1.980 1.00 0.00 ATOM 1495 CB LEU 217 72.676 -11.303 1.765 1.00 0.00 ATOM 1496 CG LEU 217 73.892 -11.726 0.915 1.00 0.00 ATOM 1497 CD1 LEU 217 74.715 -10.502 0.458 1.00 0.00 ATOM 1498 CD2 LEU 217 74.797 -12.794 1.631 1.00 0.00 ATOM 1499 O LEU 217 70.630 -12.558 4.174 1.00 0.00 ATOM 1500 C LEU 217 70.578 -12.001 3.095 1.00 0.00 ATOM 1501 N LYS 218 69.658 -11.100 2.799 1.00 0.00 ATOM 1502 CA LYS 218 68.507 -10.823 3.658 1.00 0.00 ATOM 1503 CB LYS 218 67.521 -9.920 2.930 1.00 0.00 ATOM 1504 CG LYS 218 67.932 -8.459 2.773 1.00 0.00 ATOM 1505 CD LYS 218 66.657 -7.626 2.600 1.00 0.00 ATOM 1506 CE LYS 218 66.812 -6.576 1.546 1.00 0.00 ATOM 1507 NZ LYS 218 65.562 -6.443 0.716 1.00 0.00 ATOM 1508 O LYS 218 67.452 -12.247 5.273 1.00 0.00 ATOM 1509 C LYS 218 67.748 -12.090 4.101 1.00 0.00 ATOM 1510 N GLU 219 67.418 -12.981 3.159 1.00 0.00 ATOM 1511 CA GLU 219 66.775 -14.237 3.537 1.00 0.00 ATOM 1512 CB GLU 219 66.293 -15.051 2.324 1.00 0.00 ATOM 1513 CG GLU 219 65.416 -16.272 2.696 1.00 0.00 ATOM 1514 CD GLU 219 63.929 -16.093 2.308 1.00 0.00 ATOM 1515 OE1 GLU 219 63.181 -15.419 3.066 1.00 0.00 ATOM 1516 OE2 GLU 219 63.504 -16.637 1.246 1.00 0.00 ATOM 1517 O GLU 219 67.196 -15.788 5.288 1.00 0.00 ATOM 1518 C GLU 219 67.691 -15.102 4.400 1.00 0.00 ATOM 1519 N GLU 220 69.002 -15.099 4.135 1.00 0.00 ATOM 1520 CA GLU 220 69.913 -15.867 4.982 1.00 0.00 ATOM 1521 CB GLU 220 71.318 -15.963 4.402 1.00 0.00 ATOM 1522 CG GLU 220 72.333 -16.378 5.454 1.00 0.00 ATOM 1523 CD GLU 220 73.238 -17.527 5.052 1.00 0.00 ATOM 1524 OE1 GLU 220 72.789 -18.389 4.252 1.00 0.00 ATOM 1525 OE2 GLU 220 74.394 -17.572 5.572 1.00 0.00 ATOM 1526 O GLU 220 69.914 -16.202 7.362 1.00 0.00 ATOM 1527 C GLU 220 69.939 -15.388 6.453 1.00 0.00 ATOM 1528 N LEU 221 69.994 -14.071 6.668 1.00 0.00 ATOM 1529 CA LEU 221 69.843 -13.479 8.018 1.00 0.00 ATOM 1530 CB LEU 221 70.106 -11.965 7.989 1.00 0.00 ATOM 1531 CG LEU 221 71.459 -11.544 7.402 1.00 0.00 ATOM 1532 CD1 LEU 221 71.431 -10.099 6.947 1.00 0.00 ATOM 1533 CD2 LEU 221 72.629 -11.814 8.371 1.00 0.00 ATOM 1534 O LEU 221 68.371 -14.039 9.825 1.00 0.00 ATOM 1535 C LEU 221 68.470 -13.765 8.647 1.00 0.00 ATOM 1536 N ARG 222 67.417 -13.691 7.850 1.00 0.00 ATOM 1537 CA ARG 222 66.077 -13.996 8.356 1.00 0.00 ATOM 1538 CB ARG 222 65.008 -13.783 7.277 1.00 0.00 ATOM 1539 CG ARG 222 63.581 -14.075 7.747 1.00 0.00 ATOM 1540 CD ARG 222 62.578 -14.142 6.590 1.00 0.00 ATOM 1541 NE ARG 222 62.832 -15.282 5.701 1.00 0.00 ATOM 1542 CZ ARG 222 62.185 -16.445 5.750 1.00 0.00 ATOM 1543 NH1 ARG 222 61.218 -16.643 6.638 1.00 0.00 ATOM 1544 NH2 ARG 222 62.506 -17.409 4.900 1.00 0.00 ATOM 1545 O ARG 222 65.405 -15.629 9.995 1.00 0.00 ATOM 1546 C ARG 222 65.999 -15.427 8.927 1.00 0.00 ATOM 1547 N ILE 223 66.614 -16.396 8.235 1.00 0.00 ATOM 1548 CA ILE 223 66.446 -17.804 8.607 1.00 0.00 ATOM 1549 CB ILE 223 66.435 -18.822 7.402 1.00 0.00 ATOM 1550 CG1 ILE 223 67.831 -19.087 6.840 1.00 0.00 ATOM 1551 CG2 ILE 223 65.417 -18.426 6.316 1.00 0.00 ATOM 1552 CD1 ILE 223 67.800 -20.080 5.682 1.00 0.00 ATOM 1553 O ILE 223 67.140 -19.255 10.361 1.00 0.00 ATOM 1554 C ILE 223 67.398 -18.249 9.704 1.00 0.00 ATOM 1555 N GLN 224 68.473 -17.478 9.913 1.00 0.00 ATOM 1556 CA GLN 224 69.376 -17.671 11.064 1.00 0.00 ATOM 1557 CB GLN 224 70.789 -17.188 10.729 1.00 0.00 ATOM 1558 CG GLN 224 71.528 -17.997 9.673 1.00 0.00 ATOM 1559 CD GLN 224 71.773 -19.458 10.069 1.00 0.00 ATOM 1560 OE1 GLN 224 72.309 -20.229 9.276 1.00 0.00 ATOM 1561 NE2 GLN 224 71.391 -19.838 11.290 1.00 0.00 ATOM 1562 O GLN 224 69.454 -17.082 13.400 1.00 0.00 ATOM 1563 C GLN 224 68.864 -16.954 12.334 1.00 0.00 ATOM 1564 N GLY 225 67.784 -16.188 12.195 1.00 0.00 ATOM 1565 CA GLY 225 67.169 -15.489 13.312 1.00 0.00 ATOM 1566 O GLY 225 67.778 -13.852 14.931 1.00 0.00 ATOM 1567 C GLY 225 67.931 -14.268 13.783 1.00 0.00 ATOM 1568 N VAL 226 68.764 -13.692 12.914 1.00 0.00 ATOM 1569 CA VAL 226 69.419 -12.411 13.201 1.00 0.00 ATOM 1570 CB VAL 226 70.395 -12.006 12.055 1.00 0.00 ATOM 1571 CG1 VAL 226 71.008 -10.631 12.305 1.00 0.00 ATOM 1572 CG2 VAL 226 71.481 -13.094 11.891 1.00 0.00 ATOM 1573 O VAL 226 67.503 -11.139 12.548 1.00 0.00 ATOM 1574 C VAL 226 68.342 -11.360 13.426 1.00 0.00 ATOM 1575 N PRO 227 68.316 -10.768 14.638 1.00 0.00 ATOM 1576 CA PRO 227 67.254 -9.889 15.115 1.00 0.00 ATOM 1577 CB PRO 227 67.561 -9.764 16.619 1.00 0.00 ATOM 1578 CG PRO 227 68.955 -10.062 16.753 1.00 0.00 ATOM 1579 CD PRO 227 69.337 -10.997 15.680 1.00 0.00 ATOM 1580 O PRO 227 66.043 -7.973 14.410 1.00 0.00 ATOM 1581 C PRO 227 67.146 -8.514 14.485 1.00 0.00 ATOM 1582 N LYS 228 68.275 -7.949 14.056 1.00 0.00 ATOM 1583 CA LYS 228 68.321 -6.589 13.493 1.00 0.00 ATOM 1584 CB LYS 228 68.989 -5.655 14.502 1.00 0.00 ATOM 1585 CG LYS 228 68.854 -4.175 14.225 1.00 0.00 ATOM 1586 CD LYS 228 68.442 -3.427 15.471 1.00 0.00 ATOM 1587 CE LYS 228 69.468 -3.540 16.592 1.00 0.00 ATOM 1588 NZ LYS 228 69.518 -2.277 17.379 1.00 0.00 ATOM 1589 O LYS 228 70.206 -7.113 12.086 1.00 0.00 ATOM 1590 C LYS 228 69.088 -6.598 12.152 1.00 0.00 ATOM 1591 N VAL 229 68.454 -6.067 11.100 1.00 0.00 ATOM 1592 CA VAL 229 69.011 -6.061 9.728 1.00 0.00 ATOM 1593 CB VAL 229 68.474 -7.238 8.860 1.00 0.00 ATOM 1594 CG1 VAL 229 68.881 -7.095 7.367 1.00 0.00 ATOM 1595 CG2 VAL 229 68.909 -8.607 9.433 1.00 0.00 ATOM 1596 O VAL 229 67.485 -4.309 9.140 1.00 0.00 ATOM 1597 C VAL 229 68.641 -4.741 9.076 1.00 0.00 ATOM 1598 N THR 230 69.630 -4.063 8.497 1.00 0.00 ATOM 1599 CA THR 230 69.320 -2.860 7.732 1.00 0.00 ATOM 1600 CB THR 230 69.407 -1.604 8.582 1.00 0.00 ATOM 1601 CG2 THR 230 70.789 -1.268 8.954 1.00 0.00 ATOM 1602 OG1 THR 230 68.807 -0.517 7.876 1.00 0.00 ATOM 1603 O THR 230 71.111 -3.551 6.276 1.00 0.00 ATOM 1604 C THR 230 70.162 -2.780 6.447 1.00 0.00 ATOM 1605 N TYR 231 69.748 -1.883 5.556 1.00 0.00 ATOM 1606 CA TYR 231 70.433 -1.688 4.277 1.00 0.00 ATOM 1607 CB TYR 231 70.162 -2.861 3.314 1.00 0.00 ATOM 1608 CG TYR 231 68.763 -2.910 2.819 1.00 0.00 ATOM 1609 CD1 TYR 231 68.367 -2.071 1.788 1.00 0.00 ATOM 1610 CD2 TYR 231 67.816 -3.757 3.390 1.00 0.00 ATOM 1611 CE1 TYR 231 67.088 -2.062 1.316 1.00 0.00 ATOM 1612 CE2 TYR 231 66.499 -3.750 2.926 1.00 0.00 ATOM 1613 CZ TYR 231 66.156 -2.905 1.871 1.00 0.00 ATOM 1614 OH TYR 231 64.873 -2.845 1.351 1.00 0.00 ATOM 1615 O TYR 231 69.372 0.480 4.134 1.00 0.00 ATOM 1616 C TYR 231 70.225 -0.274 3.688 1.00 0.00 ATOM 1617 N THR 232 71.068 0.105 2.723 1.00 0.00 ATOM 1618 CA THR 232 71.015 1.464 2.154 1.00 0.00 ATOM 1619 CB THR 232 71.725 2.512 3.053 1.00 0.00 ATOM 1620 CG2 THR 232 73.191 2.289 3.049 1.00 0.00 ATOM 1621 OG1 THR 232 71.458 3.841 2.569 1.00 0.00 ATOM 1622 O THR 232 72.351 0.510 0.437 1.00 0.00 ATOM 1623 C THR 232 71.694 1.478 0.797 1.00 0.00 ATOM 1624 N GLU 233 71.562 2.586 0.075 1.00 0.00 ATOM 1625 CA GLU 233 72.205 2.742 -1.239 1.00 0.00 ATOM 1626 CB GLU 233 71.143 3.112 -2.263 1.00 0.00 ATOM 1627 CG GLU 233 71.635 3.190 -3.710 1.00 0.00 ATOM 1628 CD GLU 233 70.691 3.975 -4.612 1.00 0.00 ATOM 1629 OE1 GLU 233 69.518 4.221 -4.216 1.00 0.00 ATOM 1630 OE2 GLU 233 71.155 4.387 -5.697 1.00 0.00 ATOM 1631 O GLU 233 73.190 4.877 -0.588 1.00 0.00 ATOM 1632 C GLU 233 73.324 3.817 -1.223 1.00 0.00 ATOM 1633 N PHE 234 74.428 3.530 -1.907 1.00 0.00 ATOM 1634 CA PHE 234 75.448 4.511 -2.169 1.00 0.00 ATOM 1635 CB PHE 234 76.836 4.037 -1.730 1.00 0.00 ATOM 1636 CG PHE 234 76.927 3.494 -0.297 1.00 0.00 ATOM 1637 CD1 PHE 234 76.215 4.088 0.762 1.00 0.00 ATOM 1638 CD2 PHE 234 77.795 2.426 -0.019 1.00 0.00 ATOM 1639 CE1 PHE 234 76.334 3.589 2.098 1.00 0.00 ATOM 1640 CE2 PHE 234 77.906 1.894 1.294 1.00 0.00 ATOM 1641 CZ PHE 234 77.182 2.479 2.347 1.00 0.00 ATOM 1642 O PHE 234 75.738 3.832 -4.486 1.00 0.00 ATOM 1643 C PHE 234 75.480 4.748 -3.705 1.00 0.00 ATOM 1644 N CYS 235 75.235 5.979 -4.111 1.00 0.00 ATOM 1645 CA CYS 235 75.218 6.345 -5.520 1.00 0.00 ATOM 1646 CB CYS 235 73.877 6.979 -5.860 1.00 0.00 ATOM 1647 SG CYS 235 73.760 7.404 -7.583 1.00 0.00 ATOM 1648 O CYS 235 76.402 8.384 -5.114 1.00 0.00 ATOM 1649 C CYS 235 76.312 7.363 -5.798 1.00 0.00 ATOM 1650 N GLN 236 77.185 7.043 -6.764 1.00 0.00 ATOM 1651 CA GLN 236 78.158 8.009 -7.254 1.00 0.00 ATOM 1652 CB GLN 236 79.582 7.605 -6.837 1.00 0.00 ATOM 1653 CG GLN 236 79.821 7.763 -5.304 1.00 0.00 ATOM 1654 CD GLN 236 79.507 9.180 -4.806 1.00 0.00 ATOM 1655 OE1 GLN 236 79.667 10.157 -5.550 1.00 0.00 ATOM 1656 NE2 GLN 236 79.047 9.296 -3.555 1.00 0.00 ATOM 1657 O GLN 236 78.603 7.322 -9.485 1.00 0.00 ATOM 1658 C GLN 236 78.003 8.096 -8.768 1.00 0.00 ATOM 1659 N GLY 237 77.158 9.011 -9.229 1.00 0.00 ATOM 1660 CA GLY 237 76.860 9.114 -10.658 1.00 0.00 ATOM 1661 O GLY 237 75.387 7.258 -11.070 1.00 0.00 ATOM 1662 C GLY 237 76.466 7.791 -11.319 1.00 0.00 ATOM 1663 N ARG 238 77.355 7.255 -12.141 1.00 0.00 ATOM 1664 CA ARG 238 77.043 6.086 -12.947 1.00 0.00 ATOM 1665 CB ARG 238 78.095 5.958 -14.071 1.00 0.00 ATOM 1666 CG ARG 238 77.986 4.737 -14.966 1.00 0.00 ATOM 1667 CD ARG 238 78.995 4.781 -16.120 1.00 0.00 ATOM 1668 NE ARG 238 80.378 4.413 -15.773 1.00 0.00 ATOM 1669 CZ ARG 238 81.279 4.018 -16.679 1.00 0.00 ATOM 1670 NH1 ARG 238 80.947 3.933 -17.977 1.00 0.00 ATOM 1671 NH2 ARG 238 82.512 3.713 -16.304 1.00 0.00 ATOM 1672 O ARG 238 76.393 3.795 -12.414 1.00 0.00 ATOM 1673 C ARG 238 77.010 4.827 -12.059 1.00 0.00 ATOM 1674 N THR 239 77.683 4.901 -10.906 1.00 0.00 ATOM 1675 CA THR 239 77.913 3.680 -10.157 1.00 0.00 ATOM 1676 CB THR 239 79.424 3.313 -10.023 1.00 0.00 ATOM 1677 CG2 THR 239 80.260 4.075 -11.018 1.00 0.00 ATOM 1678 OG1 THR 239 79.896 3.596 -8.708 1.00 0.00 ATOM 1679 O THR 239 76.884 4.553 -8.128 1.00 0.00 ATOM 1680 C THR 239 77.092 3.573 -8.857 1.00 0.00 ATOM 1681 N MET 240 76.573 2.374 -8.644 1.00 0.00 ATOM 1682 CA MET 240 75.634 2.123 -7.598 1.00 0.00 ATOM 1683 CB MET 240 74.229 1.961 -8.168 1.00 0.00 ATOM 1684 CG MET 240 73.669 3.328 -8.604 1.00 0.00 ATOM 1685 SD MET 240 71.921 3.239 -8.911 1.00 0.00 ATOM 1686 CE MET 240 71.878 2.770 -10.666 1.00 0.00 ATOM 1687 O MET 240 76.418 -0.128 -7.351 1.00 0.00 ATOM 1688 C MET 240 76.066 0.932 -6.796 1.00 0.00 ATOM 1689 N ARG 241 76.094 1.150 -5.480 1.00 0.00 ATOM 1690 CA ARG 241 76.440 0.136 -4.526 1.00 0.00 ATOM 1691 CB ARG 241 77.791 0.427 -3.887 1.00 0.00 ATOM 1692 CG ARG 241 78.979 0.383 -4.805 1.00 0.00 ATOM 1693 CD ARG 241 79.086 -0.951 -5.544 1.00 0.00 ATOM 1694 NE ARG 241 80.272 -0.921 -6.372 1.00 0.00 ATOM 1695 CZ ARG 241 80.286 -0.713 -7.682 1.00 0.00 ATOM 1696 NH1 ARG 241 79.148 -0.536 -8.359 1.00 0.00 ATOM 1697 NH2 ARG 241 81.452 -0.679 -8.308 1.00 0.00 ATOM 1698 O ARG 241 74.609 1.046 -3.238 1.00 0.00 ATOM 1699 C ARG 241 75.334 0.086 -3.452 1.00 0.00 ATOM 1700 N TRP 242 75.216 -1.069 -2.821 1.00 0.00 ATOM 1701 CA TRP 242 74.274 -1.303 -1.721 1.00 0.00 ATOM 1702 CB TRP 242 73.229 -2.384 -2.108 1.00 0.00 ATOM 1703 CG TRP 242 72.452 -1.825 -3.275 1.00 0.00 ATOM 1704 CD1 TRP 242 71.325 -1.011 -3.225 1.00 0.00 ATOM 1705 CD2 TRP 242 72.856 -1.860 -4.649 1.00 0.00 ATOM 1706 CE2 TRP 242 71.913 -1.097 -5.393 1.00 0.00 ATOM 1707 CE3 TRP 242 73.929 -2.467 -5.328 1.00 0.00 ATOM 1708 NE1 TRP 242 70.992 -0.584 -4.512 1.00 0.00 ATOM 1709 CZ2 TRP 242 72.001 -0.945 -6.794 1.00 0.00 ATOM 1710 CZ3 TRP 242 74.007 -2.330 -6.739 1.00 0.00 ATOM 1711 CH2 TRP 242 73.037 -1.582 -7.450 1.00 0.00 ATOM 1712 O TRP 242 76.329 -2.044 -0.738 1.00 0.00 ATOM 1713 C TRP 242 75.164 -1.678 -0.534 1.00 0.00 ATOM 1714 N ALA 243 74.687 -1.472 0.694 1.00 0.00 ATOM 1715 CA ALA 243 75.409 -2.017 1.839 1.00 0.00 ATOM 1716 CB ALA 243 76.199 -0.954 2.583 1.00 0.00 ATOM 1717 O ALA 243 73.225 -2.158 2.784 1.00 0.00 ATOM 1718 C ALA 243 74.345 -2.628 2.724 1.00 0.00 ATOM 1719 N LEU 244 74.717 -3.704 3.380 1.00 0.00 ATOM 1720 CA LEU 244 73.797 -4.414 4.244 1.00 0.00 ATOM 1721 CB LEU 244 73.716 -5.852 3.710 1.00 0.00 ATOM 1722 CG LEU 244 72.988 -6.947 4.460 1.00 0.00 ATOM 1723 CD1 LEU 244 71.459 -6.653 4.449 1.00 0.00 ATOM 1724 CD2 LEU 244 73.299 -8.286 3.816 1.00 0.00 ATOM 1725 O LEU 244 75.653 -4.613 5.730 1.00 0.00 ATOM 1726 C LEU 244 74.460 -4.425 5.635 1.00 0.00 ATOM 1727 N ALA 245 73.683 -4.302 6.690 1.00 0.00 ATOM 1728 CA ALA 245 74.242 -4.392 8.062 1.00 0.00 ATOM 1729 CB ALA 245 74.540 -3.011 8.624 1.00 0.00 ATOM 1730 O ALA 245 72.055 -5.104 8.734 1.00 0.00 ATOM 1731 C ALA 245 73.267 -5.111 8.981 1.00 0.00 ATOM 1732 N TRP 246 73.815 -5.684 10.058 1.00 0.00 ATOM 1733 CA TRP 246 73.002 -6.516 10.933 1.00 0.00 ATOM 1734 CB TRP 246 72.807 -7.945 10.345 1.00 0.00 ATOM 1735 CG TRP 246 74.052 -8.774 10.157 1.00 0.00 ATOM 1736 CD1 TRP 246 74.509 -9.740 10.999 1.00 0.00 ATOM 1737 CD2 TRP 246 74.971 -8.767 9.019 1.00 0.00 ATOM 1738 CE2 TRP 246 75.956 -9.730 9.287 1.00 0.00 ATOM 1739 CE3 TRP 246 75.049 -8.025 7.810 1.00 0.00 ATOM 1740 NE1 TRP 246 75.654 -10.295 10.500 1.00 0.00 ATOM 1741 CZ2 TRP 246 77.036 -9.987 8.396 1.00 0.00 ATOM 1742 CZ3 TRP 246 76.101 -8.253 6.957 1.00 0.00 ATOM 1743 CH2 TRP 246 77.090 -9.233 7.254 1.00 0.00 ATOM 1744 O TRP 246 74.773 -6.323 12.544 1.00 0.00 ATOM 1745 C TRP 246 73.604 -6.554 12.351 1.00 0.00 ATOM 1746 N SER 247 72.759 -6.883 13.320 1.00 0.00 ATOM 1747 CA SER 247 73.163 -6.881 14.719 1.00 0.00 ATOM 1748 CB SER 247 72.949 -5.492 15.358 1.00 0.00 ATOM 1749 OG SER 247 73.430 -5.474 16.725 1.00 0.00 ATOM 1750 O SER 247 71.213 -8.204 15.209 1.00 0.00 ATOM 1751 C SER 247 72.395 -7.941 15.482 1.00 0.00 ATOM 1752 N PHE 248 73.072 -8.530 16.457 1.00 0.00 ATOM 1753 CA PHE 248 72.433 -9.421 17.432 1.00 0.00 ATOM 1754 CB PHE 248 73.382 -10.568 17.772 1.00 0.00 ATOM 1755 CG PHE 248 73.699 -11.422 16.593 1.00 0.00 ATOM 1756 CD1 PHE 248 72.944 -12.569 16.327 1.00 0.00 ATOM 1757 CD2 PHE 248 74.695 -11.036 15.691 1.00 0.00 ATOM 1758 CE1 PHE 248 73.224 -13.348 15.188 1.00 0.00 ATOM 1759 CE2 PHE 248 74.984 -11.813 14.559 1.00 0.00 ATOM 1760 CZ PHE 248 74.251 -12.952 14.312 1.00 0.00 ATOM 1761 O PHE 248 71.379 -9.382 19.574 1.00 0.00 ATOM 1762 C PHE 248 71.954 -8.726 18.709 1.00 0.00 ATOM 1763 N TYR 249 72.182 -7.418 18.827 1.00 0.00 ATOM 1764 CA TYR 249 71.613 -6.582 19.906 1.00 0.00 ATOM 1765 CB TYR 249 72.378 -5.244 20.016 1.00 0.00 ATOM 1766 CG TYR 249 73.739 -5.402 20.665 1.00 0.00 ATOM 1767 CD1 TYR 249 74.833 -5.860 19.923 1.00 0.00 ATOM 1768 CD2 TYR 249 73.920 -5.157 22.055 1.00 0.00 ATOM 1769 CE1 TYR 249 76.086 -6.059 20.516 1.00 0.00 ATOM 1770 CE2 TYR 249 75.174 -5.348 22.664 1.00 0.00 ATOM 1771 CZ TYR 249 76.244 -5.793 21.887 1.00 0.00 ATOM 1772 OH TYR 249 77.469 -5.997 22.424 1.00 0.00 ATOM 1773 O TYR 249 69.650 -5.972 18.632 1.00 0.00 ATOM 1774 C TYR 249 70.101 -6.335 19.718 1.00 0.00 ATOM 1775 N ASP 250 69.317 -6.544 20.775 1.00 0.00 ATOM 1776 CA ASP 250 67.880 -6.253 20.748 1.00 0.00 ATOM 1777 CB ASP 250 67.092 -7.356 21.475 1.00 0.00 ATOM 1778 CG ASP 250 67.493 -7.476 22.940 1.00 0.00 ATOM 1779 OD1 ASP 250 68.090 -8.511 23.300 1.00 0.00 ATOM 1780 OD2 ASP 250 67.268 -6.510 23.715 1.00 0.00 ATOM 1781 O ASP 250 67.270 -3.905 20.760 1.00 0.00 ATOM 1782 C ASP 250 67.616 -4.896 21.417 1.00 0.00 ENDMDL # command:# Prefix for output files set to decoys/ # command:# request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_609572398.pdb -s /var/tmp/to_scwrl_609572398.seq -o /var/tmp/from_scwrl_609572398.pdb > /var/tmp/scwrl_609572398.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_609572398.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 237 # copying to AlignedFragments data structure # command:# fraction of real conformation used = 1.000 # GDT_score = -43.356 # GDT_score(maxd=8.000,maxw=2.900)= -43.975 # GDT_score(maxd=8.000,maxw=3.200)= -41.444 # GDT_score(maxd=8.000,maxw=3.500)= -39.110 # GDT_score(maxd=10.000,maxw=3.800)= -42.111 # GDT_score(maxd=10.000,maxw=4.000)= -40.640 # GDT_score(maxd=10.000,maxw=4.200)= -39.211 # GDT_score(maxd=12.000,maxw=4.300)= -42.655 # GDT_score(maxd=12.000,maxw=4.500)= -41.225 # GDT_score(maxd=12.000,maxw=4.700)= -39.888 # GDT_score(maxd=14.000,maxw=5.200)= -39.923 # GDT_score(maxd=14.000,maxw=5.500)= -38.113 # command:# request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1792254008.pdb -s /var/tmp/to_scwrl_1792254008.seq -o /var/tmp/from_scwrl_1792254008.pdb > /var/tmp/scwrl_1792254008.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1792254008.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 240 # copying to AlignedFragments data structure # command:# fraction of real conformation used = 1.000 # GDT_score = -42.793 # GDT_score(maxd=8.000,maxw=2.900)= -43.247 # GDT_score(maxd=8.000,maxw=3.200)= -40.750 # GDT_score(maxd=8.000,maxw=3.500)= -38.452 # GDT_score(maxd=10.000,maxw=3.800)= -41.553 # GDT_score(maxd=10.000,maxw=4.000)= -40.051 # GDT_score(maxd=10.000,maxw=4.200)= -38.645 # GDT_score(maxd=12.000,maxw=4.300)= -42.102 # GDT_score(maxd=12.000,maxw=4.500)= -40.694 # GDT_score(maxd=12.000,maxw=4.700)= -39.345 # GDT_score(maxd=14.000,maxw=5.200)= -39.427 # GDT_score(maxd=14.000,maxw=5.500)= -37.628 # command:# request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1809229967.pdb -s /var/tmp/to_scwrl_1809229967.seq -o /var/tmp/from_scwrl_1809229967.pdb > /var/tmp/scwrl_1809229967.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1809229967.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 248 # copying to AlignedFragments data structure # command:# fraction of real conformation used = 1.000 # GDT_score = -41.892 # GDT_score(maxd=8.000,maxw=2.900)= -42.283 # GDT_score(maxd=8.000,maxw=3.200)= -39.842 # GDT_score(maxd=8.000,maxw=3.500)= -37.595 # GDT_score(maxd=10.000,maxw=3.800)= -40.779 # GDT_score(maxd=10.000,maxw=4.000)= -39.340 # GDT_score(maxd=10.000,maxw=4.200)= -37.996 # GDT_score(maxd=12.000,maxw=4.300)= -41.508 # GDT_score(maxd=12.000,maxw=4.500)= -40.146 # GDT_score(maxd=12.000,maxw=4.700)= -38.835 # GDT_score(maxd=14.000,maxw=5.200)= -39.014 # GDT_score(maxd=14.000,maxw=5.500)= -37.252 # command:# request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1065410412.pdb -s /var/tmp/to_scwrl_1065410412.seq -o /var/tmp/from_scwrl_1065410412.pdb > /var/tmp/scwrl_1065410412.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1065410412.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 # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # command:# fraction of real conformation used = 0.730 # GDT_score = -40.315 # GDT_score(maxd=8.000,maxw=2.900)= -39.972 # GDT_score(maxd=8.000,maxw=3.200)= -37.963 # GDT_score(maxd=8.000,maxw=3.500)= -35.890 # GDT_score(maxd=10.000,maxw=3.800)= -38.682 # GDT_score(maxd=10.000,maxw=4.000)= -37.314 # GDT_score(maxd=10.000,maxw=4.200)= -36.001 # GDT_score(maxd=12.000,maxw=4.300)= -39.156 # GDT_score(maxd=12.000,maxw=4.500)= -37.835 # GDT_score(maxd=12.000,maxw=4.700)= -36.551 # GDT_score(maxd=14.000,maxw=5.200)= -36.493 # GDT_score(maxd=14.000,maxw=5.500)= -34.843 # command:# request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_2051065745.pdb -s /var/tmp/to_scwrl_2051065745.seq -o /var/tmp/from_scwrl_2051065745.pdb > /var/tmp/scwrl_2051065745.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2051065745.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 T0293.try1-opt2.pdb looking for model 1 # Found a chain break before 239 # copying to AlignedFragments data structure # command:# fraction of real conformation used = 1.000 # GDT_score = -29.392 # GDT_score(maxd=8.000,maxw=2.900)= -29.767 # GDT_score(maxd=8.000,maxw=3.200)= -28.422 # GDT_score(maxd=8.000,maxw=3.500)= -27.137 # GDT_score(maxd=10.000,maxw=3.800)= -28.835 # GDT_score(maxd=10.000,maxw=4.000)= -27.993 # GDT_score(maxd=10.000,maxw=4.200)= -27.191 # GDT_score(maxd=12.000,maxw=4.300)= -29.319 # GDT_score(maxd=12.000,maxw=4.500)= -28.505 # GDT_score(maxd=12.000,maxw=4.700)= -27.686 # GDT_score(maxd=14.000,maxw=5.200)= -27.949 # GDT_score(maxd=14.000,maxw=5.500)= -26.788 # command:# Prefix for output files set to # command:Warning: Couldn't open file T0293.try1-real.pdb for output Error: Couldn't open file T0293.try1-real.pdb for output superimposing iter= 0 total_weight= 2670.000 rmsd (weighted)= 19.456 (unweighted)= 35.046 superimposing iter= 1 total_weight= 5244.945 rmsd (weighted)= 10.798 (unweighted)= 35.836 superimposing iter= 2 total_weight= 2588.710 rmsd (weighted)= 8.707 (unweighted)= 36.237 superimposing iter= 3 total_weight= 2138.178 rmsd (weighted)= 7.747 (unweighted)= 36.536 superimposing iter= 4 total_weight= 2066.010 rmsd (weighted)= 7.007 (unweighted)= 36.786 superimposing iter= 5 total_weight= 2054.253 rmsd (weighted)= 6.347 (unweighted)= 36.985 EXPDTA T0293.try1-opt2.pdb MODEL 1 REMARK 44 REMARK 44 model 1 is called T0293.try1-opt2.pdb ATOM 1 N VAL A 1 91.938 1.553 21.068 1.00 0.00 ATOM 2 CA VAL A 1 93.025 2.523 21.379 1.00 0.00 ATOM 3 CB VAL A 1 92.463 3.774 22.020 1.00 0.00 ATOM 4 CG1 VAL A 1 93.591 4.718 22.402 1.00 0.00 ATOM 5 CG2 VAL A 1 91.491 4.457 21.067 1.00 0.00 ATOM 6 O VAL A 1 93.469 1.398 23.440 1.00 0.00 ATOM 7 C VAL A 1 93.938 1.871 22.407 1.00 0.00 ATOM 8 N SER A 2 95.228 1.774 22.085 1.00 0.00 ATOM 9 CA SER A 2 96.183 1.187 23.008 1.00 0.00 ATOM 10 CB SER A 2 97.577 1.137 22.377 1.00 0.00 ATOM 11 OG SER A 2 97.604 0.252 21.273 1.00 0.00 ATOM 12 O SER A 2 96.253 1.496 25.364 1.00 0.00 ATOM 13 C SER A 2 96.240 2.024 24.264 1.00 0.00 ATOM 14 N LEU A 3 96.292 3.339 24.090 1.00 0.00 ATOM 15 CA LEU A 3 96.353 4.236 25.244 1.00 0.00 ATOM 16 CB LEU A 3 96.406 5.695 24.786 1.00 0.00 ATOM 17 CG LEU A 3 97.696 6.144 24.098 1.00 0.00 ATOM 18 CD1 LEU A 3 97.546 7.549 23.537 1.00 0.00 ATOM 19 CD2 LEU A 3 98.858 6.146 25.080 1.00 0.00 ATOM 20 O LEU A 3 95.263 3.975 27.352 1.00 0.00 ATOM 21 C LEU A 3 95.136 4.058 26.126 1.00 0.00 ATOM 22 N ASN A 4 93.878 3.965 25.488 1.00 0.00 ATOM 23 CA ASN A 4 92.650 3.801 26.263 1.00 0.00 ATOM 24 CB ASN A 4 91.425 3.865 25.348 1.00 0.00 ATOM 25 CG ASN A 4 91.144 5.269 24.848 1.00 0.00 ATOM 26 ND2 ASN A 4 90.408 5.368 23.747 1.00 0.00 ATOM 27 OD1 ASN A 4 91.585 6.250 25.445 1.00 0.00 ATOM 28 O ASN A 4 92.228 2.359 28.149 1.00 0.00 ATOM 29 C ASN A 4 92.631 2.445 26.993 1.00 0.00 ATOM 30 N PHE A 5 93.072 1.381 26.324 1.00 0.00 ATOM 31 CA PHE A 5 93.089 0.062 26.950 1.00 0.00 ATOM 32 CB PHE A 5 93.634 -0.986 25.977 1.00 0.00 ATOM 33 CG PHE A 5 93.722 -2.367 26.561 1.00 0.00 ATOM 34 CD1 PHE A 5 92.595 -3.166 26.660 1.00 0.00 ATOM 35 CD2 PHE A 5 94.931 -2.868 27.011 1.00 0.00 ATOM 36 CE1 PHE A 5 92.677 -4.436 27.197 1.00 0.00 ATOM 37 CE2 PHE A 5 95.012 -4.138 27.547 1.00 0.00 ATOM 38 CZ PHE A 5 93.892 -4.921 27.642 1.00 0.00 ATOM 39 O PHE A 5 93.601 -0.414 29.247 1.00 0.00 ATOM 40 C PHE A 5 93.983 0.083 28.185 1.00 0.00 ATOM 41 N LYS A 6 95.176 0.659 28.049 1.00 0.00 ATOM 42 CA LYS A 6 96.095 0.709 29.175 1.00 0.00 ATOM 43 CB LYS A 6 97.422 1.329 28.733 1.00 0.00 ATOM 44 CG LYS A 6 98.239 0.446 27.804 1.00 0.00 ATOM 45 CD LYS A 6 99.543 1.121 27.406 1.00 0.00 ATOM 46 CE LYS A 6 100.348 0.250 26.457 1.00 0.00 ATOM 47 NZ LYS A 6 101.612 0.912 26.033 1.00 0.00 ATOM 48 O LYS A 6 95.734 1.156 31.507 1.00 0.00 ATOM 49 C LYS A 6 95.565 1.545 30.339 1.00 0.00 ATOM 50 N ASP A 7 94.901 2.648 30.039 1.00 0.00 ATOM 51 CA ASP A 7 94.346 3.549 31.045 1.00 0.00 ATOM 52 CB ASP A 7 95.064 4.899 31.044 1.00 0.00 ATOM 53 CG ASP A 7 94.505 5.852 32.089 1.00 0.00 ATOM 54 OD1 ASP A 7 93.353 5.646 32.529 1.00 0.00 ATOM 55 OD2 ASP A 7 95.215 6.811 32.457 1.00 0.00 ATOM 56 O ASP A 7 92.677 4.494 29.603 1.00 0.00 ATOM 57 C ASP A 7 92.915 3.728 30.535 1.00 0.00 ATOM 58 N PRO A 8 91.953 2.993 31.121 1.00 0.00 ATOM 59 CA PRO A 8 90.532 3.033 30.749 1.00 0.00 ATOM 60 CB PRO A 8 89.885 2.130 31.795 1.00 0.00 ATOM 61 CG PRO A 8 90.962 1.132 32.080 1.00 0.00 ATOM 62 CD PRO A 8 92.172 2.026 32.213 1.00 0.00 ATOM 63 O PRO A 8 88.929 4.687 30.043 1.00 0.00 ATOM 64 C PRO A 8 89.923 4.439 30.733 1.00 0.00 ATOM 65 N GLU A 9 90.538 5.352 31.478 1.00 0.00 ATOM 66 CA GLU A 9 90.061 6.728 31.577 1.00 0.00 ATOM 67 CB GLU A 9 90.382 7.288 32.969 1.00 0.00 ATOM 68 CG GLU A 9 89.625 6.608 34.104 1.00 0.00 ATOM 69 CD GLU A 9 88.118 6.774 33.983 1.00 0.00 ATOM 70 OE1 GLU A 9 87.645 7.930 33.913 1.00 0.00 ATOM 71 OE2 GLU A 9 87.404 5.747 33.958 1.00 0.00 ATOM 72 O GLU A 9 90.180 8.828 30.408 1.00 0.00 ATOM 73 C GLU A 9 90.616 7.675 30.518 1.00 0.00 ATOM 74 N ALA A 10 91.565 7.182 29.729 1.00 0.00 ATOM 75 CA ALA A 10 92.191 7.996 28.699 1.00 0.00 ATOM 76 CB ALA A 10 93.331 7.234 28.041 1.00 0.00 ATOM 77 O ALA A 10 91.164 9.500 27.129 1.00 0.00 ATOM 78 C ALA A 10 91.178 8.373 27.622 1.00 0.00 ATOM 79 N VAL A 11 90.234 7.359 27.318 1.00 0.00 ATOM 80 CA VAL A 11 89.180 7.575 26.333 1.00 0.00 ATOM 81 CB VAL A 11 88.349 6.291 26.125 1.00 0.00 ATOM 82 CG1 VAL A 11 87.152 6.580 25.216 1.00 0.00 ATOM 83 CG2 VAL A 11 89.228 5.203 25.519 1.00 0.00 ATOM 84 O VAL A 11 87.852 9.563 26.081 1.00 0.00 ATOM 85 C VAL A 11 88.278 8.702 26.844 1.00 0.00 ATOM 86 N ARG A 12 88.014 8.693 28.148 1.00 0.00 ATOM 87 CA ARG A 12 87.157 9.735 28.720 1.00 0.00 ATOM 88 CB ARG A 12 86.818 9.426 30.180 1.00 0.00 ATOM 89 CG ARG A 12 86.013 8.112 30.308 1.00 0.00 ATOM 90 CD ARG A 12 85.452 7.911 31.731 1.00 0.00 ATOM 91 NE ARG A 12 84.408 8.914 32.001 1.00 0.00 ATOM 92 CZ ARG A 12 84.555 10.006 32.755 1.00 0.00 ATOM 93 NH1 ARG A 12 85.700 10.282 33.379 1.00 0.00 ATOM 94 NH2 ARG A 12 83.539 10.864 32.818 1.00 0.00 ATOM 95 O ARG A 12 87.137 12.084 28.223 1.00 0.00 ATOM 96 C ARG A 12 87.800 11.103 28.603 1.00 0.00 ATOM 97 N ALA A 13 89.093 11.187 28.880 1.00 0.00 ATOM 98 CA ALA A 13 89.796 12.458 28.773 1.00 0.00 ATOM 99 CB ALA A 13 91.220 12.301 29.329 1.00 0.00 ATOM 100 O ALA A 13 89.616 14.142 27.044 1.00 0.00 ATOM 101 C ALA A 13 89.822 12.948 27.324 1.00 0.00 ATOM 102 N LEU A 14 90.083 12.049 26.391 1.00 0.00 ATOM 103 CA LEU A 14 90.135 12.431 24.979 1.00 0.00 ATOM 104 CB LEU A 14 90.646 11.254 24.165 1.00 0.00 ATOM 105 CG LEU A 14 92.129 10.944 24.391 1.00 0.00 ATOM 106 CD1 LEU A 14 92.481 9.603 23.803 1.00 0.00 ATOM 107 CD2 LEU A 14 92.987 12.007 23.728 1.00 0.00 ATOM 108 O LEU A 14 88.702 13.847 23.731 1.00 0.00 ATOM 109 C LEU A 14 88.776 12.876 24.490 1.00 0.00 ATOM 110 N THR A 15 87.704 12.195 24.905 1.00 0.00 ATOM 111 CA THR A 15 86.379 12.588 24.476 1.00 0.00 ATOM 112 CB THR A 15 85.301 11.642 25.034 1.00 0.00 ATOM 113 CG2 THR A 15 83.916 12.099 24.605 1.00 0.00 ATOM 114 OG1 THR A 15 85.524 10.314 24.541 1.00 0.00 ATOM 115 O THR A 15 85.669 14.869 24.203 1.00 0.00 ATOM 116 C THR A 15 86.118 14.014 24.964 1.00 0.00 ATOM 117 N CYS A 16 86.397 14.281 26.263 1.00 0.00 ATOM 118 CA CYS A 16 86.163 15.602 26.824 1.00 0.00 ATOM 119 CB CYS A 16 86.667 15.641 28.269 1.00 0.00 ATOM 120 SG CYS A 16 85.731 14.602 29.414 1.00 0.00 ATOM 121 O CYS A 16 86.417 17.772 25.722 1.00 0.00 ATOM 122 C CYS A 16 86.939 16.699 26.045 1.00 0.00 ATOM 123 N THR A 17 88.198 16.415 25.734 1.00 0.00 ATOM 124 CA THR A 17 89.074 17.387 25.102 1.00 0.00 ATOM 125 CB THR A 17 90.548 16.945 25.168 1.00 0.00 ATOM 126 CG2 THR A 17 91.442 17.963 24.475 1.00 0.00 ATOM 127 OG1 THR A 17 90.954 16.828 26.537 1.00 0.00 ATOM 128 O THR A 17 88.973 18.715 23.071 1.00 0.00 ATOM 129 C THR A 17 88.753 17.615 23.611 1.00 0.00 ATOM 130 N LEU A 18 88.199 16.592 22.964 1.00 0.00 ATOM 131 CA LEU A 18 87.959 16.613 21.515 1.00 0.00 ATOM 132 CB LEU A 18 87.464 15.249 21.034 1.00 0.00 ATOM 133 CG LEU A 18 88.459 14.092 21.134 1.00 0.00 ATOM 134 CD1 LEU A 18 87.801 12.779 20.738 1.00 0.00 ATOM 135 CD2 LEU A 18 89.648 14.324 20.214 1.00 0.00 ATOM 136 O LEU A 18 86.906 18.004 19.895 1.00 0.00 ATOM 137 C LEU A 18 86.917 17.634 21.068 1.00 0.00 ATOM 138 N LEU A 19 86.027 18.028 21.985 1.00 0.00 ATOM 139 CA LEU A 19 84.957 18.983 21.665 1.00 0.00 ATOM 140 CB LEU A 19 84.031 19.172 22.869 1.00 0.00 ATOM 141 CG LEU A 19 83.186 17.961 23.271 1.00 0.00 ATOM 142 CD1 LEU A 19 82.419 18.243 24.553 1.00 0.00 ATOM 143 CD2 LEU A 19 82.180 17.623 22.180 1.00 0.00 ATOM 144 O LEU A 19 85.009 21.005 20.378 1.00 0.00 ATOM 145 C LEU A 19 85.562 20.316 21.230 1.00 0.00 ATOM 146 N ARG A 20 86.681 20.670 21.779 1.00 0.00 ATOM 147 CA ARG A 20 87.350 21.911 21.404 1.00 0.00 ATOM 148 CB ARG A 20 88.185 22.419 22.582 1.00 0.00 ATOM 149 CG ARG A 20 87.365 22.791 23.807 1.00 0.00 ATOM 150 CD ARG A 20 88.253 23.302 24.930 1.00 0.00 ATOM 151 NE ARG A 20 87.480 23.674 26.113 1.00 0.00 ATOM 152 CZ ARG A 20 88.017 24.036 27.273 1.00 0.00 ATOM 153 NH1 ARG A 20 87.235 24.357 28.294 1.00 0.00 ATOM 154 NH2 ARG A 20 89.335 24.077 27.409 1.00 0.00 ATOM 155 O ARG A 20 88.244 22.675 19.323 1.00 0.00 ATOM 156 C ARG A 20 88.226 21.780 20.156 1.00 0.00 ATOM 157 N GLU A 21 89.068 20.621 20.161 1.00 0.00 ATOM 158 CA GLU A 21 90.008 20.425 19.059 1.00 0.00 ATOM 159 CB GLU A 21 90.982 19.274 19.322 1.00 0.00 ATOM 160 CG GLU A 21 91.904 19.501 20.509 1.00 0.00 ATOM 161 CD GLU A 21 92.809 18.315 20.778 1.00 0.00 ATOM 162 OE1 GLU A 21 92.674 17.293 20.073 1.00 0.00 ATOM 163 OE2 GLU A 21 93.655 18.408 21.692 1.00 0.00 ATOM 164 O GLU A 21 89.812 20.720 16.694 1.00 0.00 ATOM 165 C GLU A 21 89.365 20.170 17.699 1.00 0.00 ATOM 166 N ASP A 22 88.305 19.372 17.670 1.00 0.00 ATOM 167 CA ASP A 22 87.704 18.998 16.390 1.00 0.00 ATOM 168 CB ASP A 22 86.541 18.027 16.608 1.00 0.00 ATOM 169 CG ASP A 22 87.006 16.643 17.013 1.00 0.00 ATOM 170 OD1 ASP A 22 88.218 16.365 16.897 1.00 0.00 ATOM 171 OD2 ASP A 22 86.160 15.834 17.450 1.00 0.00 ATOM 172 O ASP A 22 86.992 19.912 14.285 1.00 0.00 ATOM 173 C ASP A 22 87.013 20.035 15.511 1.00 0.00 ATOM 174 N PHE A 23 86.444 21.006 16.161 1.00 0.00 ATOM 175 CA PHE A 23 85.710 22.049 15.450 1.00 0.00 ATOM 176 CB PHE A 23 85.230 23.156 16.389 1.00 0.00 ATOM 177 CG PHE A 23 84.484 24.259 15.694 1.00 0.00 ATOM 178 CD1 PHE A 23 83.153 24.104 15.351 1.00 0.00 ATOM 179 CD2 PHE A 23 85.115 25.452 15.382 1.00 0.00 ATOM 180 CE1 PHE A 23 82.467 25.120 14.711 1.00 0.00 ATOM 181 CE2 PHE A 23 84.429 26.466 14.743 1.00 0.00 ATOM 182 CZ PHE A 23 83.111 26.304 14.407 1.00 0.00 ATOM 183 O PHE A 23 86.205 22.782 13.209 1.00 0.00 ATOM 184 C PHE A 23 86.557 22.782 14.390 1.00 0.00 ATOM 185 N GLY A 24 87.689 23.376 14.814 1.00 0.00 ATOM 186 CA GLY A 24 88.534 24.087 13.871 1.00 0.00 ATOM 187 O GLY A 24 89.297 23.574 11.668 1.00 0.00 ATOM 188 C GLY A 24 89.058 23.140 12.792 1.00 0.00 ATOM 189 N LEU A 25 89.240 21.862 13.129 1.00 0.00 ATOM 190 CA LEU A 25 89.737 20.894 12.169 1.00 0.00 ATOM 191 CB LEU A 25 90.383 19.708 12.890 1.00 0.00 ATOM 192 CG LEU A 25 91.630 20.016 13.721 1.00 0.00 ATOM 193 CD1 LEU A 25 92.099 18.776 14.465 1.00 0.00 ATOM 194 CD2 LEU A 25 92.765 20.496 12.830 1.00 0.00 ATOM 195 O LEU A 25 88.926 19.623 10.314 1.00 0.00 ATOM 196 C LEU A 25 88.635 20.339 11.275 1.00 0.00 ATOM 197 N SER A 26 87.369 20.649 11.578 1.00 0.00 ATOM 198 CA SER A 26 86.287 20.047 10.790 1.00 0.00 ATOM 199 CB SER A 26 84.923 20.483 11.332 1.00 0.00 ATOM 200 OG SER A 26 84.722 21.873 11.147 1.00 0.00 ATOM 201 O SER A 26 85.903 19.744 8.442 1.00 0.00 ATOM 202 C SER A 26 86.375 20.471 9.325 1.00 0.00 ATOM 203 N ILE A 27 86.984 21.685 8.998 1.00 0.00 ATOM 204 CA ILE A 27 87.145 22.089 7.596 1.00 0.00 ATOM 205 CB ILE A 27 87.831 23.463 7.479 1.00 0.00 ATOM 206 CG1 ILE A 27 87.629 24.043 6.078 1.00 0.00 ATOM 207 CG2 ILE A 27 89.324 23.335 7.737 1.00 0.00 ATOM 208 CD1 ILE A 27 87.993 25.507 5.964 1.00 0.00 ATOM 209 O ILE A 27 87.741 20.893 5.582 1.00 0.00 ATOM 210 C ILE A 27 87.933 21.036 6.791 1.00 0.00 ATOM 211 N ASP A 28 88.758 20.289 7.466 1.00 0.00 ATOM 212 CA ASP A 28 89.562 19.249 6.802 1.00 0.00 ATOM 213 CB ASP A 28 90.711 18.813 7.714 1.00 0.00 ATOM 214 CG ASP A 28 91.775 19.883 7.865 1.00 0.00 ATOM 215 OD1 ASP A 28 91.763 20.849 7.071 1.00 0.00 ATOM 216 OD2 ASP A 28 92.620 19.757 8.776 1.00 0.00 ATOM 217 O ASP A 28 89.175 17.229 5.596 1.00 0.00 ATOM 218 C ASP A 28 88.760 18.013 6.445 1.00 0.00 ATOM 219 N ILE A 29 87.617 17.840 7.129 1.00 0.00 ATOM 220 CA ILE A 29 86.914 16.577 7.000 1.00 0.00 ATOM 221 CB ILE A 29 85.703 16.505 7.947 1.00 0.00 ATOM 222 CG1 ILE A 29 86.167 16.463 9.404 1.00 0.00 ATOM 223 CG2 ILE A 29 84.880 15.258 7.667 1.00 0.00 ATOM 224 CD1 ILE A 29 85.049 16.658 10.407 1.00 0.00 ATOM 225 O ILE A 29 86.430 15.308 5.019 1.00 0.00 ATOM 226 C ILE A 29 86.413 16.414 5.560 1.00 0.00 ATOM 227 N PRO A 30 85.960 17.497 4.941 1.00 0.00 ATOM 228 CA PRO A 30 85.488 17.448 3.550 1.00 0.00 ATOM 229 CB PRO A 30 85.140 18.902 3.227 1.00 0.00 ATOM 230 CG PRO A 30 84.748 19.493 4.540 1.00 0.00 ATOM 231 CD PRO A 30 85.692 18.915 5.556 1.00 0.00 ATOM 232 O PRO A 30 86.382 16.009 1.798 1.00 0.00 ATOM 233 C PRO A 30 86.603 16.919 2.638 1.00 0.00 ATOM 234 N LEU A 31 87.818 17.446 2.819 1.00 0.00 ATOM 235 CA LEU A 31 88.948 16.996 2.002 1.00 0.00 ATOM 236 CB LEU A 31 90.203 17.811 2.326 1.00 0.00 ATOM 237 CG LEU A 31 90.188 19.279 1.895 1.00 0.00 ATOM 238 CD1 LEU A 31 91.415 20.006 2.423 1.00 0.00 ATOM 239 CD2 LEU A 31 90.183 19.394 0.378 1.00 0.00 ATOM 240 O LEU A 31 89.748 14.823 1.386 1.00 0.00 ATOM 241 C LEU A 31 89.245 15.533 2.275 1.00 0.00 ATOM 242 N GLU A 32 88.963 15.001 3.556 1.00 0.00 ATOM 243 CA GLU A 32 89.208 13.604 3.880 1.00 0.00 ATOM 244 CB GLU A 32 88.973 13.351 5.370 1.00 0.00 ATOM 245 CG GLU A 32 90.015 13.983 6.280 1.00 0.00 ATOM 246 CD GLU A 32 89.700 13.789 7.750 1.00 0.00 ATOM 247 OE1 GLU A 32 88.633 13.217 8.058 1.00 0.00 ATOM 248 OE2 GLU A 32 90.519 14.211 8.593 1.00 0.00 ATOM 249 O GLU A 32 88.609 11.495 2.907 1.00 0.00 ATOM 250 C GLU A 32 88.286 12.663 3.099 1.00 0.00 ATOM 251 N ARG A 33 87.106 13.144 2.692 1.00 0.00 ATOM 252 CA ARG A 33 86.183 12.285 1.949 1.00 0.00 ATOM 253 CB ARG A 33 84.756 12.656 2.175 1.00 0.00 ATOM 254 CG ARG A 33 84.301 12.334 3.589 1.00 0.00 ATOM 255 CD ARG A 33 82.982 13.001 3.902 1.00 0.00 ATOM 256 NE ARG A 33 83.108 14.457 3.880 1.00 0.00 ATOM 257 CZ ARG A 33 82.086 15.293 4.016 1.00 0.00 ATOM 258 NH1 ARG A 33 82.285 16.604 3.988 1.00 0.00 ATOM 259 NH2 ARG A 33 80.859 14.817 4.182 1.00 0.00 ATOM 260 O ARG A 33 86.316 11.426 -0.287 1.00 0.00 ATOM 261 C ARG A 33 86.515 12.370 0.455 1.00 0.00 ATOM 262 N LEU A 34 87.023 13.495 0.004 1.00 0.00 ATOM 263 CA LEU A 34 87.413 13.640 -1.397 1.00 0.00 ATOM 264 CB LEU A 34 87.992 15.034 -1.650 1.00 0.00 ATOM 265 CG LEU A 34 87.003 16.200 -1.594 1.00 0.00 ATOM 266 CD1 LEU A 34 87.737 17.530 -1.669 1.00 0.00 ATOM 267 CD2 LEU A 34 86.024 16.130 -2.756 1.00 0.00 ATOM 268 O LEU A 34 88.379 12.129 -3.018 1.00 0.00 ATOM 269 C LEU A 34 88.482 12.686 -1.919 1.00 0.00 ATOM 270 N ILE A 35 89.519 12.542 -1.150 1.00 0.00 ATOM 271 CA ILE A 35 90.608 11.642 -1.543 1.00 0.00 ATOM 272 CB ILE A 35 91.772 11.718 -0.580 1.00 0.00 ATOM 273 CG1 ILE A 35 92.409 13.118 -0.708 1.00 0.00 ATOM 274 CG2 ILE A 35 92.748 10.602 -0.820 1.00 0.00 ATOM 275 CD1 ILE A 35 93.528 13.416 0.280 1.00 0.00 ATOM 276 O ILE A 35 90.407 9.539 -2.658 1.00 0.00 ATOM 277 C ILE A 35 90.204 10.192 -1.645 1.00 0.00 ATOM 278 N PRO A 36 89.560 9.618 -0.522 1.00 0.00 ATOM 279 CA PRO A 36 89.144 8.246 -0.581 1.00 0.00 ATOM 280 CB PRO A 36 88.543 8.031 0.831 1.00 0.00 ATOM 281 CG PRO A 36 89.415 8.906 1.674 1.00 0.00 ATOM 282 CD PRO A 36 89.509 10.165 0.834 1.00 0.00 ATOM 283 O PRO A 36 88.151 6.921 -2.312 1.00 0.00 ATOM 284 C PRO A 36 88.165 8.006 -1.730 1.00 0.00 ATOM 285 N THR A 37 87.254 8.954 -2.012 1.00 0.00 ATOM 286 CA THR A 37 86.270 8.675 -3.049 1.00 0.00 ATOM 287 CB THR A 37 85.228 9.806 -3.056 1.00 0.00 ATOM 288 CG2 THR A 37 84.173 9.743 -4.188 1.00 0.00 ATOM 289 OG1 THR A 37 84.619 9.833 -1.800 1.00 0.00 ATOM 290 O THR A 37 86.572 7.715 -5.265 1.00 0.00 ATOM 291 C THR A 37 86.946 8.545 -4.426 1.00 0.00 ATOM 292 N VAL A 38 88.002 9.324 -4.688 1.00 0.00 ATOM 293 CA VAL A 38 88.659 9.144 -5.973 1.00 0.00 ATOM 294 CB VAL A 38 89.698 10.243 -6.190 1.00 0.00 ATOM 295 CG1 VAL A 38 90.481 9.922 -7.457 1.00 0.00 ATOM 296 CG2 VAL A 38 88.955 11.545 -6.424 1.00 0.00 ATOM 297 O VAL A 38 89.355 7.091 -7.017 1.00 0.00 ATOM 298 C VAL A 38 89.338 7.792 -6.021 1.00 0.00 ATOM 299 N PRO A 39 89.961 7.380 -4.929 1.00 0.00 ATOM 300 CA PRO A 39 90.637 6.088 -4.911 1.00 0.00 ATOM 301 CB PRO A 39 91.326 6.059 -3.559 1.00 0.00 ATOM 302 CG PRO A 39 91.642 7.499 -3.321 1.00 0.00 ATOM 303 CD PRO A 39 90.351 8.166 -3.727 1.00 0.00 ATOM 304 O PRO A 39 89.835 4.092 -5.988 1.00 0.00 ATOM 305 C PRO A 39 89.624 4.967 -5.143 1.00 0.00 ATOM 306 N LEU A 40 88.519 5.000 -4.402 1.00 0.00 ATOM 307 CA LEU A 40 87.472 3.992 -4.538 1.00 0.00 ATOM 308 CB LEU A 40 86.306 4.300 -3.596 1.00 0.00 ATOM 309 CG LEU A 40 85.124 3.331 -3.640 1.00 0.00 ATOM 310 CD1 LEU A 40 85.561 1.931 -3.238 1.00 0.00 ATOM 311 CD2 LEU A 40 84.025 3.779 -2.689 1.00 0.00 ATOM 312 O LEU A 40 86.803 2.883 -6.557 1.00 0.00 ATOM 313 C LEU A 40 86.933 3.955 -5.965 1.00 0.00 ATOM 314 N ARG A 41 86.628 5.126 -6.515 1.00 0.00 ATOM 315 CA ARG A 41 86.099 5.214 -7.871 1.00 0.00 ATOM 316 CB ARG A 41 85.630 6.628 -8.175 1.00 0.00 ATOM 317 CG ARG A 41 85.263 6.844 -9.615 1.00 0.00 ATOM 318 CD ARG A 41 84.703 8.272 -9.912 1.00 0.00 ATOM 319 NE ARG A 41 84.258 8.429 -11.300 1.00 0.00 ATOM 320 CZ ARG A 41 85.004 8.875 -12.301 1.00 0.00 ATOM 321 NH1 ARG A 41 86.253 9.225 -12.105 1.00 0.00 ATOM 322 NH2 ARG A 41 84.507 8.930 -13.523 1.00 0.00 ATOM 323 O ARG A 41 86.734 4.084 -9.885 1.00 0.00 ATOM 324 C ARG A 41 87.110 4.723 -8.902 1.00 0.00 ATOM 325 N LEU A 42 88.388 5.017 -8.687 1.00 0.00 ATOM 326 CA LEU A 42 89.416 4.563 -9.618 1.00 0.00 ATOM 327 CB LEU A 42 90.796 5.049 -9.170 1.00 0.00 ATOM 328 CG LEU A 42 91.978 4.632 -10.045 1.00 0.00 ATOM 329 CD1 LEU A 42 91.831 5.195 -11.451 1.00 0.00 ATOM 330 CD2 LEU A 42 93.287 5.144 -9.463 1.00 0.00 ATOM 331 O LEU A 42 89.435 2.440 -10.743 1.00 0.00 ATOM 332 C LEU A 42 89.417 3.037 -9.667 1.00 0.00 ATOM 333 N ASN A 43 89.358 2.426 -8.488 1.00 0.00 ATOM 334 CA ASN A 43 89.342 0.970 -8.406 1.00 0.00 ATOM 335 CB ASN A 43 89.612 0.536 -6.968 1.00 0.00 ATOM 336 CG ASN A 43 91.085 0.539 -6.664 1.00 0.00 ATOM 337 ND2 ASN A 43 91.588 1.591 -5.967 1.00 0.00 ATOM 338 OD1 ASN A 43 91.779 -0.401 -7.043 1.00 0.00 ATOM 339 O ASN A 43 88.170 -0.681 -9.724 1.00 0.00 ATOM 340 C ASN A 43 88.094 0.332 -9.007 1.00 0.00 ATOM 341 N TYR A 44 86.960 0.977 -8.771 1.00 0.00 ATOM 342 CA TYR A 44 85.696 0.555 -9.377 1.00 0.00 ATOM 343 CB TYR A 44 84.582 1.495 -8.914 1.00 0.00 ATOM 344 CG TYR A 44 83.207 1.161 -9.459 1.00 0.00 ATOM 345 CD1 TYR A 44 82.376 0.257 -8.779 1.00 0.00 ATOM 346 CD2 TYR A 44 82.727 1.755 -10.634 1.00 0.00 ATOM 347 CE1 TYR A 44 81.103 -0.054 -9.253 1.00 0.00 ATOM 348 CE2 TYR A 44 81.443 1.456 -11.104 1.00 0.00 ATOM 349 CZ TYR A 44 80.658 0.549 -10.408 1.00 0.00 ATOM 350 OH TYR A 44 79.411 0.249 -10.863 1.00 0.00 ATOM 351 O TYR A 44 85.403 -0.394 -11.574 1.00 0.00 ATOM 352 C TYR A 44 85.806 0.569 -10.905 1.00 0.00 ATOM 353 N ILE A 45 86.369 1.657 -11.437 1.00 0.00 ATOM 354 CA ILE A 45 86.548 1.813 -12.874 1.00 0.00 ATOM 355 CB ILE A 45 87.066 3.229 -13.203 1.00 0.00 ATOM 356 CG1 ILE A 45 85.983 4.268 -12.902 1.00 0.00 ATOM 357 CG2 ILE A 45 87.499 3.320 -14.657 1.00 0.00 ATOM 358 CD1 ILE A 45 86.493 5.722 -12.886 1.00 0.00 ATOM 359 O ILE A 45 87.140 0.112 -14.440 1.00 0.00 ATOM 360 C ILE A 45 87.481 0.747 -13.427 1.00 0.00 ATOM 361 N HIS A 46 88.583 0.540 -12.774 1.00 0.00 ATOM 362 CA HIS A 46 89.532 -0.480 -13.194 1.00 0.00 ATOM 363 CB HIS A 46 90.678 -0.594 -12.187 1.00 0.00 ATOM 364 CG HIS A 46 91.670 -1.664 -12.520 1.00 0.00 ATOM 365 CD2 HIS A 46 91.981 -2.989 -12.003 1.00 0.00 ATOM 366 ND1 HIS A 46 92.592 -1.536 -13.537 1.00 0.00 ATOM 367 CE1 HIS A 46 93.340 -2.651 -13.593 1.00 0.00 ATOM 368 NE2 HIS A 46 92.979 -3.527 -12.675 1.00 0.00 ATOM 369 O HIS A 46 89.064 -2.543 -14.302 1.00 0.00 ATOM 370 C HIS A 46 88.879 -1.844 -13.309 1.00 0.00 ATOM 371 N TRP A 47 88.122 -2.221 -12.284 1.00 0.00 ATOM 372 CA TRP A 47 87.457 -3.520 -12.256 1.00 0.00 ATOM 373 CB TRP A 47 86.892 -3.804 -10.863 1.00 0.00 ATOM 374 CG TRP A 47 87.946 -3.984 -9.814 1.00 0.00 ATOM 375 CD1 TRP A 47 89.295 -4.039 -10.009 1.00 0.00 ATOM 376 CD2 TRP A 47 87.737 -4.134 -8.404 1.00 0.00 ATOM 377 CE2 TRP A 47 89.004 -4.275 -7.807 1.00 0.00 ATOM 378 CE3 TRP A 47 86.601 -4.164 -7.588 1.00 0.00 ATOM 379 NE1 TRP A 47 89.941 -4.214 -8.809 1.00 0.00 ATOM 380 CZ2 TRP A 47 89.170 -4.443 -6.432 1.00 0.00 ATOM 381 CZ3 TRP A 47 86.769 -4.330 -6.227 1.00 0.00 ATOM 382 CH2 TRP A 47 88.040 -4.468 -5.660 1.00 0.00 ATOM 383 O TRP A 47 85.946 -4.406 -13.917 1.00 0.00 ATOM 384 C TRP A 47 86.230 -3.455 -13.185 1.00 0.00 ATOM 385 N VAL A 48 85.237 -2.157 -13.211 1.00 0.00 ATOM 386 CA VAL A 48 84.032 -2.034 -14.058 1.00 0.00 ATOM 387 CB VAL A 48 83.214 -0.740 -13.894 1.00 0.00 ATOM 388 CG1 VAL A 48 83.908 0.421 -14.593 1.00 0.00 ATOM 389 CG2 VAL A 48 81.828 -0.905 -14.499 1.00 0.00 ATOM 390 O VAL A 48 83.569 -2.883 -16.249 1.00 0.00 ATOM 391 C VAL A 48 84.324 -2.216 -15.544 1.00 0.00 ATOM 392 N GLU A 49 85.428 -1.650 -16.013 1.00 0.00 ATOM 393 CA GLU A 49 85.763 -1.742 -17.428 1.00 0.00 ATOM 394 CB GLU A 49 86.160 -0.369 -17.974 1.00 0.00 ATOM 395 CG GLU A 49 85.060 0.676 -17.887 1.00 0.00 ATOM 396 CD GLU A 49 85.492 2.023 -18.433 1.00 0.00 ATOM 397 OE1 GLU A 49 86.655 2.142 -18.873 1.00 0.00 ATOM 398 OE2 GLU A 49 84.666 2.961 -18.420 1.00 0.00 ATOM 399 O GLU A 49 87.018 -3.030 -18.993 1.00 0.00 ATOM 400 C GLU A 49 86.914 -2.662 -17.829 1.00 0.00 ATOM 401 N ASP A 50 87.776 -3.038 -16.890 1.00 0.00 ATOM 402 CA ASP A 50 88.905 -3.896 -17.242 1.00 0.00 ATOM 403 CB ASP A 50 90.225 -3.237 -16.838 1.00 0.00 ATOM 404 CG ASP A 50 91.433 -4.055 -17.248 1.00 0.00 ATOM 405 OD1 ASP A 50 91.244 -5.180 -17.757 1.00 0.00 ATOM 406 OD2 ASP A 50 92.570 -3.572 -17.059 1.00 0.00 ATOM 407 O ASP A 50 88.748 -6.282 -17.269 1.00 0.00 ATOM 408 C ASP A 50 88.912 -5.274 -16.588 1.00 0.00 ATOM 409 N LEU A 51 89.080 -5.324 -15.270 1.00 0.00 ATOM 410 CA LEU A 51 89.106 -6.606 -14.573 1.00 0.00 ATOM 411 CB LEU A 51 90.540 -6.977 -14.188 1.00 0.00 ATOM 412 CG LEU A 51 90.714 -8.268 -13.385 1.00 0.00 ATOM 413 CD1 LEU A 51 90.329 -9.477 -14.224 1.00 0.00 ATOM 414 CD2 LEU A 51 92.159 -8.437 -12.945 1.00 0.00 ATOM 415 O LEU A 51 88.415 -5.656 -12.491 1.00 0.00 ATOM 416 C LEU A 51 88.286 -6.577 -13.296 1.00 0.00 ATOM 417 N ILE A 52 87.452 -7.603 -13.122 1.00 0.00 ATOM 418 CA ILE A 52 86.636 -7.700 -11.914 1.00 0.00 ATOM 419 CB ILE A 52 85.308 -8.430 -12.191 1.00 0.00 ATOM 420 CG1 ILE A 52 84.500 -7.680 -13.252 1.00 0.00 ATOM 421 CG2 ILE A 52 84.475 -8.517 -10.922 1.00 0.00 ATOM 422 CD1 ILE A 52 83.282 -8.436 -13.738 1.00 0.00 ATOM 423 O ILE A 52 87.616 -9.686 -11.008 1.00 0.00 ATOM 424 C ILE A 52 87.433 -8.477 -10.875 1.00 0.00 ATOM 425 N GLY A 53 87.900 -7.784 -9.844 1.00 0.00 ATOM 426 CA GLY A 53 88.653 -8.449 -8.804 1.00 0.00 ATOM 427 O GLY A 53 87.955 -10.458 -7.710 1.00 0.00 ATOM 428 C GLY A 53 87.720 -9.271 -7.941 1.00 0.00 ATOM 429 N HIS A 54 86.658 -8.644 -7.460 1.00 0.00 ATOM 430 CA HIS A 54 85.678 -9.321 -6.620 1.00 0.00 ATOM 431 CB HIS A 54 86.334 -9.799 -5.312 1.00 0.00 ATOM 432 CG HIS A 54 86.864 -8.686 -4.464 1.00 0.00 ATOM 433 CD2 HIS A 54 86.312 -8.022 -3.421 1.00 0.00 ATOM 434 ND1 HIS A 54 88.102 -8.116 -4.667 1.00 0.00 ATOM 435 CE1 HIS A 54 88.290 -7.149 -3.787 1.00 0.00 ATOM 436 NE2 HIS A 54 87.218 -7.071 -3.018 1.00 0.00 ATOM 437 O HIS A 54 84.500 -7.220 -6.644 1.00 0.00 ATOM 438 C HIS A 54 84.459 -8.422 -6.428 1.00 0.00 ATOM 439 N GLN A 55 83.351 -9.124 -5.799 1.00 0.00 ATOM 440 CA GLN A 55 82.136 -8.365 -5.599 1.00 0.00 ATOM 441 CB GLN A 55 81.337 -9.362 -4.454 1.00 0.00 ATOM 442 CG GLN A 55 81.891 -10.747 -4.204 1.00 0.00 ATOM 443 CD GLN A 55 81.433 -11.715 -5.279 1.00 0.00 ATOM 444 OE1 GLN A 55 82.269 -12.357 -5.913 1.00 0.00 ATOM 445 NE2 GLN A 55 80.119 -11.790 -5.442 1.00 0.00 ATOM 446 O GLN A 55 81.674 -6.105 -4.957 1.00 0.00 ATOM 447 C GLN A 55 82.305 -7.131 -4.715 1.00 0.00 ATOM 448 N ASP A 56 83.142 -7.226 -3.686 1.00 0.00 ATOM 449 CA ASP A 56 83.383 -6.103 -2.796 1.00 0.00 ATOM 450 CB ASP A 56 84.437 -6.467 -1.749 1.00 0.00 ATOM 451 CG ASP A 56 84.555 -5.424 -0.655 1.00 0.00 ATOM 452 OD1 ASP A 56 83.737 -4.481 -0.643 1.00 0.00 ATOM 453 OD2 ASP A 56 85.466 -5.551 0.190 1.00 0.00 ATOM 454 O ASP A 56 83.473 -3.774 -3.344 1.00 0.00 ATOM 455 C ASP A 56 83.880 -4.912 -3.606 1.00 0.00 ATOM 456 N SER A 57 79.881 0.460 4.698 1.00 0.00 ATOM 457 CA SER A 57 80.377 1.283 5.794 1.00 0.00 ATOM 458 CB SER A 57 80.827 2.656 5.200 1.00 0.00 ATOM 459 OG SER A 57 81.164 3.524 6.252 1.00 0.00 ATOM 460 O SER A 57 78.161 1.809 6.511 1.00 0.00 ATOM 461 C SER A 57 79.305 1.518 6.849 1.00 0.00 ATOM 462 N ASP A 58 79.674 1.380 8.123 1.00 0.00 ATOM 463 CA ASP A 58 78.705 1.633 9.187 1.00 0.00 ATOM 464 CB ASP A 58 79.121 1.221 10.474 1.00 0.00 ATOM 465 CG ASP A 58 77.945 1.582 11.409 1.00 0.00 ATOM 466 OD1 ASP A 58 76.803 1.830 10.900 1.00 0.00 ATOM 467 OD2 ASP A 58 78.165 1.604 12.637 1.00 0.00 ATOM 468 O ASP A 58 79.410 3.815 9.886 1.00 0.00 ATOM 469 C ASP A 58 78.512 3.130 9.385 1.00 0.00 ATOM 470 N LYS A 59 77.321 3.642 9.089 1.00 0.00 ATOM 471 CA LYS A 59 77.019 5.052 9.294 1.00 0.00 ATOM 472 CB LYS A 59 75.592 5.390 8.800 1.00 0.00 ATOM 473 CG LYS A 59 75.445 5.052 7.311 1.00 0.00 ATOM 474 CD LYS A 59 74.091 5.557 6.815 1.00 0.00 ATOM 475 CE LYS A 59 73.964 5.341 5.312 1.00 0.00 ATOM 476 NZ LYS A 59 73.092 6.372 4.679 1.00 0.00 ATOM 477 O LYS A 59 77.461 6.632 11.044 1.00 0.00 ATOM 478 C LYS A 59 77.186 5.473 10.754 1.00 0.00 ATOM 479 N SER A 60 76.765 4.456 11.584 1.00 0.00 ATOM 480 CA SER A 60 76.842 4.683 13.009 1.00 0.00 ATOM 481 CB SER A 60 75.840 3.775 13.763 1.00 0.00 ATOM 482 OG SER A 60 76.283 2.429 13.782 1.00 0.00 ATOM 483 O SER A 60 78.342 4.541 14.843 1.00 0.00 ATOM 484 C SER A 60 78.226 4.504 13.617 1.00 0.00 ATOM 485 N THR A 61 78.526 5.956 13.249 1.00 0.00 ATOM 486 CA THR A 61 79.712 6.728 13.592 1.00 0.00 ATOM 487 CB THR A 61 79.341 8.081 14.227 1.00 0.00 ATOM 488 CG2 THR A 61 78.457 8.886 13.288 1.00 0.00 ATOM 489 OG1 THR A 61 78.633 7.859 15.453 1.00 0.00 ATOM 490 O THR A 61 80.832 6.433 15.713 1.00 0.00 ATOM 491 C THR A 61 80.591 5.962 14.601 1.00 0.00 ATOM 492 N LEU A 62 81.089 4.776 14.217 1.00 0.00 ATOM 493 CA LEU A 62 81.930 3.974 15.112 1.00 0.00 ATOM 494 CB LEU A 62 82.096 2.539 14.536 1.00 0.00 ATOM 495 CG LEU A 62 80.835 1.754 14.191 1.00 0.00 ATOM 496 CD1 LEU A 62 81.239 0.521 13.387 1.00 0.00 ATOM 497 CD2 LEU A 62 80.101 1.362 15.463 1.00 0.00 ATOM 498 O LEU A 62 83.883 5.277 14.610 1.00 0.00 ATOM 499 C LEU A 62 83.303 4.574 15.431 1.00 0.00 ATOM 500 N ARG A 63 83.809 4.284 16.629 1.00 0.00 ATOM 501 CA ARG A 63 85.124 4.765 17.052 1.00 0.00 ATOM 502 CB ARG A 63 85.104 5.143 18.535 1.00 0.00 ATOM 503 CG ARG A 63 84.152 6.277 18.874 1.00 0.00 ATOM 504 CD ARG A 63 84.154 6.573 20.365 1.00 0.00 ATOM 505 NE ARG A 63 83.437 5.553 21.127 1.00 0.00 ATOM 506 CZ ARG A 63 83.272 5.582 22.444 1.00 0.00 ATOM 507 NH1 ARG A 63 82.606 4.610 23.052 1.00 0.00 ATOM 508 NH2 ARG A 63 83.774 6.584 23.153 1.00 0.00 ATOM 509 O ARG A 63 87.350 3.987 16.622 1.00 0.00 ATOM 510 C ARG A 63 86.181 3.687 16.844 1.00 0.00 ATOM 511 N ARG A 64 85.767 2.429 16.929 1.00 0.00 ATOM 512 CA ARG A 64 86.691 1.320 16.740 1.00 0.00 ATOM 513 CB ARG A 64 87.002 0.647 18.078 1.00 0.00 ATOM 514 CG ARG A 64 87.723 1.545 19.071 1.00 0.00 ATOM 515 CD ARG A 64 87.920 0.847 20.406 1.00 0.00 ATOM 516 NE ARG A 64 88.746 1.633 21.319 1.00 0.00 ATOM 517 CZ ARG A 64 89.177 1.198 22.499 1.00 0.00 ATOM 518 NH1 ARG A 64 89.924 1.984 23.262 1.00 0.00 ATOM 519 NH2 ARG A 64 88.859 -0.021 22.913 1.00 0.00 ATOM 520 O ARG A 64 85.063 -0.343 16.136 1.00 0.00 ATOM 521 C ARG A 64 86.063 0.296 15.804 1.00 0.00 ATOM 522 N GLY A 65 86.646 0.161 14.618 1.00 0.00 ATOM 523 CA GLY A 65 86.139 -0.767 13.616 1.00 0.00 ATOM 524 O GLY A 65 88.344 -1.615 13.253 1.00 0.00 ATOM 525 C GLY A 65 87.145 -1.868 13.331 1.00 0.00 ATOM 526 N ILE A 66 86.653 -3.093 13.188 1.00 0.00 ATOM 527 CA ILE A 66 87.522 -4.214 12.864 1.00 0.00 ATOM 528 CB ILE A 66 87.361 -5.305 13.868 1.00 0.00 ATOM 529 CG1 ILE A 66 87.970 -4.851 15.198 1.00 0.00 ATOM 530 CG2 ILE A 66 88.094 -6.539 13.335 1.00 0.00 ATOM 531 CD1 ILE A 66 89.461 -4.567 15.084 1.00 0.00 ATOM 532 O ILE A 66 85.894 -5.064 11.321 1.00 0.00 ATOM 533 C ILE A 66 87.072 -4.770 11.515 1.00 0.00 ATOM 534 N ASP A 67 88.021 -4.898 10.590 1.00 0.00 ATOM 535 CA ASP A 67 87.728 -5.447 9.273 1.00 0.00 ATOM 536 CB ASP A 67 88.209 -4.496 8.177 1.00 0.00 ATOM 537 CG ASP A 67 87.712 -4.894 6.801 1.00 0.00 ATOM 538 OD1 ASP A 67 87.862 -6.079 6.436 1.00 0.00 ATOM 539 OD2 ASP A 67 87.175 -4.021 6.087 1.00 0.00 ATOM 540 O ASP A 67 89.616 -6.909 9.481 1.00 0.00 ATOM 541 C ASP A 67 88.447 -6.787 9.129 1.00 0.00 ATOM 542 N ILE A 68 87.779 -7.826 8.635 1.00 0.00 ATOM 543 CA ILE A 68 88.351 -9.146 8.427 1.00 0.00 ATOM 544 CB ILE A 68 87.534 -10.235 9.147 1.00 0.00 ATOM 545 CG1 ILE A 68 87.394 -9.902 10.633 1.00 0.00 ATOM 546 CG2 ILE A 68 88.218 -11.588 9.017 1.00 0.00 ATOM 547 CD1 ILE A 68 88.716 -9.795 11.361 1.00 0.00 ATOM 548 O ILE A 68 87.285 -9.622 6.330 1.00 0.00 ATOM 549 C ILE A 68 88.341 -9.401 6.921 1.00 0.00 ATOM 550 N GLY A 69 89.519 -9.336 6.305 1.00 0.00 ATOM 551 CA GLY A 69 89.628 -9.547 4.868 1.00 0.00 ATOM 552 O GLY A 69 88.820 -7.600 3.748 1.00 0.00 ATOM 553 C GLY A 69 89.800 -8.239 4.117 1.00 0.00 ATOM 554 N THR A 70 91.048 -7.838 3.888 1.00 0.00 ATOM 555 CA THR A 70 91.340 -6.586 3.190 1.00 0.00 ATOM 556 CB THR A 70 92.704 -6.009 3.612 1.00 0.00 ATOM 557 CG2 THR A 70 92.978 -4.700 2.887 1.00 0.00 ATOM 558 OG1 THR A 70 92.708 -5.767 5.024 1.00 0.00 ATOM 559 O THR A 70 91.005 -5.835 0.959 1.00 0.00 ATOM 560 C THR A 70 91.435 -6.732 1.697 1.00 0.00 ATOM 561 N GLY A 71 92.067 -7.845 1.213 1.00 0.00 ATOM 562 CA GLY A 71 92.213 -8.014 -0.250 1.00 0.00 ATOM 563 O GLY A 71 94.285 -6.865 -0.626 1.00 0.00 ATOM 564 C GLY A 71 93.077 -6.903 -0.861 1.00 0.00 ATOM 565 N ALA A 72 92.471 -6.002 -1.633 1.00 0.00 ATOM 566 CA ALA A 72 93.219 -4.910 -2.249 1.00 0.00 ATOM 567 CB ALA A 72 92.778 -4.710 -3.690 1.00 0.00 ATOM 568 O ALA A 72 93.627 -2.560 -1.969 1.00 0.00 ATOM 569 C ALA A 72 93.044 -3.565 -1.547 1.00 0.00 ATOM 570 N SER A 73 92.232 -3.546 -0.490 1.00 0.00 ATOM 571 CA SER A 73 92.020 -2.322 0.263 1.00 0.00 ATOM 572 CB SER A 73 93.227 -1.392 0.128 1.00 0.00 ATOM 573 OG SER A 73 94.395 -1.993 0.660 1.00 0.00 ATOM 574 O SER A 73 90.710 -0.324 0.305 1.00 0.00 ATOM 575 C SER A 73 90.829 -1.468 -0.139 1.00 0.00 ATOM 576 N CYS A 74 89.939 -2.010 -0.963 1.00 0.00 ATOM 577 CA CYS A 74 88.773 -1.250 -1.400 1.00 0.00 ATOM 578 CB CYS A 74 87.908 -2.088 -2.345 1.00 0.00 ATOM 579 SG CYS A 74 86.430 -1.243 -2.950 1.00 0.00 ATOM 580 O CYS A 74 87.621 0.375 -0.058 1.00 0.00 ATOM 581 C CYS A 74 87.875 -0.817 -0.238 1.00 0.00 ATOM 582 N ILE A 75 87.389 -1.776 0.547 1.00 0.00 ATOM 583 CA ILE A 75 86.517 -1.441 1.665 1.00 0.00 ATOM 584 CB ILE A 75 85.929 -2.704 2.320 1.00 0.00 ATOM 585 CG1 ILE A 75 84.739 -2.340 3.208 1.00 0.00 ATOM 586 CG2 ILE A 75 86.977 -3.396 3.179 1.00 0.00 ATOM 587 CD1 ILE A 75 83.929 -3.534 3.665 1.00 0.00 ATOM 588 O ILE A 75 86.602 0.115 3.476 1.00 0.00 ATOM 589 C ILE A 75 87.230 -0.671 2.771 1.00 0.00 ATOM 590 N TYR A 76 88.537 -0.888 2.921 1.00 0.00 ATOM 591 CA TYR A 76 89.311 -0.183 3.943 1.00 0.00 ATOM 592 CB TYR A 76 90.703 -0.823 4.155 1.00 0.00 ATOM 593 CG TYR A 76 91.183 -0.795 5.601 1.00 0.00 ATOM 594 CD1 TYR A 76 90.473 -0.103 6.590 1.00 0.00 ATOM 595 CD2 TYR A 76 92.324 -1.495 5.984 1.00 0.00 ATOM 596 CE1 TYR A 76 90.895 -0.123 7.929 1.00 0.00 ATOM 597 CE2 TYR A 76 92.755 -1.519 7.316 1.00 0.00 ATOM 598 CZ TYR A 76 92.035 -0.834 8.280 1.00 0.00 ATOM 599 OH TYR A 76 92.464 -0.882 9.587 1.00 0.00 ATOM 600 O TYR A 76 89.255 2.158 4.457 1.00 0.00 ATOM 601 C TYR A 76 89.371 1.297 3.585 1.00 0.00 ATOM 602 N PRO A 77 89.556 1.591 2.302 1.00 0.00 ATOM 603 CA PRO A 77 89.602 2.978 1.849 1.00 0.00 ATOM 604 CB PRO A 77 89.996 2.921 0.416 1.00 0.00 ATOM 605 CG PRO A 77 90.960 1.757 0.403 1.00 0.00 ATOM 606 CD PRO A 77 90.197 0.725 1.223 1.00 0.00 ATOM 607 O PRO A 77 88.006 4.702 2.396 1.00 0.00 ATOM 608 C PRO A 77 88.192 3.553 1.982 1.00 0.00 ATOM 609 N LEU A 78 87.205 2.735 1.644 1.00 0.00 ATOM 610 CA LEU A 78 85.812 3.146 1.717 1.00 0.00 ATOM 611 CB LEU A 78 84.893 1.996 1.295 1.00 0.00 ATOM 612 CG LEU A 78 83.391 2.281 1.339 1.00 0.00 ATOM 613 CD1 LEU A 78 83.028 3.410 0.386 1.00 0.00 ATOM 614 CD2 LEU A 78 82.598 1.047 0.936 1.00 0.00 ATOM 615 O LEU A 78 84.809 4.643 3.317 1.00 0.00 ATOM 616 C LEU A 78 85.397 3.573 3.111 1.00 0.00 ATOM 617 N LEU A 79 85.749 2.710 4.091 1.00 0.00 ATOM 618 CA LEU A 79 85.400 2.981 5.481 1.00 0.00 ATOM 619 CB LEU A 79 85.497 1.739 6.369 1.00 0.00 ATOM 620 CG LEU A 79 84.563 0.580 6.018 1.00 0.00 ATOM 621 CD1 LEU A 79 84.855 -0.630 6.892 1.00 0.00 ATOM 622 CD2 LEU A 79 83.110 0.977 6.227 1.00 0.00 ATOM 623 O LEU A 79 85.637 4.973 6.786 1.00 0.00 ATOM 624 C LEU A 79 86.206 4.068 6.177 1.00 0.00 ATOM 625 N GLY A 80 87.527 4.001 6.059 1.00 0.00 ATOM 626 CA GLY A 80 88.408 4.977 6.704 1.00 0.00 ATOM 627 O GLY A 80 88.332 7.351 7.045 1.00 0.00 ATOM 628 C GLY A 80 88.200 6.424 6.246 1.00 0.00 ATOM 629 N ALA A 81 87.876 6.620 4.970 1.00 0.00 ATOM 630 CA ALA A 81 87.667 7.966 4.447 1.00 0.00 ATOM 631 CB ALA A 81 87.384 7.916 2.953 1.00 0.00 ATOM 632 O ALA A 81 86.384 9.872 5.121 1.00 0.00 ATOM 633 C ALA A 81 86.486 8.647 5.130 1.00 0.00 ATOM 634 N THR A 82 85.604 7.852 5.730 1.00 0.00 ATOM 635 CA THR A 82 84.428 8.379 6.408 1.00 0.00 ATOM 636 CB THR A 82 83.181 7.520 6.124 1.00 0.00 ATOM 637 CG2 THR A 82 82.895 7.473 4.632 1.00 0.00 ATOM 638 OG1 THR A 82 83.399 6.186 6.598 1.00 0.00 ATOM 639 O THR A 82 83.661 8.923 8.613 1.00 0.00 ATOM 640 C THR A 82 84.563 8.438 7.931 1.00 0.00 ATOM 641 N LEU A 83 85.670 7.952 8.471 1.00 0.00 ATOM 642 CA LEU A 83 85.875 7.955 9.928 1.00 0.00 ATOM 643 CB LEU A 83 86.524 6.646 10.381 1.00 0.00 ATOM 644 CG LEU A 83 85.735 5.366 10.100 1.00 0.00 ATOM 645 CD1 LEU A 83 86.521 4.141 10.543 1.00 0.00 ATOM 646 CD2 LEU A 83 84.409 5.377 10.846 1.00 0.00 ATOM 647 O LEU A 83 86.526 10.235 9.782 1.00 0.00 ATOM 648 C LEU A 83 86.670 9.148 10.345 1.00 0.00 ATOM 649 N ASN A 84 87.453 9.089 11.372 1.00 0.00 ATOM 650 CA ASN A 84 88.216 10.201 11.875 1.00 0.00 ATOM 651 CB ASN A 84 87.440 11.089 12.794 1.00 0.00 ATOM 652 CG ASN A 84 86.709 12.220 12.112 1.00 0.00 ATOM 653 ND2 ASN A 84 86.189 13.205 12.878 1.00 0.00 ATOM 654 OD1 ASN A 84 86.666 12.244 10.916 1.00 0.00 ATOM 655 O ASN A 84 89.254 8.290 12.734 1.00 0.00 ATOM 656 C ASN A 84 89.241 9.515 12.798 1.00 0.00 ATOM 657 N GLY A 85 90.061 10.252 13.500 1.00 0.00 ATOM 658 CA GLY A 85 91.113 9.640 14.307 1.00 0.00 ATOM 659 O GLY A 85 91.371 7.849 15.864 1.00 0.00 ATOM 660 C GLY A 85 90.609 8.728 15.400 1.00 0.00 ATOM 661 N TRP A 86 89.102 8.187 15.515 1.00 0.00 ATOM 662 CA TRP A 86 88.560 6.853 15.282 1.00 0.00 ATOM 663 CB TRP A 86 87.397 6.914 14.290 1.00 0.00 ATOM 664 CG TRP A 86 86.178 7.596 14.835 1.00 0.00 ATOM 665 CD1 TRP A 86 86.004 8.071 16.103 1.00 0.00 ATOM 666 CD2 TRP A 86 84.967 7.883 14.126 1.00 0.00 ATOM 667 CE2 TRP A 86 84.099 8.532 15.029 1.00 0.00 ATOM 668 CE3 TRP A 86 84.528 7.656 12.819 1.00 0.00 ATOM 669 NE1 TRP A 86 84.756 8.634 16.231 1.00 0.00 ATOM 670 CZ2 TRP A 86 82.822 8.954 14.666 1.00 0.00 ATOM 671 CZ3 TRP A 86 83.260 8.076 12.463 1.00 0.00 ATOM 672 CH2 TRP A 86 82.421 8.717 13.380 1.00 0.00 ATOM 673 O TRP A 86 90.609 6.466 14.094 1.00 0.00 ATOM 674 C TRP A 86 89.666 5.970 14.711 1.00 0.00 ATOM 675 N TYR A 87 89.551 4.665 14.923 1.00 0.00 ATOM 676 CA TYR A 87 90.549 3.726 14.432 1.00 0.00 ATOM 677 CB TYR A 87 91.328 3.114 15.597 1.00 0.00 ATOM 678 CG TYR A 87 92.129 4.118 16.392 1.00 0.00 ATOM 679 CD1 TYR A 87 91.569 4.773 17.482 1.00 0.00 ATOM 680 CD2 TYR A 87 93.445 4.408 16.052 1.00 0.00 ATOM 681 CE1 TYR A 87 92.294 5.693 18.216 1.00 0.00 ATOM 682 CE2 TYR A 87 94.185 5.325 16.773 1.00 0.00 ATOM 683 CZ TYR A 87 93.599 5.969 17.863 1.00 0.00 ATOM 684 OH TYR A 87 94.322 6.885 18.590 1.00 0.00 ATOM 685 O TYR A 87 88.851 2.097 13.981 1.00 0.00 ATOM 686 C TYR A 87 89.934 2.583 13.649 1.00 0.00 ATOM 687 N PHE A 88 90.651 2.138 12.622 1.00 0.00 ATOM 688 CA PHE A 88 90.214 1.004 11.828 1.00 0.00 ATOM 689 CB PHE A 88 89.957 1.157 10.557 1.00 0.00 ATOM 690 CG PHE A 88 88.491 1.468 10.626 1.00 0.00 ATOM 691 CD1 PHE A 88 87.656 0.710 11.410 1.00 0.00 ATOM 692 CD2 PHE A 88 87.962 2.536 9.936 1.00 0.00 ATOM 693 CE1 PHE A 88 86.312 1.026 11.491 1.00 0.00 ATOM 694 CE2 PHE A 88 86.620 2.864 9.987 1.00 0.00 ATOM 695 CZ PHE A 88 85.776 2.081 10.776 1.00 0.00 ATOM 696 O PHE A 88 92.474 0.292 11.477 1.00 0.00 ATOM 697 C PHE A 88 91.338 -0.017 11.842 1.00 0.00 ATOM 698 N LEU A 89 91.023 -1.220 12.305 1.00 0.00 ATOM 699 CA LEU A 89 91.992 -2.307 12.343 1.00 0.00 ATOM 700 CB LEU A 89 92.012 -2.958 13.727 1.00 0.00 ATOM 701 CG LEU A 89 92.386 -2.048 14.899 1.00 0.00 ATOM 702 CD1 LEU A 89 92.282 -2.799 16.217 1.00 0.00 ATOM 703 CD2 LEU A 89 93.811 -1.539 14.751 1.00 0.00 ATOM 704 O LEU A 89 90.345 -3.660 11.248 1.00 0.00 ATOM 705 C LEU A 89 91.521 -3.292 11.277 1.00 0.00 ATOM 706 N ALA A 90 92.417 -3.704 10.390 1.00 0.00 ATOM 707 CA ALA A 90 92.033 -4.654 9.351 1.00 0.00 ATOM 708 CB ALA A 90 92.074 -3.989 7.983 1.00 0.00 ATOM 709 O ALA A 90 94.209 -5.692 9.358 1.00 0.00 ATOM 710 C ALA A 90 92.987 -5.852 9.334 1.00 0.00 ATOM 711 N THR A 91 92.411 -7.050 9.307 1.00 0.00 ATOM 712 CA THR A 91 93.185 -8.284 9.302 1.00 0.00 ATOM 713 CB THR A 91 92.536 -9.359 10.192 1.00 0.00 ATOM 714 CG2 THR A 91 93.347 -10.646 10.149 1.00 0.00 ATOM 715 OG1 THR A 91 92.480 -8.893 11.546 1.00 0.00 ATOM 716 O THR A 91 92.307 -8.967 7.172 1.00 0.00 ATOM 717 C THR A 91 93.303 -8.862 7.892 1.00 0.00 ATOM 718 N GLU A 92 94.525 -9.233 7.513 1.00 0.00 ATOM 719 CA GLU A 92 94.804 -9.812 6.199 1.00 0.00 ATOM 720 CB GLU A 92 95.296 -8.737 5.228 1.00 0.00 ATOM 721 CG GLU A 92 95.716 -9.272 3.868 1.00 0.00 ATOM 722 CD GLU A 92 94.536 -9.737 3.037 1.00 0.00 ATOM 723 OE1 GLU A 92 93.385 -9.574 3.494 1.00 0.00 ATOM 724 OE2 GLU A 92 94.764 -10.265 1.927 1.00 0.00 ATOM 725 O GLU A 92 96.994 -10.543 6.860 1.00 0.00 ATOM 726 C GLU A 92 95.894 -10.862 6.417 1.00 0.00 ATOM 727 N VAL A 93 95.569 -12.107 6.062 1.00 0.00 ATOM 728 CA VAL A 93 96.504 -13.210 6.259 1.00 0.00 ATOM 729 CB VAL A 93 95.807 -14.581 6.324 1.00 0.00 ATOM 730 CG1 VAL A 93 95.306 -14.991 4.947 1.00 0.00 ATOM 731 CG2 VAL A 93 96.771 -15.646 6.823 1.00 0.00 ATOM 732 O VAL A 93 98.758 -13.567 5.503 1.00 0.00 ATOM 733 C VAL A 93 97.599 -13.279 5.201 1.00 0.00 ATOM 734 N ASP A 94 97.206 -12.975 3.948 1.00 0.00 ATOM 735 CA ASP A 94 98.135 -12.993 2.825 1.00 0.00 ATOM 736 CB ASP A 94 97.385 -12.937 1.493 1.00 0.00 ATOM 737 CG ASP A 94 98.308 -13.075 0.299 1.00 0.00 ATOM 738 OD1 ASP A 94 99.540 -13.097 0.499 1.00 0.00 ATOM 739 OD2 ASP A 94 97.798 -13.160 -0.840 1.00 0.00 ATOM 740 O ASP A 94 98.715 -10.663 2.722 1.00 0.00 ATOM 741 C ASP A 94 99.104 -11.811 2.916 1.00 0.00 ATOM 742 N ASP A 95 100.386 -12.085 3.213 1.00 0.00 ATOM 743 CA ASP A 95 101.374 -11.011 3.325 1.00 0.00 ATOM 744 CB ASP A 95 102.764 -11.588 3.601 1.00 0.00 ATOM 745 CG ASP A 95 102.906 -12.114 5.015 1.00 0.00 ATOM 746 OD1 ASP A 95 102.021 -11.824 5.848 1.00 0.00 ATOM 747 OD2 ASP A 95 103.903 -12.814 5.293 1.00 0.00 ATOM 748 O ASP A 95 101.689 -8.909 2.212 1.00 0.00 ATOM 749 C ASP A 95 101.462 -10.115 2.094 1.00 0.00 ATOM 750 N MET A 96 101.308 -10.730 0.903 1.00 0.00 ATOM 751 CA MET A 96 101.393 -9.973 -0.339 1.00 0.00 ATOM 752 CB MET A 96 101.272 -10.899 -1.551 1.00 0.00 ATOM 753 CG MET A 96 102.461 -11.826 -1.745 1.00 0.00 ATOM 754 SD MET A 96 104.005 -10.933 -2.007 1.00 0.00 ATOM 755 CE MET A 96 103.709 -10.212 -3.620 1.00 0.00 ATOM 756 O MET A 96 100.511 -7.786 -0.821 1.00 0.00 ATOM 757 C MET A 96 100.280 -8.930 -0.421 1.00 0.00 ATOM 758 N CYS A 97 99.071 -9.330 -0.041 1.00 0.00 ATOM 759 CA CYS A 97 97.935 -8.422 -0.066 1.00 0.00 ATOM 760 CB CYS A 97 96.634 -9.184 0.187 1.00 0.00 ATOM 761 SG CYS A 97 96.137 -10.282 -1.162 1.00 0.00 ATOM 762 O CYS A 97 97.752 -6.188 0.779 1.00 0.00 ATOM 763 C CYS A 97 98.093 -7.349 1.003 1.00 0.00 ATOM 764 N PHE A 98 98.609 -7.734 2.169 1.00 0.00 ATOM 765 CA PHE A 98 98.797 -6.783 3.262 1.00 0.00 ATOM 766 CB PHE A 98 99.284 -7.448 4.555 1.00 0.00 ATOM 767 CG PHE A 98 99.742 -6.467 5.611 1.00 0.00 ATOM 768 CD1 PHE A 98 98.817 -5.634 6.263 1.00 0.00 ATOM 769 CD2 PHE A 98 101.076 -6.350 5.938 1.00 0.00 ATOM 770 CE1 PHE A 98 99.227 -4.734 7.222 1.00 0.00 ATOM 771 CE2 PHE A 98 101.501 -5.432 6.891 1.00 0.00 ATOM 772 CZ PHE A 98 100.574 -4.628 7.537 1.00 0.00 ATOM 773 O PHE A 98 99.518 -4.488 3.089 1.00 0.00 ATOM 774 C PHE A 98 99.744 -5.670 2.811 1.00 0.00 ATOM 775 N ASN A 99 100.790 -6.048 2.069 1.00 0.00 ATOM 776 CA ASN A 99 101.721 -5.055 1.543 1.00 0.00 ATOM 777 CB ASN A 99 102.848 -5.762 0.786 1.00 0.00 ATOM 778 CG ASN A 99 103.781 -6.522 1.708 1.00 0.00 ATOM 779 ND2 ASN A 99 104.501 -7.489 1.153 1.00 0.00 ATOM 780 OD1 ASN A 99 103.851 -6.242 2.905 1.00 0.00 ATOM 781 O ASN A 99 101.268 -2.858 0.694 1.00 0.00 ATOM 782 C ASN A 99 101.040 -4.065 0.601 1.00 0.00 ATOM 783 N TYR A 100 100.197 -4.583 -0.293 1.00 0.00 ATOM 784 CA TYR A 100 99.467 -3.746 -1.243 1.00 0.00 ATOM 785 CB TYR A 100 98.635 -4.612 -2.193 1.00 0.00 ATOM 786 CG TYR A 100 99.463 -5.439 -3.149 1.00 0.00 ATOM 787 CD1 TYR A 100 100.808 -5.159 -3.353 1.00 0.00 ATOM 788 CD2 TYR A 100 98.897 -6.499 -3.847 1.00 0.00 ATOM 789 CE1 TYR A 100 101.572 -5.908 -4.225 1.00 0.00 ATOM 790 CE2 TYR A 100 99.645 -7.260 -4.724 1.00 0.00 ATOM 791 CZ TYR A 100 100.993 -6.956 -4.910 1.00 0.00 ATOM 792 OH TYR A 100 101.753 -7.704 -5.779 1.00 0.00 ATOM 793 O TYR A 100 98.316 -1.653 -0.873 1.00 0.00 ATOM 794 C TYR A 100 98.480 -2.822 -0.512 1.00 0.00 ATOM 795 N ALA A 101 97.834 -3.347 0.518 1.00 0.00 ATOM 796 CA ALA A 101 96.898 -2.547 1.310 1.00 0.00 ATOM 797 CB ALA A 101 96.179 -3.414 2.309 1.00 0.00 ATOM 798 O ALA A 101 97.104 -0.269 2.024 1.00 0.00 ATOM 799 C ALA A 101 97.614 -1.389 1.992 1.00 0.00 ATOM 800 N LYS A 102 98.793 -1.661 2.545 1.00 0.00 ATOM 801 CA LYS A 102 99.560 -0.620 3.215 1.00 0.00 ATOM 802 CB LYS A 102 100.856 -1.197 3.789 1.00 0.00 ATOM 803 CG LYS A 102 101.703 -0.184 4.543 1.00 0.00 ATOM 804 CD LYS A 102 102.937 -0.837 5.145 1.00 0.00 ATOM 805 CE LYS A 102 103.810 0.182 5.858 1.00 0.00 ATOM 806 NZ LYS A 102 105.034 -0.439 6.434 1.00 0.00 ATOM 807 O LYS A 102 99.768 1.667 2.513 1.00 0.00 ATOM 808 C LYS A 102 99.907 0.483 2.213 1.00 0.00 ATOM 809 N LYS A 103 100.358 0.092 1.024 1.00 0.00 ATOM 810 CA LYS A 103 100.693 1.068 -0.009 1.00 0.00 ATOM 811 CB LYS A 103 101.277 0.368 -1.238 1.00 0.00 ATOM 812 CG LYS A 103 102.665 -0.211 -1.022 1.00 0.00 ATOM 813 CD LYS A 103 103.183 -0.889 -2.281 1.00 0.00 ATOM 814 CE LYS A 103 104.562 -1.488 -2.058 1.00 0.00 ATOM 815 NZ LYS A 103 105.068 -2.184 -3.272 1.00 0.00 ATOM 816 O LYS A 103 99.516 3.052 -0.669 1.00 0.00 ATOM 817 C LYS A 103 99.455 1.841 -0.443 1.00 0.00 ATOM 818 N ASN A 104 98.324 1.147 -0.534 1.00 0.00 ATOM 819 CA ASN A 104 97.081 1.786 -0.945 1.00 0.00 ATOM 820 CB ASN A 104 95.957 0.753 -1.049 1.00 0.00 ATOM 821 CG ASN A 104 94.679 1.339 -1.616 1.00 0.00 ATOM 822 ND2 ASN A 104 93.622 1.339 -0.811 1.00 0.00 ATOM 823 OD1 ASN A 104 94.644 1.784 -2.763 1.00 0.00 ATOM 824 O ASN A 104 96.359 3.972 -0.273 1.00 0.00 ATOM 825 C ASN A 104 96.697 2.844 0.083 1.00 0.00 ATOM 826 N VAL A 105 96.748 2.485 1.380 1.00 0.00 ATOM 827 CA VAL A 105 96.388 3.431 2.423 1.00 0.00 ATOM 828 CB VAL A 105 96.468 2.762 3.808 1.00 0.00 ATOM 829 CG1 VAL A 105 96.297 3.796 4.910 1.00 0.00 ATOM 830 CG2 VAL A 105 95.376 1.715 3.957 1.00 0.00 ATOM 831 O VAL A 105 96.903 5.774 2.630 1.00 0.00 ATOM 832 C VAL A 105 97.334 4.635 2.435 1.00 0.00 ATOM 833 N GLU A 106 98.624 4.378 2.231 1.00 0.00 ATOM 834 CA GLU A 106 99.615 5.449 2.206 1.00 0.00 ATOM 835 CB GLU A 106 101.014 4.878 1.965 1.00 0.00 ATOM 836 CG GLU A 106 102.120 5.922 1.970 1.00 0.00 ATOM 837 CD GLU A 106 103.493 5.317 1.762 1.00 0.00 ATOM 838 OE1 GLU A 106 103.582 4.078 1.626 1.00 0.00 ATOM 839 OE2 GLU A 106 104.481 6.081 1.734 1.00 0.00 ATOM 840 O GLU A 106 99.361 7.644 1.297 1.00 0.00 ATOM 841 C GLU A 106 99.332 6.445 1.079 1.00 0.00 ATOM 842 N GLN A 107 99.057 5.932 -0.084 1.00 0.00 ATOM 843 CA GLN A 107 98.764 6.776 -1.246 1.00 0.00 ATOM 844 CB GLN A 107 98.553 5.923 -2.498 1.00 0.00 ATOM 845 CG GLN A 107 99.823 5.275 -3.029 1.00 0.00 ATOM 846 CD GLN A 107 99.559 4.349 -4.200 1.00 0.00 ATOM 847 OE1 GLN A 107 98.409 4.113 -4.570 1.00 0.00 ATOM 848 NE2 GLN A 107 100.626 3.821 -4.788 1.00 0.00 ATOM 849 O GLN A 107 97.427 8.755 -1.405 1.00 0.00 ATOM 850 C GLN A 107 97.506 7.599 -0.994 1.00 0.00 ATOM 851 N ASN A 108 96.529 6.972 -0.306 1.00 0.00 ATOM 852 CA ASN A 108 95.266 7.647 -0.014 1.00 0.00 ATOM 853 CB ASN A 108 94.140 6.638 0.167 1.00 0.00 ATOM 854 CG ASN A 108 93.466 6.295 -1.114 1.00 0.00 ATOM 855 ND2 ASN A 108 92.905 5.079 -1.162 1.00 0.00 ATOM 856 OD1 ASN A 108 93.420 7.105 -2.077 1.00 0.00 ATOM 857 O ASN A 108 94.552 9.436 1.401 1.00 0.00 ATOM 858 C ASN A 108 95.429 8.616 1.146 1.00 0.00 ATOM 859 N ASN A 109 96.551 8.519 1.850 1.00 0.00 ATOM 860 CA ASN A 109 96.795 9.409 2.969 1.00 0.00 ATOM 861 CB ASN A 109 96.487 10.853 2.568 1.00 0.00 ATOM 862 CG ASN A 109 97.225 11.864 3.424 1.00 0.00 ATOM 863 ND2 ASN A 109 96.635 13.043 3.584 1.00 0.00 ATOM 864 OD1 ASN A 109 98.309 11.586 3.935 1.00 0.00 ATOM 865 O ASN A 109 95.519 9.958 4.942 1.00 0.00 ATOM 866 C ASN A 109 95.880 9.062 4.153 1.00 0.00 ATOM 867 N LEU A 110 95.542 7.780 4.390 1.00 0.00 ATOM 868 CA LEU A 110 94.709 7.377 5.524 1.00 0.00 ATOM 869 CB LEU A 110 93.459 6.641 5.037 1.00 0.00 ATOM 870 CG LEU A 110 92.490 7.450 4.172 1.00 0.00 ATOM 871 CD1 LEU A 110 91.359 6.569 3.665 1.00 0.00 ATOM 872 CD2 LEU A 110 91.880 8.592 4.971 1.00 0.00 ATOM 873 O LEU A 110 94.915 5.766 7.277 1.00 0.00 ATOM 874 C LEU A 110 95.494 6.434 6.417 1.00 0.00 ATOM 875 N SER A 111 96.808 6.381 6.224 1.00 0.00 ATOM 876 CA SER A 111 97.636 5.467 7.001 1.00 0.00 ATOM 877 CB SER A 111 99.107 5.603 6.600 1.00 0.00 ATOM 878 OG SER A 111 99.612 6.883 6.942 1.00 0.00 ATOM 879 O SER A 111 97.671 4.683 9.265 1.00 0.00 ATOM 880 C SER A 111 97.546 5.650 8.512 1.00 0.00 ATOM 881 N ASP A 112 97.304 6.867 8.955 1.00 0.00 ATOM 882 CA ASP A 112 97.195 7.148 10.386 1.00 0.00 ATOM 883 CB ASP A 112 97.152 8.654 10.655 1.00 0.00 ATOM 884 CG ASP A 112 98.482 9.331 10.388 1.00 0.00 ATOM 885 OD1 ASP A 112 99.493 8.614 10.234 1.00 0.00 ATOM 886 OD2 ASP A 112 98.513 10.578 10.332 1.00 0.00 ATOM 887 O ASP A 112 96.049 6.278 12.294 1.00 0.00 ATOM 888 C ASP A 112 95.986 6.563 11.102 1.00 0.00 ATOM 889 N LEU A 113 94.893 6.373 10.371 1.00 0.00 ATOM 890 CA LEU A 113 93.667 5.838 10.954 1.00 0.00 ATOM 891 CB LEU A 113 92.440 6.349 10.198 1.00 0.00 ATOM 892 CG LEU A 113 92.198 7.858 10.238 1.00 0.00 ATOM 893 CD1 LEU A 113 91.002 8.236 9.377 1.00 0.00 ATOM 894 CD2 LEU A 113 91.925 8.322 11.661 1.00 0.00 ATOM 895 O LEU A 113 92.856 3.712 11.712 1.00 0.00 ATOM 896 C LEU A 113 93.591 4.312 10.927 1.00 0.00 ATOM 897 N ILE A 114 94.345 3.690 10.025 1.00 0.00 ATOM 898 CA ILE A 114 94.291 2.242 9.867 1.00 0.00 ATOM 899 CB ILE A 114 94.073 1.844 8.396 1.00 0.00 ATOM 900 CG1 ILE A 114 92.737 2.388 7.887 1.00 0.00 ATOM 901 CG2 ILE A 114 94.063 0.329 8.249 1.00 0.00 ATOM 902 CD1 ILE A 114 92.550 2.250 6.392 1.00 0.00 ATOM 903 O ILE A 114 96.659 1.918 10.095 1.00 0.00 ATOM 904 C ILE A 114 95.532 1.476 10.306 1.00 0.00 ATOM 905 N LYS A 115 95.308 0.317 10.918 1.00 0.00 ATOM 906 CA LYS A 115 96.389 -0.553 11.370 1.00 0.00 ATOM 907 CB LYS A 115 96.391 -0.664 12.896 1.00 0.00 ATOM 908 CG LYS A 115 96.678 0.645 13.613 1.00 0.00 ATOM 909 CD LYS A 115 96.726 0.450 15.119 1.00 0.00 ATOM 910 CE LYS A 115 97.000 1.762 15.838 1.00 0.00 ATOM 911 NZ LYS A 115 97.139 1.572 17.308 1.00 0.00 ATOM 912 O LYS A 115 95.076 -2.508 10.930 1.00 0.00 ATOM 913 C LYS A 115 96.129 -1.912 10.735 1.00 0.00 ATOM 914 N VAL A 116 97.090 -2.388 9.959 1.00 0.00 ATOM 915 CA VAL A 116 96.964 -3.672 9.296 1.00 0.00 ATOM 916 CB VAL A 116 97.582 -3.633 7.860 1.00 0.00 ATOM 917 CG1 VAL A 116 97.465 -4.990 7.176 1.00 0.00 ATOM 918 CG2 VAL A 116 96.912 -2.563 7.016 1.00 0.00 ATOM 919 O VAL A 116 98.675 -4.648 10.635 1.00 0.00 ATOM 920 C VAL A 116 97.547 -4.763 10.179 1.00 0.00 ATOM 921 N VAL A 117 96.760 -5.805 10.429 1.00 0.00 ATOM 922 CA VAL A 117 97.182 -6.952 11.222 1.00 0.00 ATOM 923 CB VAL A 117 96.122 -7.372 12.258 1.00 0.00 ATOM 924 CG1 VAL A 117 96.606 -8.574 13.055 1.00 0.00 ATOM 925 CG2 VAL A 117 95.842 -6.234 13.226 1.00 0.00 ATOM 926 O VAL A 117 96.501 -8.600 9.618 1.00 0.00 ATOM 927 C VAL A 117 97.433 -8.085 10.240 1.00 0.00 ATOM 928 N LYS A 118 98.696 -8.462 10.086 1.00 0.00 ATOM 929 CA LYS A 118 99.040 -9.529 9.161 1.00 0.00 ATOM 930 CB LYS A 118 99.855 -9.550 8.180 1.00 0.00 ATOM 931 CG LYS A 118 101.161 -8.709 8.324 1.00 0.00 ATOM 932 CD LYS A 118 102.061 -8.758 7.107 1.00 0.00 ATOM 933 CE LYS A 118 103.473 -8.204 7.385 1.00 0.00 ATOM 934 NZ LYS A 118 104.442 -8.657 6.367 1.00 0.00 ATOM 935 O LYS A 118 99.839 -11.201 10.697 1.00 0.00 ATOM 936 C LYS A 118 99.000 -10.885 9.856 1.00 0.00 ATOM 937 N VAL A 119 97.993 -11.675 9.502 1.00 0.00 ATOM 938 CA VAL A 119 97.830 -12.990 10.089 1.00 0.00 ATOM 939 CB VAL A 119 98.114 -12.972 11.603 1.00 0.00 ATOM 940 CG1 VAL A 119 99.553 -12.557 11.870 1.00 0.00 ATOM 941 CG2 VAL A 119 97.191 -11.988 12.306 1.00 0.00 ATOM 942 O VAL A 119 95.574 -12.780 9.329 1.00 0.00 ATOM 943 C VAL A 119 96.414 -13.490 9.888 1.00 0.00 ATOM 944 N PRO A 120 96.148 -14.713 10.335 1.00 0.00 ATOM 945 CA PRO A 120 94.821 -15.304 10.204 1.00 0.00 ATOM 946 CB PRO A 120 95.081 -16.810 10.253 1.00 0.00 ATOM 947 CG PRO A 120 96.324 -16.949 11.067 1.00 0.00 ATOM 948 CD PRO A 120 97.159 -15.739 10.761 1.00 0.00 ATOM 949 O PRO A 120 94.389 -14.803 12.505 1.00 0.00 ATOM 950 C PRO A 120 93.949 -14.836 11.356 1.00 0.00 ATOM 951 N GLN A 121 92.710 -14.474 11.041 1.00 0.00 ATOM 952 CA GLN A 121 91.760 -14.005 12.041 1.00 0.00 ATOM 953 CB GLN A 121 90.354 -13.922 11.448 1.00 0.00 ATOM 954 CG GLN A 121 89.307 -13.380 12.406 1.00 0.00 ATOM 955 CD GLN A 121 87.929 -13.292 11.778 1.00 0.00 ATOM 956 OE1 GLN A 121 87.725 -13.732 10.646 1.00 0.00 ATOM 957 NE2 GLN A 121 86.980 -12.723 12.511 1.00 0.00 ATOM 958 O GLN A 121 91.666 -14.417 14.390 1.00 0.00 ATOM 959 C GLN A 121 91.675 -14.909 13.264 1.00 0.00 ATOM 960 N ALA A 122 91.617 -16.222 13.058 1.00 0.00 ATOM 961 CA ALA A 122 91.509 -17.146 14.188 1.00 0.00 ATOM 962 CB ALA A 122 91.453 -18.583 13.696 1.00 0.00 ATOM 963 O ALA A 122 92.529 -17.323 16.346 1.00 0.00 ATOM 964 C ALA A 122 92.682 -17.050 15.155 1.00 0.00 ATOM 965 N THR A 123 93.844 -16.674 14.656 1.00 0.00 ATOM 966 CA THR A 123 95.021 -16.552 15.507 1.00 0.00 ATOM 967 CB THR A 123 96.316 -16.820 14.720 1.00 0.00 ATOM 968 CG2 THR A 123 96.299 -18.220 14.125 1.00 0.00 ATOM 969 OG1 THR A 123 96.441 -15.865 13.658 1.00 0.00 ATOM 970 O THR A 123 95.745 -14.953 17.145 1.00 0.00 ATOM 971 C THR A 123 95.178 -15.139 16.067 1.00 0.00 ATOM 972 N LEU A 124 94.661 -14.140 15.380 1.00 0.00 ATOM 973 CA LEU A 124 94.783 -12.760 15.832 1.00 0.00 ATOM 974 CB LEU A 124 94.836 -11.824 14.600 1.00 0.00 ATOM 975 CG LEU A 124 94.842 -10.302 14.826 1.00 0.00 ATOM 976 CD1 LEU A 124 96.249 -9.858 15.200 1.00 0.00 ATOM 977 CD2 LEU A 124 94.393 -9.590 13.557 1.00 0.00 ATOM 978 O LEU A 124 93.922 -11.461 17.641 1.00 0.00 ATOM 979 C LEU A 124 93.676 -12.277 16.755 1.00 0.00 ATOM 980 N LEU A 125 92.455 -12.758 16.552 1.00 0.00 ATOM 981 CA LEU A 125 91.351 -12.315 17.390 1.00 0.00 ATOM 982 CB LEU A 125 90.081 -13.104 17.066 1.00 0.00 ATOM 983 CG LEU A 125 89.433 -12.815 15.710 1.00 0.00 ATOM 984 CD1 LEU A 125 88.286 -13.779 15.447 1.00 0.00 ATOM 985 CD2 LEU A 125 88.882 -11.398 15.666 1.00 0.00 ATOM 986 O LEU A 125 91.287 -11.613 19.687 1.00 0.00 ATOM 987 C LEU A 125 91.614 -12.492 18.889 1.00 0.00 ATOM 988 N MET A 126 92.210 -13.627 19.294 1.00 0.00 ATOM 989 CA MET A 126 92.483 -13.837 20.720 1.00 0.00 ATOM 990 CB MET A 126 93.187 -15.178 20.938 1.00 0.00 ATOM 991 CG MET A 126 92.313 -16.391 20.660 1.00 0.00 ATOM 992 SD MET A 126 90.854 -16.453 21.718 1.00 0.00 ATOM 993 CE MET A 126 91.606 -16.776 23.311 1.00 0.00 ATOM 994 O MET A 126 93.450 -12.571 22.537 1.00 0.00 ATOM 995 C MET A 126 93.390 -12.772 21.316 1.00 0.00 ATOM 996 N ASP A 127 94.240 -12.205 20.370 1.00 0.00 ATOM 997 CA ASP A 127 95.264 -11.293 20.827 1.00 0.00 ATOM 998 CB ASP A 127 96.560 -11.479 20.037 1.00 0.00 ATOM 999 CG ASP A 127 97.163 -12.857 20.223 1.00 0.00 ATOM 1000 OD1 ASP A 127 97.282 -13.303 21.383 1.00 0.00 ATOM 1001 OD2 ASP A 127 97.517 -13.493 19.207 1.00 0.00 ATOM 1002 O ASP A 127 95.760 -8.952 21.012 1.00 0.00 ATOM 1003 C ASP A 127 94.935 -9.802 20.687 1.00 0.00 ATOM 1004 N ALA A 128 93.751 -9.481 20.233 1.00 0.00 ATOM 1005 CA ALA A 128 93.357 -8.084 20.051 1.00 0.00 ATOM 1006 CB ALA A 128 91.933 -7.993 19.525 1.00 0.00 ATOM 1007 O ALA A 128 93.958 -6.106 21.306 1.00 0.00 ATOM 1008 C ALA A 128 93.376 -7.206 21.317 1.00 0.00 ATOM 1009 N LEU A 129 92.772 -7.670 22.383 1.00 0.00 ATOM 1010 CA LEU A 129 92.735 -6.887 23.604 1.00 0.00 ATOM 1011 CB LEU A 129 91.853 -7.640 24.649 1.00 0.00 ATOM 1012 CG LEU A 129 90.352 -7.675 24.357 1.00 0.00 ATOM 1013 CD1 LEU A 129 89.646 -8.544 25.389 1.00 0.00 ATOM 1014 CD2 LEU A 129 89.792 -6.259 24.380 1.00 0.00 ATOM 1015 O LEU A 129 94.413 -5.498 24.625 1.00 0.00 ATOM 1016 C LEU A 129 94.109 -6.620 24.208 1.00 0.00 ATOM 1017 N LYS A 130 94.940 -7.656 24.244 1.00 0.00 ATOM 1018 CA LYS A 130 96.273 -7.546 24.815 1.00 0.00 ATOM 1019 CB LYS A 130 96.914 -8.929 24.950 1.00 0.00 ATOM 1020 CG LYS A 130 98.320 -8.909 25.529 1.00 0.00 ATOM 1021 CD LYS A 130 98.877 -10.316 25.674 1.00 0.00 ATOM 1022 CE LYS A 130 100.289 -10.294 26.239 1.00 0.00 ATOM 1023 NZ LYS A 130 100.859 -11.664 26.355 1.00 0.00 ATOM 1024 O LYS A 130 97.743 -5.676 24.423 1.00 0.00 ATOM 1025 C LYS A 130 97.252 -6.708 23.963 1.00 0.00 ATOM 1026 N GLU A 131 97.503 -7.105 22.780 1.00 0.00 ATOM 1027 CA GLU A 131 98.475 -6.428 21.923 1.00 0.00 ATOM 1028 CB GLU A 131 98.929 -7.337 20.778 1.00 0.00 ATOM 1029 CG GLU A 131 99.727 -8.551 21.229 1.00 0.00 ATOM 1030 CD GLU A 131 100.141 -9.438 20.072 1.00 0.00 ATOM 1031 OE1 GLU A 131 99.846 -9.078 18.913 1.00 0.00 ATOM 1032 OE2 GLU A 131 100.759 -10.494 20.324 1.00 0.00 ATOM 1033 O GLU A 131 98.931 -4.349 20.850 1.00 0.00 ATOM 1034 C GLU A 131 98.067 -5.141 21.217 1.00 0.00 ATOM 1035 N GLU A 132 96.774 -4.904 21.023 1.00 0.00 ATOM 1036 CA GLU A 132 96.373 -3.691 20.322 1.00 0.00 ATOM 1037 CB GLU A 132 95.576 -4.037 19.064 1.00 0.00 ATOM 1038 CG GLU A 132 96.360 -4.829 18.030 1.00 0.00 ATOM 1039 CD GLU A 132 95.619 -4.966 16.714 1.00 0.00 ATOM 1040 OE1 GLU A 132 94.481 -5.480 16.723 1.00 0.00 ATOM 1041 OE2 GLU A 132 96.177 -4.558 15.674 1.00 0.00 ATOM 1042 O GLU A 132 94.976 -1.764 20.559 1.00 0.00 ATOM 1043 C GLU A 132 95.517 -2.720 21.114 1.00 0.00 ATOM 1044 N SER A 133 95.415 -2.960 22.415 1.00 0.00 ATOM 1045 CA SER A 133 94.629 -2.107 23.297 1.00 0.00 ATOM 1046 CB SER A 133 95.267 -0.723 23.436 1.00 0.00 ATOM 1047 OG SER A 133 96.562 -0.813 24.005 1.00 0.00 ATOM 1048 O SER A 133 92.791 -0.811 22.417 1.00 0.00 ATOM 1049 C SER A 133 93.215 -1.919 22.759 1.00 0.00 ATOM 1050 N GLU A 134 92.417 -3.108 22.861 1.00 0.00 ATOM 1051 CA GLU A 134 91.040 -3.111 22.412 1.00 0.00 ATOM 1052 CB GLU A 134 90.887 -3.978 21.160 1.00 0.00 ATOM 1053 CG GLU A 134 91.595 -3.428 19.933 1.00 0.00 ATOM 1054 CD GLU A 134 91.012 -2.109 19.464 1.00 0.00 ATOM 1055 OE1 GLU A 134 89.769 -2.002 19.398 1.00 0.00 ATOM 1056 OE2 GLU A 134 91.796 -1.186 19.163 1.00 0.00 ATOM 1057 O GLU A 134 90.516 -4.701 24.119 1.00 0.00 ATOM 1058 C GLU A 134 90.186 -3.672 23.534 1.00 0.00 ATOM 1059 N ILE A 135 89.102 -2.979 23.852 1.00 0.00 ATOM 1060 CA ILE A 135 88.195 -3.443 24.883 1.00 0.00 ATOM 1061 CB ILE A 135 87.618 -2.270 25.697 1.00 0.00 ATOM 1062 CG1 ILE A 135 88.740 -1.509 26.404 1.00 0.00 ATOM 1063 CG2 ILE A 135 86.645 -2.780 26.748 1.00 0.00 ATOM 1064 CD1 ILE A 135 88.283 -0.238 27.084 1.00 0.00 ATOM 1065 O ILE A 135 87.008 -5.408 24.192 1.00 0.00 ATOM 1066 C ILE A 135 87.074 -4.184 24.152 1.00 0.00 ATOM 1067 N ILE A 136 86.234 -3.444 23.437 1.00 0.00 ATOM 1068 CA ILE A 136 85.153 -4.043 22.664 1.00 0.00 ATOM 1069 CB ILE A 136 83.800 -3.908 23.386 1.00 0.00 ATOM 1070 CG1 ILE A 136 83.462 -2.434 23.614 1.00 0.00 ATOM 1071 CG2 ILE A 136 83.844 -4.606 24.737 1.00 0.00 ATOM 1072 CD1 ILE A 136 82.059 -2.203 24.135 1.00 0.00 ATOM 1073 O ILE A 136 85.509 -2.181 21.203 1.00 0.00 ATOM 1074 C ILE A 136 85.080 -3.325 21.325 1.00 0.00 ATOM 1075 N TYR A 137 84.541 -4.002 20.322 1.00 0.00 ATOM 1076 CA TYR A 137 84.444 -3.433 18.986 1.00 0.00 ATOM 1077 CB TYR A 137 84.610 -4.524 17.926 1.00 0.00 ATOM 1078 CG TYR A 137 86.012 -5.085 17.839 1.00 0.00 ATOM 1079 CD1 TYR A 137 86.356 -6.244 18.521 1.00 0.00 ATOM 1080 CD2 TYR A 137 86.984 -4.454 17.073 1.00 0.00 ATOM 1081 CE1 TYR A 137 87.635 -6.765 18.448 1.00 0.00 ATOM 1082 CE2 TYR A 137 88.268 -4.960 16.989 1.00 0.00 ATOM 1083 CZ TYR A 137 88.588 -6.125 17.685 1.00 0.00 ATOM 1084 OH TYR A 137 89.860 -6.641 17.608 1.00 0.00 ATOM 1085 O TYR A 137 82.073 -3.255 19.189 1.00 0.00 ATOM 1086 C TYR A 137 83.101 -2.763 18.742 1.00 0.00 ATOM 1087 N ASP A 138 83.111 -1.636 18.040 1.00 0.00 ATOM 1088 CA ASP A 138 81.866 -0.935 17.730 1.00 0.00 ATOM 1089 CB ASP A 138 82.034 0.538 17.594 1.00 0.00 ATOM 1090 CG ASP A 138 82.568 1.173 18.866 1.00 0.00 ATOM 1091 OD1 ASP A 138 81.975 0.942 19.944 1.00 0.00 ATOM 1092 OD2 ASP A 138 83.572 1.916 18.785 1.00 0.00 ATOM 1093 O ASP A 138 80.037 -1.703 16.383 1.00 0.00 ATOM 1094 C ASP A 138 81.252 -1.562 16.490 1.00 0.00 ATOM 1095 N PHE A 139 82.113 -1.945 15.555 1.00 0.00 ATOM 1096 CA PHE A 139 81.660 -2.529 14.314 1.00 0.00 ATOM 1097 CB PHE A 139 81.525 -1.418 13.270 1.00 0.00 ATOM 1098 CG PHE A 139 81.024 -1.881 11.925 1.00 0.00 ATOM 1099 CD1 PHE A 139 79.689 -2.188 11.738 1.00 0.00 ATOM 1100 CD2 PHE A 139 81.890 -2.025 10.835 1.00 0.00 ATOM 1101 CE1 PHE A 139 79.232 -2.623 10.505 1.00 0.00 ATOM 1102 CE2 PHE A 139 81.421 -2.444 9.607 1.00 0.00 ATOM 1103 CZ PHE A 139 80.082 -2.738 9.427 1.00 0.00 ATOM 1104 O PHE A 139 83.880 -3.309 13.875 1.00 0.00 ATOM 1105 C PHE A 139 82.673 -3.506 13.747 1.00 0.00 ATOM 1106 N CYS A 140 82.161 -4.552 13.104 1.00 0.00 ATOM 1107 CA CYS A 140 82.997 -5.573 12.491 1.00 0.00 ATOM 1108 CB CYS A 140 82.887 -6.886 13.269 1.00 0.00 ATOM 1109 SG CYS A 140 83.917 -8.224 12.625 1.00 0.00 ATOM 1110 O CYS A 140 81.369 -6.061 10.790 1.00 0.00 ATOM 1111 C CYS A 140 82.553 -5.830 11.051 1.00 0.00 ATOM 1112 N MET A 141 83.493 -5.771 10.115 1.00 0.00 ATOM 1113 CA MET A 141 83.161 -6.034 8.722 1.00 0.00 ATOM 1114 CB MET A 141 83.549 -4.810 7.868 1.00 0.00 ATOM 1115 CG MET A 141 83.464 -5.011 6.361 1.00 0.00 ATOM 1116 SD MET A 141 81.827 -4.685 5.687 1.00 0.00 ATOM 1117 CE MET A 141 82.126 -3.080 4.933 1.00 0.00 ATOM 1118 O MET A 141 84.940 -7.603 8.354 1.00 0.00 ATOM 1119 C MET A 141 83.725 -7.401 8.343 1.00 0.00 ATOM 1120 N CYS A 142 82.836 -8.346 8.041 1.00 0.00 ATOM 1121 CA CYS A 142 83.247 -9.694 7.662 1.00 0.00 ATOM 1122 CB CYS A 142 82.258 -10.727 8.205 1.00 0.00 ATOM 1123 SG CYS A 142 82.171 -10.802 10.010 1.00 0.00 ATOM 1124 O CYS A 142 82.284 -9.683 5.466 1.00 0.00 ATOM 1125 C CYS A 142 83.300 -9.828 6.149 1.00 0.00 ATOM 1126 N ASN A 143 84.488 -10.099 5.624 1.00 0.00 ATOM 1127 CA ASN A 143 84.646 -10.244 4.190 1.00 0.00 ATOM 1128 CB ASN A 143 84.792 -8.873 3.526 1.00 0.00 ATOM 1129 CG ASN A 143 84.664 -8.940 2.017 1.00 0.00 ATOM 1130 ND2 ASN A 143 85.305 -8.003 1.328 1.00 0.00 ATOM 1131 OD1 ASN A 143 83.997 -9.824 1.480 1.00 0.00 ATOM 1132 O ASN A 143 86.565 -10.754 2.831 1.00 0.00 ATOM 1133 C ASN A 143 85.880 -11.067 3.802 1.00 0.00 ATOM 1134 N PRO A 144 86.174 -12.113 4.564 1.00 0.00 ATOM 1135 CA PRO A 144 87.298 -13.009 4.272 1.00 0.00 ATOM 1136 CB PRO A 144 87.372 -13.919 5.501 1.00 0.00 ATOM 1137 CG PRO A 144 85.972 -13.972 6.012 1.00 0.00 ATOM 1138 CD PRO A 144 85.387 -12.610 5.766 1.00 0.00 ATOM 1139 O PRO A 144 86.063 -13.961 2.444 1.00 0.00 ATOM 1140 C PRO A 144 87.148 -13.858 3.015 1.00 0.00 ATOM 1141 N PRO A 145 88.252 -14.474 2.564 1.00 0.00 ATOM 1142 CA PRO A 145 88.213 -15.318 1.369 1.00 0.00 ATOM 1143 CB PRO A 145 89.688 -15.565 1.042 1.00 0.00 ATOM 1144 CG PRO A 145 90.384 -15.468 2.358 1.00 0.00 ATOM 1145 CD PRO A 145 89.661 -14.402 3.134 1.00 0.00 ATOM 1146 O PRO A 145 87.347 -16.941 2.894 1.00 0.00 ATOM 1147 C PRO A 145 87.468 -16.596 1.720 1.00 0.00 ATOM 1148 N PHE A 146 86.955 -17.292 0.711 1.00 0.00 ATOM 1149 CA PHE A 146 86.238 -18.531 0.971 1.00 0.00 ATOM 1150 CB PHE A 146 85.475 -18.976 -0.297 1.00 0.00 ATOM 1151 CG PHE A 146 84.520 -17.948 -0.834 1.00 0.00 ATOM 1152 CD1 PHE A 146 83.205 -17.893 -0.375 1.00 0.00 ATOM 1153 CD2 PHE A 146 84.928 -17.038 -1.808 1.00 0.00 ATOM 1154 CE1 PHE A 146 82.311 -16.944 -0.885 1.00 0.00 ATOM 1155 CE2 PHE A 146 84.047 -16.087 -2.324 1.00 0.00 ATOM 1156 CZ PHE A 146 82.734 -16.039 -1.861 1.00 0.00 ATOM 1157 O PHE A 146 88.178 -19.946 1.088 1.00 0.00 ATOM 1158 C PHE A 146 87.186 -19.505 1.671 1.00 0.00 ATOM 1159 N PHE A 147 86.865 -19.848 2.914 1.00 0.00 ATOM 1160 CA PHE A 147 87.684 -20.774 3.700 1.00 0.00 ATOM 1161 CB PHE A 147 87.650 -20.310 5.191 1.00 0.00 ATOM 1162 CG PHE A 147 88.484 -19.092 5.469 1.00 0.00 ATOM 1163 CD1 PHE A 147 89.820 -19.056 5.063 1.00 0.00 ATOM 1164 CD2 PHE A 147 87.947 -17.978 6.105 1.00 0.00 ATOM 1165 CE1 PHE A 147 90.608 -17.927 5.281 1.00 0.00 ATOM 1166 CE2 PHE A 147 88.729 -16.839 6.328 1.00 0.00 ATOM 1167 CZ PHE A 147 90.065 -16.818 5.912 1.00 0.00 ATOM 1168 O PHE A 147 88.148 -23.127 3.648 1.00 0.00 ATOM 1169 C PHE A 147 87.368 -22.223 3.348 1.00 0.00 ATOM 1170 N ALA A 148 86.278 -22.314 2.461 1.00 0.00 ATOM 1171 CA ALA A 148 85.899 -23.669 2.083 1.00 0.00 ATOM 1172 CB ALA A 148 84.562 -24.039 2.706 1.00 0.00 ATOM 1173 O ALA A 148 84.878 -23.235 -0.044 1.00 0.00 ATOM 1174 C ALA A 148 85.769 -23.816 0.570 1.00 0.00 ATOM 1175 N ASN A 149 86.673 -24.591 -0.021 1.00 0.00 ATOM 1176 CA ASN A 149 86.669 -24.829 -1.460 1.00 0.00 ATOM 1177 CB ASN A 149 88.094 -24.791 -2.015 1.00 0.00 ATOM 1178 CG ASN A 149 88.729 -23.419 -1.891 1.00 0.00 ATOM 1179 ND2 ASN A 149 90.053 -23.389 -1.797 1.00 0.00 ATOM 1180 OD1 ASN A 149 88.036 -22.401 -1.881 1.00 0.00 ATOM 1181 O ASN A 149 85.526 -26.409 -2.857 1.00 0.00 ATOM 1182 C ASN A 149 86.060 -26.189 -1.770 1.00 0.00 ATOM 1183 N GLN A 150 86.172 -27.106 -0.815 1.00 0.00 ATOM 1184 CA GLN A 150 85.637 -28.455 -0.969 1.00 0.00 ATOM 1185 CB GLN A 150 86.778 -29.459 -1.145 1.00 0.00 ATOM 1186 CG GLN A 150 87.617 -29.232 -2.393 1.00 0.00 ATOM 1187 CD GLN A 150 88.706 -30.274 -2.559 1.00 0.00 ATOM 1188 OE1 GLN A 150 88.924 -31.105 -1.678 1.00 0.00 ATOM 1189 NE2 GLN A 150 89.393 -30.232 -3.695 1.00 0.00 ATOM 1190 O GLN A 150 85.161 -28.416 1.383 1.00 0.00 ATOM 1191 C GLN A 150 84.833 -28.831 0.271 1.00 0.00 ATOM 1192 N LEU A 151 83.777 -29.617 0.066 1.00 0.00 ATOM 1193 CA LEU A 151 82.936 -30.041 1.176 1.00 0.00 ATOM 1194 CB LEU A 151 81.795 -30.929 0.675 1.00 0.00 ATOM 1195 CG LEU A 151 80.715 -30.238 -0.160 1.00 0.00 ATOM 1196 CD1 LEU A 151 79.750 -31.260 -0.741 1.00 0.00 ATOM 1197 CD2 LEU A 151 79.920 -29.260 0.690 1.00 0.00 ATOM 1198 O LEU A 151 83.588 -30.643 3.410 1.00 0.00 ATOM 1199 C LEU A 151 83.742 -30.835 2.202 1.00 0.00 ATOM 1200 N GLU A 152 84.577 -31.752 1.724 1.00 0.00 ATOM 1201 CA GLU A 152 85.390 -32.574 2.613 1.00 0.00 ATOM 1202 CB GLU A 152 86.262 -33.536 1.805 1.00 0.00 ATOM 1203 CG GLU A 152 85.489 -34.654 1.125 1.00 0.00 ATOM 1204 CD GLU A 152 86.368 -35.513 0.236 1.00 0.00 ATOM 1205 OE1 GLU A 152 87.566 -35.189 0.094 1.00 0.00 ATOM 1206 OE2 GLU A 152 85.858 -36.510 -0.318 1.00 0.00 ATOM 1207 O GLU A 152 86.458 -31.984 4.688 1.00 0.00 ATOM 1208 C GLU A 152 86.316 -31.733 3.486 1.00 0.00 ATOM 1209 N ALA A 153 86.930 -30.716 2.901 1.00 0.00 ATOM 1210 CA ALA A 153 87.841 -29.869 3.669 1.00 0.00 ATOM 1211 CB ALA A 153 88.601 -28.953 2.674 1.00 0.00 ATOM 1212 O ALA A 153 87.633 -28.773 5.859 1.00 0.00 ATOM 1213 C ALA A 153 87.098 -29.037 4.744 1.00 0.00 ATOM 1214 N LYS A 154 85.872 -28.614 4.445 1.00 0.00 ATOM 1215 CA LYS A 154 85.086 -27.836 5.402 1.00 0.00 ATOM 1216 CB LYS A 154 83.750 -27.420 4.784 1.00 0.00 ATOM 1217 CG LYS A 154 82.884 -26.566 5.696 1.00 0.00 ATOM 1218 CD LYS A 154 81.610 -26.125 4.994 1.00 0.00 ATOM 1219 CE LYS A 154 80.731 -25.295 5.915 1.00 0.00 ATOM 1220 NZ LYS A 154 79.472 -24.867 5.244 1.00 0.00 ATOM 1221 O LYS A 154 84.920 -28.144 7.768 1.00 0.00 ATOM 1222 C LYS A 154 84.802 -28.649 6.651 1.00 0.00 ATOM 1223 N GLY A 155 84.434 -29.906 6.459 1.00 0.00 ATOM 1224 CA GLY A 155 84.135 -30.778 7.585 1.00 0.00 ATOM 1225 O GLY A 155 85.210 -31.029 9.705 1.00 0.00 ATOM 1226 C GLY A 155 85.347 -31.001 8.480 1.00 0.00 ATOM 1227 N VAL A 156 86.521 -31.160 7.879 1.00 0.00 ATOM 1228 CA VAL A 156 87.736 -31.390 8.662 1.00 0.00 ATOM 1229 CB VAL A 156 88.958 -31.618 7.754 1.00 0.00 ATOM 1230 CG1 VAL A 156 90.235 -31.656 8.580 1.00 0.00 ATOM 1231 CG2 VAL A 156 88.829 -32.939 7.010 1.00 0.00 ATOM 1232 O VAL A 156 88.159 -30.311 10.788 1.00 0.00 ATOM 1233 C VAL A 156 87.997 -30.185 9.548 1.00 0.00 ATOM 1234 N ASN A 157 88.052 -28.968 8.988 1.00 0.00 ATOM 1235 CA ASN A 157 88.260 -27.780 9.775 1.00 0.00 ATOM 1236 CB ASN A 157 88.387 -26.564 8.856 1.00 0.00 ATOM 1237 CG ASN A 157 89.676 -26.571 8.058 1.00 0.00 ATOM 1238 ND2 ASN A 157 89.692 -25.829 6.956 1.00 0.00 ATOM 1239 OD1 ASN A 157 90.645 -27.235 8.429 1.00 0.00 ATOM 1240 O ASN A 157 87.266 -27.005 11.849 1.00 0.00 ATOM 1241 C ASN A 157 87.080 -27.529 10.748 1.00 0.00 ATOM 1242 N SER A 158 85.744 -27.870 10.363 1.00 0.00 ATOM 1243 CA SER A 158 84.565 -27.625 11.206 1.00 0.00 ATOM 1244 CB SER A 158 83.298 -28.131 10.514 1.00 0.00 ATOM 1245 OG SER A 158 83.025 -27.387 9.339 1.00 0.00 ATOM 1246 O SER A 158 84.139 -27.950 13.537 1.00 0.00 ATOM 1247 C SER A 158 84.717 -28.361 12.532 1.00 0.00 ATOM 1248 N ARG A 159 85.491 -29.440 12.545 1.00 0.00 ATOM 1249 CA ARG A 159 85.693 -30.182 13.793 1.00 0.00 ATOM 1250 CB ARG A 159 86.393 -31.514 13.519 1.00 0.00 ATOM 1251 CG ARG A 159 85.535 -32.525 12.776 1.00 0.00 ATOM 1252 CD ARG A 159 86.316 -33.790 12.464 1.00 0.00 ATOM 1253 NE ARG A 159 87.381 -33.549 11.493 1.00 0.00 ATOM 1254 CZ ARG A 159 88.186 -34.494 11.018 1.00 0.00 ATOM 1255 NH1 ARG A 159 89.127 -34.183 10.137 1.00 0.00 ATOM 1256 NH2 ARG A 159 88.049 -35.749 11.426 1.00 0.00 ATOM 1257 O ARG A 159 86.732 -29.826 15.923 1.00 0.00 ATOM 1258 C ARG A 159 86.547 -29.405 14.780 1.00 0.00 ATOM 1259 N ASN A 160 87.068 -28.269 14.326 1.00 0.00 ATOM 1260 CA ASN A 160 87.891 -27.424 15.191 1.00 0.00 ATOM 1261 CB ASN A 160 89.364 -27.519 14.788 1.00 0.00 ATOM 1262 CG ASN A 160 89.940 -28.904 15.012 1.00 0.00 ATOM 1263 ND2 ASN A 160 90.142 -29.641 13.927 1.00 0.00 ATOM 1264 OD1 ASN A 160 90.200 -29.303 16.147 1.00 0.00 ATOM 1265 O ASN A 160 87.870 -25.266 14.136 1.00 0.00 ATOM 1266 C ASN A 160 87.385 -26.001 15.016 1.00 0.00 ATOM 1267 N PRO A 161 86.382 -25.590 15.787 1.00 0.00 ATOM 1268 CA PRO A 161 85.746 -24.326 15.483 1.00 0.00 ATOM 1269 CB PRO A 161 84.764 -24.118 16.637 1.00 0.00 ATOM 1270 CG PRO A 161 84.442 -25.497 17.105 1.00 0.00 ATOM 1271 CD PRO A 161 85.718 -26.282 17.003 1.00 0.00 ATOM 1272 O PRO A 161 87.659 -23.002 16.215 1.00 0.00 ATOM 1273 C PRO A 161 86.734 -23.177 15.405 1.00 0.00 ATOM 1274 N ARG A 162 86.527 -22.307 14.438 1.00 0.00 ATOM 1275 CA ARG A 162 87.282 -21.060 14.237 1.00 0.00 ATOM 1276 CB ARG A 162 86.671 -20.227 15.709 1.00 0.00 ATOM 1277 CG ARG A 162 85.367 -20.763 16.333 1.00 0.00 ATOM 1278 CD ARG A 162 85.036 -20.177 17.706 1.00 0.00 ATOM 1279 NE ARG A 162 86.145 -20.299 18.646 1.00 0.00 ATOM 1280 CZ ARG A 162 86.550 -21.440 19.200 1.00 0.00 ATOM 1281 NH1 ARG A 162 85.916 -22.592 18.918 1.00 0.00 ATOM 1282 NH2 ARG A 162 87.639 -21.438 19.986 1.00 0.00 ATOM 1283 O ARG A 162 89.523 -20.266 13.752 1.00 0.00 ATOM 1284 C ARG A 162 88.741 -21.261 13.853 1.00 0.00 ATOM 1285 N ARG A 163 89.195 -22.487 13.599 1.00 0.00 ATOM 1286 CA ARG A 163 90.600 -22.671 13.245 1.00 0.00 ATOM 1287 CB ARG A 163 90.958 -24.157 13.156 1.00 0.00 ATOM 1288 CG ARG A 163 92.437 -24.379 12.887 1.00 0.00 ATOM 1289 CD ARG A 163 92.846 -25.836 12.977 1.00 0.00 ATOM 1290 NE ARG A 163 94.234 -26.003 12.555 1.00 0.00 ATOM 1291 CZ ARG A 163 94.639 -25.943 11.289 1.00 0.00 ATOM 1292 NH1 ARG A 163 93.760 -25.730 10.317 1.00 0.00 ATOM 1293 NH2 ARG A 163 95.926 -26.072 10.996 1.00 0.00 ATOM 1294 O ARG A 163 91.932 -21.223 11.870 1.00 0.00 ATOM 1295 C ARG A 163 90.945 -21.956 11.937 1.00 0.00 ATOM 1296 N PRO A 164 90.130 -22.145 10.884 1.00 0.00 ATOM 1297 CA PRO A 164 90.418 -21.475 9.613 1.00 0.00 ATOM 1298 CB PRO A 164 89.232 -21.877 8.743 1.00 0.00 ATOM 1299 CG PRO A 164 88.953 -23.268 9.217 1.00 0.00 ATOM 1300 CD PRO A 164 89.027 -23.111 10.722 1.00 0.00 ATOM 1301 O PRO A 164 91.420 -19.333 9.212 1.00 0.00 ATOM 1302 C PRO A 164 90.534 -19.962 9.784 1.00 0.00 ATOM 1303 N PRO A 165 84.624 -18.080 8.355 1.00 0.00 ATOM 1304 CA PRO A 165 83.646 -17.195 9.009 1.00 0.00 ATOM 1305 CB PRO A 165 82.452 -17.246 8.055 1.00 0.00 ATOM 1306 CG PRO A 165 83.143 -17.329 6.707 1.00 0.00 ATOM 1307 CD PRO A 165 84.204 -18.383 6.969 1.00 0.00 ATOM 1308 O PRO A 165 83.296 -16.833 11.372 1.00 0.00 ATOM 1309 C PRO A 165 83.339 -17.664 10.459 1.00 0.00 ATOM 1310 N PRO A 166 83.113 -18.983 10.686 1.00 0.00 ATOM 1311 CA PRO A 166 82.839 -19.477 12.043 1.00 0.00 ATOM 1312 CB PRO A 166 82.708 -20.988 11.830 1.00 0.00 ATOM 1313 CG PRO A 166 82.154 -21.097 10.480 1.00 0.00 ATOM 1314 CD PRO A 166 82.946 -20.075 9.708 1.00 0.00 ATOM 1315 O PRO A 166 83.839 -19.206 14.142 1.00 0.00 ATOM 1316 C PRO A 166 84.020 -19.371 12.966 1.00 0.00 ATOM 1317 N SER A 167 85.206 -19.396 12.409 1.00 0.00 ATOM 1318 CA SER A 167 86.398 -19.228 13.183 1.00 0.00 ATOM 1319 CB SER A 167 87.578 -19.040 11.989 1.00 0.00 ATOM 1320 OG SER A 167 87.420 -19.847 10.846 1.00 0.00 ATOM 1321 O SER A 167 86.721 -17.467 14.758 1.00 0.00 ATOM 1322 C SER A 167 86.405 -17.772 13.610 1.00 0.00 ATOM 1323 N SER A 168 85.164 -17.073 13.439 1.00 0.00 ATOM 1324 CA SER A 168 85.733 -15.816 13.926 1.00 0.00 ATOM 1325 CB SER A 168 86.221 -14.960 12.755 1.00 0.00 ATOM 1326 OG SER A 168 85.137 -14.537 11.946 1.00 0.00 ATOM 1327 O SER A 168 85.104 -14.257 15.640 1.00 0.00 ATOM 1328 C SER A 168 84.730 -14.977 14.709 1.00 0.00 ATOM 1329 N VAL A 169 83.458 -15.100 14.359 1.00 0.00 ATOM 1330 CA VAL A 169 82.415 -14.373 15.067 1.00 0.00 ATOM 1331 CB VAL A 169 81.048 -14.531 14.374 1.00 0.00 ATOM 1332 CG1 VAL A 169 79.945 -13.926 15.228 1.00 0.00 ATOM 1333 CG2 VAL A 169 81.051 -13.829 13.024 1.00 0.00 ATOM 1334 O VAL A 169 82.194 -14.206 17.456 1.00 0.00 ATOM 1335 C VAL A 169 82.336 -14.948 16.481 1.00 0.00 ATOM 1336 N ASN A 170 82.439 -16.271 16.584 1.00 0.00 ATOM 1337 CA ASN A 170 82.391 -16.941 17.879 1.00 0.00 ATOM 1338 CB ASN A 170 82.358 -18.460 17.696 1.00 0.00 ATOM 1339 CG ASN A 170 81.021 -18.955 17.181 1.00 0.00 ATOM 1340 ND2 ASN A 170 81.019 -20.147 16.593 1.00 0.00 ATOM 1341 OD1 ASN A 170 80.004 -18.274 17.309 1.00 0.00 ATOM 1342 O ASN A 170 83.540 -16.433 19.927 1.00 0.00 ATOM 1343 C ASN A 170 83.624 -16.580 18.709 1.00 0.00 ATOM 1344 N THR A 171 84.753 -16.398 18.033 1.00 0.00 ATOM 1345 CA THR A 171 86.003 -16.041 18.694 1.00 0.00 ATOM 1346 CB THR A 171 87.192 -16.086 17.717 1.00 0.00 ATOM 1347 CG2 THR A 171 88.476 -15.673 18.420 1.00 0.00 ATOM 1348 OG1 THR A 171 87.349 -17.418 17.211 1.00 0.00 ATOM 1349 O THR A 171 86.316 -14.371 20.396 1.00 0.00 ATOM 1350 C THR A 171 85.902 -14.624 19.263 1.00 0.00 ATOM 1351 N GLY A 172 85.349 -13.704 18.478 1.00 0.00 ATOM 1352 CA GLY A 172 85.179 -12.324 18.924 1.00 0.00 ATOM 1353 O GLY A 172 84.661 -11.631 21.160 1.00 0.00 ATOM 1354 C GLY A 172 84.331 -12.311 20.183 1.00 0.00 ATOM 1355 N GLY A 173 83.242 -13.090 20.166 1.00 0.00 ATOM 1356 CA GLY A 173 82.360 -13.161 21.322 1.00 0.00 ATOM 1357 O GLY A 173 82.950 -13.214 23.653 1.00 0.00 ATOM 1358 C GLY A 173 83.061 -13.746 22.549 1.00 0.00 ATOM 1359 N ILE A 174 83.791 -14.843 22.355 1.00 0.00 ATOM 1360 CA ILE A 174 84.508 -15.485 23.447 1.00 0.00 ATOM 1361 CB ILE A 174 85.322 -16.695 22.953 1.00 0.00 ATOM 1362 CG1 ILE A 174 84.386 -17.813 22.487 1.00 0.00 ATOM 1363 CG2 ILE A 174 86.202 -17.237 24.069 1.00 0.00 ATOM 1364 CD1 ILE A 174 85.089 -18.925 21.740 1.00 0.00 ATOM 1365 O ILE A 174 85.573 -14.473 25.354 1.00 0.00 ATOM 1366 C ILE A 174 85.487 -14.527 24.123 1.00 0.00 ATOM 1367 N THR A 175 86.245 -13.790 23.315 1.00 0.00 ATOM 1368 CA THR A 175 87.231 -12.839 23.824 1.00 0.00 ATOM 1369 CB THR A 175 88.247 -12.442 22.735 1.00 0.00 ATOM 1370 CG2 THR A 175 89.005 -13.665 22.245 1.00 0.00 ATOM 1371 OG1 THR A 175 87.557 -11.849 21.629 1.00 0.00 ATOM 1372 O THR A 175 87.385 -10.603 24.647 1.00 0.00 ATOM 1373 C THR A 175 86.643 -11.532 24.336 1.00 0.00 ATOM 1374 N GLU A 176 85.318 -11.462 24.421 1.00 0.00 ATOM 1375 CA GLU A 176 84.655 -10.265 24.914 1.00 0.00 ATOM 1376 CB GLU A 176 85.107 -9.951 26.342 1.00 0.00 ATOM 1377 CG GLU A 176 84.811 -11.056 27.344 1.00 0.00 ATOM 1378 CD GLU A 176 85.222 -10.688 28.755 1.00 0.00 ATOM 1379 OE1 GLU A 176 85.746 -9.571 28.948 1.00 0.00 ATOM 1380 OE2 GLU A 176 85.021 -11.516 29.667 1.00 0.00 ATOM 1381 O GLU A 176 84.977 -7.911 24.675 1.00 0.00 ATOM 1382 C GLU A 176 84.911 -9.003 24.111 1.00 0.00 ATOM 1383 N ILE A 177 85.041 -9.147 22.793 1.00 0.00 ATOM 1384 CA ILE A 177 85.292 -8.009 21.908 1.00 0.00 ATOM 1385 CB ILE A 177 85.749 -8.392 20.533 1.00 0.00 ATOM 1386 CG1 ILE A 177 87.105 -9.103 20.649 1.00 0.00 ATOM 1387 CG2 ILE A 177 85.893 -7.153 19.649 1.00 0.00 ATOM 1388 CD1 ILE A 177 88.231 -8.209 21.265 1.00 0.00 ATOM 1389 O ILE A 177 83.979 -6.006 21.804 1.00 0.00 ATOM 1390 C ILE A 177 83.998 -7.234 21.687 1.00 0.00 ATOM 1391 N MET A 178 82.851 -8.024 21.799 1.00 0.00 ATOM 1392 CA MET A 178 81.558 -7.399 21.535 1.00 0.00 ATOM 1393 CB MET A 178 80.714 -8.513 20.913 1.00 0.00 ATOM 1394 CG MET A 178 81.295 -9.090 19.632 1.00 0.00 ATOM 1395 SD MET A 178 80.307 -10.445 18.968 1.00 0.00 ATOM 1396 CE MET A 178 81.141 -10.742 17.412 1.00 0.00 ATOM 1397 O MET A 178 80.949 -7.339 23.844 1.00 0.00 ATOM 1398 C MET A 178 80.809 -6.839 22.727 1.00 0.00 ATOM 1399 N ALA A 179 80.027 -5.793 22.489 1.00 0.00 ATOM 1400 CA ALA A 179 79.204 -5.205 23.534 1.00 0.00 ATOM 1401 CB ALA A 179 79.827 -3.910 24.032 1.00 0.00 ATOM 1402 O ALA A 179 77.658 -4.919 21.727 1.00 0.00 ATOM 1403 C ALA A 179 77.830 -4.925 22.949 1.00 0.00 ATOM 1404 N GLU A 180 76.847 -4.726 23.816 1.00 0.00 ATOM 1405 CA GLU A 180 75.495 -4.457 23.353 1.00 0.00 ATOM 1406 CB GLU A 180 74.786 -3.794 24.398 1.00 0.00 ATOM 1407 CG GLU A 180 75.333 -3.089 25.643 1.00 0.00 ATOM 1408 CD GLU A 180 75.953 -4.053 26.656 1.00 0.00 ATOM 1409 OE1 GLU A 180 75.226 -4.559 27.539 1.00 0.00 ATOM 1410 OE2 GLU A 180 77.173 -4.307 26.565 1.00 0.00 ATOM 1411 O GLU A 180 76.019 -2.197 22.742 1.00 0.00 ATOM 1412 C GLU A 180 75.534 -3.272 22.391 1.00 0.00 ATOM 1413 N GLY A 181 75.060 -3.480 21.167 1.00 0.00 ATOM 1414 CA GLY A 181 75.068 -2.405 20.191 1.00 0.00 ATOM 1415 O GLY A 181 76.111 -1.853 18.116 1.00 0.00 ATOM 1416 C GLY A 181 76.137 -2.562 19.123 1.00 0.00 ATOM 1417 N GLY A 182 77.086 -3.473 19.333 1.00 0.00 ATOM 1418 CA GLY A 182 78.132 -3.688 18.340 1.00 0.00 ATOM 1419 O GLY A 182 76.605 -5.012 17.044 1.00 0.00 ATOM 1420 C GLY A 182 77.461 -4.130 17.046 1.00 0.00 ATOM 1421 N GLU A 183 77.866 -3.505 15.949 1.00 0.00 ATOM 1422 CA GLU A 183 77.313 -3.806 14.643 1.00 0.00 ATOM 1423 CB GLU A 183 77.109 -2.522 13.838 1.00 0.00 ATOM 1424 CG GLU A 183 76.539 -2.745 12.446 1.00 0.00 ATOM 1425 CD GLU A 183 76.364 -1.453 11.674 1.00 0.00 ATOM 1426 OE1 GLU A 183 76.690 -0.380 12.228 1.00 0.00 ATOM 1427 OE2 GLU A 183 75.901 -1.511 10.515 1.00 0.00 ATOM 1428 O GLU A 183 79.390 -4.395 13.621 1.00 0.00 ATOM 1429 C GLU A 183 78.223 -4.714 13.837 1.00 0.00 ATOM 1430 N LEU A 184 77.692 -5.855 13.419 1.00 0.00 ATOM 1431 CA LEU A 184 78.437 -6.778 12.575 1.00 0.00 ATOM 1432 CB LEU A 184 78.289 -8.213 13.088 1.00 0.00 ATOM 1433 CG LEU A 184 78.785 -8.479 14.510 1.00 0.00 ATOM 1434 CD1 LEU A 184 78.499 -9.916 14.918 1.00 0.00 ATOM 1435 CD2 LEU A 184 80.285 -8.247 14.606 1.00 0.00 ATOM 1436 O LEU A 184 76.613 -6.705 11.025 1.00 0.00 ATOM 1437 C LEU A 184 77.829 -6.626 11.184 1.00 0.00 ATOM 1438 N GLU A 185 78.668 -6.357 10.160 1.00 0.00 ATOM 1439 CA GLU A 185 78.201 -6.202 8.789 1.00 0.00 ATOM 1440 CB GLU A 185 78.548 -4.810 8.258 1.00 0.00 ATOM 1441 CG GLU A 185 78.042 -4.538 6.851 1.00 0.00 ATOM 1442 CD GLU A 185 78.401 -3.151 6.361 1.00 0.00 ATOM 1443 OE1 GLU A 185 79.109 -2.426 7.092 1.00 0.00 ATOM 1444 OE2 GLU A 185 77.976 -2.785 5.243 1.00 0.00 ATOM 1445 O GLU A 185 80.144 -7.299 7.905 1.00 0.00 ATOM 1446 C GLU A 185 78.916 -7.285 7.979 1.00 0.00 ATOM 1447 N PHE A 186 78.148 -8.196 7.389 1.00 0.00 ATOM 1448 CA PHE A 186 78.729 -9.297 6.632 1.00 0.00 ATOM 1449 CB PHE A 186 78.179 -10.637 7.127 1.00 0.00 ATOM 1450 CG PHE A 186 78.705 -11.824 6.372 1.00 0.00 ATOM 1451 CD1 PHE A 186 79.982 -12.302 6.610 1.00 0.00 ATOM 1452 CD2 PHE A 186 77.924 -12.463 5.425 1.00 0.00 ATOM 1453 CE1 PHE A 186 80.466 -13.396 5.916 1.00 0.00 ATOM 1454 CE2 PHE A 186 78.408 -13.556 4.732 1.00 0.00 ATOM 1455 CZ PHE A 186 79.672 -14.022 4.973 1.00 0.00 ATOM 1456 O PHE A 186 77.318 -9.065 4.703 1.00 0.00 ATOM 1457 C PHE A 186 78.454 -9.250 5.134 1.00 0.00 ATOM 1458 N VAL A 187 79.506 -9.433 4.346 1.00 0.00 ATOM 1459 CA VAL A 187 79.398 -9.426 2.893 1.00 0.00 ATOM 1460 CB VAL A 187 80.675 -8.872 2.235 1.00 0.00 ATOM 1461 CG1 VAL A 187 80.920 -7.437 2.673 1.00 0.00 ATOM 1462 CG2 VAL A 187 81.883 -9.709 2.627 1.00 0.00 ATOM 1463 O VAL A 187 79.477 -11.831 3.062 1.00 0.00 ATOM 1464 C VAL A 187 79.175 -10.853 2.373 1.00 0.00 ATOM 1465 N LYS A 188 78.685 -10.911 1.066 1.00 0.00 ATOM 1466 CA LYS A 188 78.476 -12.193 0.391 1.00 0.00 ATOM 1467 CB LYS A 188 79.815 -12.891 0.142 1.00 0.00 ATOM 1468 CG LYS A 188 80.776 -12.098 -0.729 1.00 0.00 ATOM 1469 CD LYS A 188 82.055 -12.877 -0.990 1.00 0.00 ATOM 1470 CE LYS A 188 83.045 -12.059 -1.804 1.00 0.00 ATOM 1471 NZ LYS A 188 84.312 -12.801 -2.047 1.00 0.00 ATOM 1472 O LYS A 188 77.936 -14.424 1.025 1.00 0.00 ATOM 1473 C LYS A 188 77.630 -13.233 1.100 1.00 0.00 ATOM 1474 N ARG A 189 76.587 -12.828 1.797 1.00 0.00 ATOM 1475 CA ARG A 189 75.712 -13.748 2.495 1.00 0.00 ATOM 1476 CB ARG A 189 74.475 -13.032 3.113 1.00 0.00 ATOM 1477 CG ARG A 189 74.101 -13.933 4.276 1.00 0.00 ATOM 1478 CD ARG A 189 72.866 -13.669 5.121 1.00 0.00 ATOM 1479 NE ARG A 189 71.618 -14.231 4.603 1.00 0.00 ATOM 1480 CZ ARG A 189 71.257 -15.503 4.728 1.00 0.00 ATOM 1481 NH1 ARG A 189 72.034 -16.375 5.334 1.00 0.00 ATOM 1482 NH2 ARG A 189 70.083 -15.891 4.236 1.00 0.00 ATOM 1483 O ARG A 189 75.233 -16.018 1.856 1.00 0.00 ATOM 1484 C ARG A 189 75.199 -14.830 1.535 1.00 0.00 ATOM 1485 N ILE A 190 74.775 -14.456 0.325 1.00 0.00 ATOM 1486 CA ILE A 190 74.231 -15.401 -0.655 1.00 0.00 ATOM 1487 CB ILE A 190 73.568 -14.569 -1.807 1.00 0.00 ATOM 1488 CG1 ILE A 190 72.339 -13.805 -1.274 1.00 0.00 ATOM 1489 CG2 ILE A 190 73.166 -15.527 -2.953 1.00 0.00 ATOM 1490 CD1 ILE A 190 71.890 -12.618 -2.150 1.00 0.00 ATOM 1491 O ILE A 190 75.133 -17.554 -1.155 1.00 0.00 ATOM 1492 C ILE A 190 75.321 -16.345 -1.158 1.00 0.00 ATOM 1493 N ILE A 191 76.384 -15.775 -1.553 1.00 0.00 ATOM 1494 CA ILE A 191 77.510 -16.604 -1.963 1.00 0.00 ATOM 1495 CB ILE A 191 78.673 -15.729 -2.528 1.00 0.00 ATOM 1496 CG1 ILE A 191 78.222 -15.013 -3.801 1.00 0.00 ATOM 1497 CG2 ILE A 191 79.891 -16.599 -2.813 1.00 0.00 ATOM 1498 CD1 ILE A 191 79.160 -13.891 -4.235 1.00 0.00 ATOM 1499 O ILE A 191 78.204 -18.646 -0.888 1.00 0.00 ATOM 1500 C ILE A 191 77.974 -17.432 -0.785 1.00 0.00 ATOM 1501 N HIS A 192 78.104 -16.845 0.378 1.00 0.00 ATOM 1502 CA HIS A 192 78.527 -17.567 1.562 1.00 0.00 ATOM 1503 CB HIS A 192 79.487 -16.538 2.334 1.00 0.00 ATOM 1504 CG HIS A 192 80.300 -17.197 3.414 1.00 0.00 ATOM 1505 CD2 HIS A 192 80.269 -17.085 4.768 1.00 0.00 ATOM 1506 ND1 HIS A 192 81.299 -18.100 3.128 1.00 0.00 ATOM 1507 CE1 HIS A 192 81.848 -18.526 4.254 1.00 0.00 ATOM 1508 NE2 HIS A 192 81.251 -17.921 5.266 1.00 0.00 ATOM 1509 O HIS A 192 77.642 -19.292 2.960 1.00 0.00 ATOM 1510 C HIS A 192 77.416 -18.465 2.079 1.00 0.00 ATOM 1511 N ASP A 193 76.124 -18.208 1.532 1.00 0.00 ATOM 1512 CA ASP A 193 75.056 -18.994 2.148 1.00 0.00 ATOM 1513 CB ASP A 193 73.793 -18.961 1.379 1.00 0.00 ATOM 1514 CG ASP A 193 72.630 -19.506 2.187 1.00 0.00 ATOM 1515 OD1 ASP A 193 72.536 -19.177 3.388 1.00 0.00 ATOM 1516 OD2 ASP A 193 71.802 -20.253 1.625 1.00 0.00 ATOM 1517 O ASP A 193 74.934 -21.244 2.938 1.00 0.00 ATOM 1518 C ASP A 193 75.362 -20.486 2.046 1.00 0.00 ATOM 1519 N SER A 194 76.176 -20.895 1.064 1.00 0.00 ATOM 1520 CA SER A 194 76.578 -22.315 1.013 1.00 0.00 ATOM 1521 CB SER A 194 77.253 -22.660 -0.305 1.00 0.00 ATOM 1522 OG SER A 194 78.622 -22.257 -0.281 1.00 0.00 ATOM 1523 O SER A 194 77.357 -23.856 2.725 1.00 0.00 ATOM 1524 C SER A 194 77.420 -22.704 2.237 1.00 0.00 ATOM 1525 N LEU A 195 78.216 -21.742 2.724 1.00 0.00 ATOM 1526 CA LEU A 195 79.027 -21.976 3.917 1.00 0.00 ATOM 1527 CB LEU A 195 80.188 -20.970 3.996 1.00 0.00 ATOM 1528 CG LEU A 195 81.321 -21.192 2.980 1.00 0.00 ATOM 1529 CD1 LEU A 195 82.104 -19.909 2.932 1.00 0.00 ATOM 1530 CD2 LEU A 195 82.220 -22.397 3.347 1.00 0.00 ATOM 1531 O LEU A 195 77.267 -21.067 5.277 1.00 0.00 ATOM 1532 C LEU A 195 78.197 -21.873 5.186 1.00 0.00 ATOM 1533 N GLN A 196 76.827 -20.499 6.702 1.00 0.00 ATOM 1534 CA GLN A 196 76.768 -20.806 8.122 1.00 0.00 ATOM 1535 CB GLN A 196 77.976 -21.612 8.564 1.00 0.00 ATOM 1536 CG GLN A 196 78.112 -22.965 7.884 1.00 0.00 ATOM 1537 CD GLN A 196 76.856 -23.799 7.995 1.00 0.00 ATOM 1538 OE1 GLN A 196 76.073 -23.897 7.047 1.00 0.00 ATOM 1539 NE2 GLN A 196 76.647 -24.396 9.160 1.00 0.00 ATOM 1540 O GLN A 196 75.870 -19.544 9.954 1.00 0.00 ATOM 1541 C GLN A 196 76.672 -19.572 9.016 1.00 0.00 ATOM 1542 N LEU A 197 77.463 -18.546 8.719 1.00 0.00 ATOM 1543 CA LEU A 197 77.439 -17.319 9.512 1.00 0.00 ATOM 1544 CB LEU A 197 78.473 -16.313 9.105 1.00 0.00 ATOM 1545 CG LEU A 197 78.573 -15.052 9.974 1.00 0.00 ATOM 1546 CD1 LEU A 197 78.993 -15.376 11.397 1.00 0.00 ATOM 1547 CD2 LEU A 197 79.551 -14.082 9.314 1.00 0.00 ATOM 1548 O LEU A 197 75.506 -16.232 10.472 1.00 0.00 ATOM 1549 C LEU A 197 76.069 -16.627 9.451 1.00 0.00 ATOM 1550 N GLY A 198 75.525 -16.501 8.245 1.00 0.00 ATOM 1551 CA GLY A 198 74.220 -15.896 8.064 1.00 0.00 ATOM 1552 O GLY A 198 72.258 -16.078 9.427 1.00 0.00 ATOM 1553 C GLY A 198 73.115 -16.674 8.774 1.00 0.00 ATOM 1554 N LYS A 199 73.151 -18.001 8.674 1.00 0.00 ATOM 1555 CA LYS A 199 72.150 -18.833 9.332 1.00 0.00 ATOM 1556 CB LYS A 199 72.353 -20.305 8.967 1.00 0.00 ATOM 1557 CG LYS A 199 72.007 -20.641 7.525 1.00 0.00 ATOM 1558 CD LYS A 199 72.230 -22.116 7.233 1.00 0.00 ATOM 1559 CE LYS A 199 71.907 -22.447 5.786 1.00 0.00 ATOM 1560 NZ LYS A 199 72.154 -23.883 5.476 1.00 0.00 ATOM 1561 O LYS A 199 71.257 -18.562 11.550 1.00 0.00 ATOM 1562 C LYS A 199 72.263 -18.684 10.843 1.00 0.00 ATOM 1563 N ARG A 200 73.498 -18.687 11.335 1.00 0.00 ATOM 1564 CA ARG A 200 73.741 -18.568 12.763 1.00 0.00 ATOM 1565 CB ARG A 200 75.237 -18.677 13.064 1.00 0.00 ATOM 1566 CG ARG A 200 75.812 -20.070 12.864 1.00 0.00 ATOM 1567 CD ARG A 200 77.307 -20.094 13.134 1.00 0.00 ATOM 1568 NE ARG A 200 77.884 -21.415 12.898 1.00 0.00 ATOM 1569 CZ ARG A 200 79.178 -21.695 13.006 1.00 0.00 ATOM 1570 NH1 ARG A 200 79.612 -22.926 12.774 1.00 0.00 ATOM 1571 NH2 ARG A 200 80.036 -20.743 13.348 1.00 0.00 ATOM 1572 O ARG A 200 72.508 -17.258 14.336 1.00 0.00 ATOM 1573 C ARG A 200 73.270 -17.244 13.376 1.00 0.00 ATOM 1574 N LEU A 201 73.715 -16.107 12.842 1.00 0.00 ATOM 1575 CA LEU A 201 73.311 -14.819 13.423 1.00 0.00 ATOM 1576 CB LEU A 201 74.046 -13.666 12.737 1.00 0.00 ATOM 1577 CG LEU A 201 75.550 -13.568 12.999 1.00 0.00 ATOM 1578 CD1 LEU A 201 76.180 -12.499 12.122 1.00 0.00 ATOM 1579 CD2 LEU A 201 75.819 -13.212 14.453 1.00 0.00 ATOM 1580 O LEU A 201 71.211 -14.042 14.276 1.00 0.00 ATOM 1581 C LEU A 201 71.819 -14.533 13.327 1.00 0.00 ATOM 1582 N ARG A 202 71.212 -14.861 12.188 1.00 0.00 ATOM 1583 CA ARG A 202 69.792 -14.618 11.996 1.00 0.00 ATOM 1584 CB ARG A 202 69.501 -14.541 10.470 1.00 0.00 ATOM 1585 CG ARG A 202 68.219 -14.015 10.081 1.00 0.00 ATOM 1586 CD ARG A 202 68.212 -13.956 8.553 1.00 0.00 ATOM 1587 NE ARG A 202 67.046 -13.421 7.888 1.00 0.00 ATOM 1588 CZ ARG A 202 65.971 -14.125 7.555 1.00 0.00 ATOM 1589 NH1 ARG A 202 65.832 -15.380 7.959 1.00 0.00 ATOM 1590 NH2 ARG A 202 65.012 -13.550 6.852 1.00 0.00 ATOM 1591 O ARG A 202 67.820 -15.135 13.237 1.00 0.00 ATOM 1592 C ARG A 202 68.941 -15.498 12.893 1.00 0.00 ATOM 1593 N TRP A 203 69.474 -16.651 13.275 1.00 0.00 ATOM 1594 CA TRP A 203 68.728 -17.553 14.133 1.00 0.00 ATOM 1595 CB TRP A 203 69.043 -19.009 13.783 1.00 0.00 ATOM 1596 CG TRP A 203 68.570 -19.413 12.420 1.00 0.00 ATOM 1597 CD1 TRP A 203 67.795 -18.679 11.570 1.00 0.00 ATOM 1598 CD2 TRP A 203 68.844 -20.650 11.749 1.00 0.00 ATOM 1599 CE2 TRP A 203 68.200 -20.596 10.497 1.00 0.00 ATOM 1600 CE3 TRP A 203 69.569 -21.798 12.085 1.00 0.00 ATOM 1601 NE1 TRP A 203 67.566 -19.381 10.411 1.00 0.00 ATOM 1602 CZ2 TRP A 203 68.261 -21.643 9.580 1.00 0.00 ATOM 1603 CZ3 TRP A 203 69.625 -22.835 11.173 1.00 0.00 ATOM 1604 CH2 TRP A 203 68.977 -22.753 9.936 1.00 0.00 ATOM 1605 O TRP A 203 68.283 -17.919 16.449 1.00 0.00 ATOM 1606 C TRP A 203 69.017 -17.401 15.617 1.00 0.00 ATOM 1607 N TYR A 204 70.134 -16.601 15.931 1.00 0.00 ATOM 1608 CA TYR A 204 70.558 -16.344 17.302 1.00 0.00 ATOM 1609 CB TYR A 204 72.081 -16.145 17.338 1.00 0.00 ATOM 1610 CG TYR A 204 72.827 -17.483 17.448 1.00 0.00 ATOM 1611 CD1 TYR A 204 74.174 -17.524 17.779 1.00 0.00 ATOM 1612 CD2 TYR A 204 72.153 -18.700 17.309 1.00 0.00 ATOM 1613 CE1 TYR A 204 74.854 -18.746 17.921 1.00 0.00 ATOM 1614 CE2 TYR A 204 72.822 -19.931 17.453 1.00 0.00 ATOM 1615 CZ TYR A 204 74.165 -19.947 17.765 1.00 0.00 ATOM 1616 OH TYR A 204 74.820 -21.165 17.923 1.00 0.00 ATOM 1617 O TYR A 204 69.595 -14.150 17.288 1.00 0.00 ATOM 1618 C TYR A 204 69.812 -15.178 17.930 1.00 0.00 ATOM 1619 N SER A 205 69.413 -15.337 19.188 1.00 0.00 ATOM 1620 CA SER A 205 68.707 -14.271 19.887 1.00 0.00 ATOM 1621 CB SER A 205 68.213 -14.760 21.251 1.00 0.00 ATOM 1622 OG SER A 205 67.299 -15.833 21.108 1.00 0.00 ATOM 1623 O SER A 205 69.454 -11.987 19.961 1.00 0.00 ATOM 1624 C SER A 205 69.772 -13.177 19.994 1.00 0.00 ATOM 1625 N CYS A 206 71.116 -13.636 20.080 1.00 0.00 ATOM 1626 CA CYS A 206 72.219 -12.685 20.187 1.00 0.00 ATOM 1627 CB CYS A 206 73.614 -13.296 20.334 1.00 0.00 ATOM 1628 SG CYS A 206 73.838 -14.292 21.826 1.00 0.00 ATOM 1629 O CYS A 206 73.118 -10.667 19.254 1.00 0.00 ATOM 1630 C CYS A 206 72.398 -11.646 19.077 1.00 0.00 ATOM 1631 N MET A 207 71.742 -11.857 17.941 1.00 0.00 ATOM 1632 CA MET A 207 71.866 -10.942 16.811 1.00 0.00 ATOM 1633 CB MET A 207 72.669 -11.601 15.699 1.00 0.00 ATOM 1634 CG MET A 207 74.063 -11.985 16.148 1.00 0.00 ATOM 1635 SD MET A 207 75.025 -10.608 16.792 1.00 0.00 ATOM 1636 CE MET A 207 75.348 -9.713 15.258 1.00 0.00 ATOM 1637 O MET A 207 69.516 -11.273 16.368 1.00 0.00 ATOM 1638 C MET A 207 70.492 -10.516 16.297 1.00 0.00 ATOM 1639 N LEU A 208 70.276 -9.117 16.212 1.00 0.00 ATOM 1640 CA LEU A 208 69.140 -8.487 15.540 1.00 0.00 ATOM 1641 CB LEU A 208 68.776 -7.167 16.223 1.00 0.00 ATOM 1642 CG LEU A 208 67.593 -6.400 15.628 1.00 0.00 ATOM 1643 CD1 LEU A 208 66.313 -7.217 15.735 1.00 0.00 ATOM 1644 CD2 LEU A 208 67.380 -5.086 16.363 1.00 0.00 ATOM 1645 O LEU A 208 70.655 -7.619 13.898 1.00 0.00 ATOM 1646 C LEU A 208 69.668 -8.317 14.122 1.00 0.00 ATOM 1647 N GLY A 209 69.053 -8.980 13.159 1.00 0.00 ATOM 1648 CA GLY A 209 69.483 -8.910 11.774 1.00 0.00 ATOM 1649 O GLY A 209 67.361 -8.295 10.853 1.00 0.00 ATOM 1650 C GLY A 209 68.587 -8.205 10.781 1.00 0.00 ATOM 1651 N LYS A 210 69.190 -7.438 9.888 1.00 0.00 ATOM 1652 CA LYS A 210 68.446 -6.723 8.863 1.00 0.00 ATOM 1653 CB LYS A 210 68.463 -5.226 9.184 1.00 0.00 ATOM 1654 CG LYS A 210 67.679 -4.849 10.429 1.00 0.00 ATOM 1655 CD LYS A 210 67.661 -3.344 10.637 1.00 0.00 ATOM 1656 CE LYS A 210 66.874 -2.966 11.882 1.00 0.00 ATOM 1657 NZ LYS A 210 66.874 -1.495 12.113 1.00 0.00 ATOM 1658 O LYS A 210 70.416 -7.001 7.553 1.00 0.00 ATOM 1659 C LYS A 210 69.189 -7.022 7.573 1.00 0.00 ATOM 1660 N ALA A 211 68.451 -7.305 6.505 1.00 0.00 ATOM 1661 CA ALA A 211 69.066 -7.616 5.222 1.00 0.00 ATOM 1662 CB ALA A 211 68.433 -8.860 4.618 1.00 0.00 ATOM 1663 O ALA A 211 67.805 -5.943 4.047 1.00 0.00 ATOM 1664 C ALA A 211 68.899 -6.478 4.221 1.00 0.00 ATOM 1665 N CYS A 212 69.993 -6.103 3.569 1.00 0.00 ATOM 1666 CA CYS A 212 69.961 -5.049 2.564 1.00 0.00 ATOM 1667 CB CYS A 212 71.019 -3.986 2.868 1.00 0.00 ATOM 1668 SG CYS A 212 71.018 -2.584 1.727 1.00 0.00 ATOM 1669 O CYS A 212 71.361 -6.134 0.941 1.00 0.00 ATOM 1670 C CYS A 212 70.244 -5.686 1.209 1.00 0.00 ATOM 1671 N SER A 213 69.217 -5.762 0.374 1.00 0.00 ATOM 1672 CA SER A 213 69.362 -6.365 -0.938 1.00 0.00 ATOM 1673 CB SER A 213 67.990 -6.698 -1.530 1.00 0.00 ATOM 1674 OG SER A 213 68.112 -7.187 -2.854 1.00 0.00 ATOM 1675 O SER A 213 69.543 -4.321 -2.180 1.00 0.00 ATOM 1676 C SER A 213 70.078 -5.389 -1.879 1.00 0.00 ATOM 1677 N LEU A 214 71.441 -5.688 -2.628 1.00 0.00 ATOM 1678 CA LEU A 214 72.288 -4.868 -3.526 1.00 0.00 ATOM 1679 CB LEU A 214 73.523 -4.278 -2.842 1.00 0.00 ATOM 1680 CG LEU A 214 73.261 -3.260 -1.730 1.00 0.00 ATOM 1681 CD1 LEU A 214 74.560 -2.869 -1.042 1.00 0.00 ATOM 1682 CD2 LEU A 214 72.625 -1.999 -2.296 1.00 0.00 ATOM 1683 O LEU A 214 72.037 -6.651 -5.118 1.00 0.00 ATOM 1684 C LEU A 214 72.747 -5.735 -4.700 1.00 0.00 ATOM 1685 N ALA A 215 73.932 -5.445 -5.229 1.00 0.00 ATOM 1686 CA ALA A 215 74.470 -6.190 -6.361 1.00 0.00 ATOM 1687 CB ALA A 215 74.333 -5.383 -7.643 1.00 0.00 ATOM 1688 O ALA A 215 76.727 -5.738 -5.685 1.00 0.00 ATOM 1689 C ALA A 215 75.947 -6.529 -6.218 1.00 0.00 ATOM 1690 N PRO A 216 76.323 -7.711 -6.704 1.00 0.00 ATOM 1691 CA PRO A 216 77.713 -8.144 -6.651 1.00 0.00 ATOM 1692 CB PRO A 216 77.710 -9.489 -7.378 1.00 0.00 ATOM 1693 CG PRO A 216 76.310 -9.986 -7.242 1.00 0.00 ATOM 1694 CD PRO A 216 75.426 -8.774 -7.340 1.00 0.00 ATOM 1695 O PRO A 216 78.144 -6.481 -8.340 1.00 0.00 ATOM 1696 C PRO A 216 78.547 -7.082 -7.336 1.00 0.00 ATOM 1697 N LEU A 217 79.745 -6.836 -6.802 1.00 0.00 ATOM 1698 CA LEU A 217 80.619 -5.783 -7.366 1.00 0.00 ATOM 1699 CB LEU A 217 81.562 -5.107 -6.767 1.00 0.00 ATOM 1700 CG LEU A 217 80.928 -3.768 -6.389 1.00 0.00 ATOM 1701 CD1 LEU A 217 81.779 -3.090 -5.297 1.00 0.00 ATOM 1702 CD2 LEU A 217 80.787 -2.855 -7.614 1.00 0.00 ATOM 1703 O LEU A 217 81.286 -7.100 -9.274 1.00 0.00 ATOM 1704 C LEU A 217 80.905 -6.000 -8.847 1.00 0.00 ATOM 1705 N LYS A 218 80.182 -5.071 -9.655 1.00 0.00 ATOM 1706 CA LYS A 218 80.422 -5.040 -11.091 1.00 0.00 ATOM 1707 CB LYS A 218 81.890 -5.349 -11.397 1.00 0.00 ATOM 1708 CG LYS A 218 82.872 -4.371 -10.775 1.00 0.00 ATOM 1709 CD LYS A 218 82.743 -2.990 -11.394 1.00 0.00 ATOM 1710 CE LYS A 218 83.818 -2.049 -10.873 1.00 0.00 ATOM 1711 NZ LYS A 218 83.605 -1.704 -9.440 1.00 0.00 ATOM 1712 O LYS A 218 80.226 -6.819 -12.722 1.00 0.00 ATOM 1713 C LYS A 218 79.678 -6.151 -11.828 1.00 0.00 ATOM 1714 N GLU A 219 78.325 -6.286 -11.473 1.00 0.00 ATOM 1715 CA GLU A 219 77.480 -7.274 -12.117 1.00 0.00 ATOM 1716 CB GLU A 219 77.839 -8.710 -11.731 1.00 0.00 ATOM 1717 CG GLU A 219 77.013 -9.769 -12.442 1.00 0.00 ATOM 1718 CD GLU A 219 77.238 -9.774 -13.941 1.00 0.00 ATOM 1719 OE1 GLU A 219 76.821 -8.803 -14.609 1.00 0.00 ATOM 1720 OE2 GLU A 219 77.833 -10.747 -14.450 1.00 0.00 ATOM 1721 O GLU A 219 75.633 -6.412 -10.823 1.00 0.00 ATOM 1722 C GLU A 219 75.992 -7.094 -11.782 1.00 0.00 ATOM 1723 N GLU A 220 75.139 -7.717 -12.591 1.00 0.00 ATOM 1724 CA GLU A 220 73.686 -7.649 -12.433 1.00 0.00 ATOM 1725 CB GLU A 220 72.992 -7.817 -13.786 1.00 0.00 ATOM 1726 CG GLU A 220 73.238 -6.674 -14.756 1.00 0.00 ATOM 1727 CD GLU A 220 72.576 -6.897 -16.101 1.00 0.00 ATOM 1728 OE1 GLU A 220 71.943 -7.958 -16.283 1.00 0.00 ATOM 1729 OE2 GLU A 220 72.688 -6.010 -16.974 1.00 0.00 ATOM 1730 O GLU A 220 71.940 -8.829 -11.251 1.00 0.00 ATOM 1731 C GLU A 220 73.141 -8.742 -11.502 1.00 0.00 ATOM 1732 N LEU A 221 74.037 -9.543 -10.946 1.00 0.00 ATOM 1733 CA LEU A 221 73.636 -10.605 -10.037 1.00 0.00 ATOM 1734 CB LEU A 221 74.790 -11.584 -9.814 1.00 0.00 ATOM 1735 CG LEU A 221 75.244 -12.386 -11.034 1.00 0.00 ATOM 1736 CD1 LEU A 221 76.466 -13.229 -10.699 1.00 0.00 ATOM 1737 CD2 LEU A 221 74.138 -13.319 -11.506 1.00 0.00 ATOM 1738 O LEU A 221 73.582 -8.801 -8.426 1.00 0.00 ATOM 1739 C LEU A 221 73.131 -9.896 -8.762 1.00 0.00 ATOM 1740 N ARG A 222 72.143 -10.687 -8.071 1.00 0.00 ATOM 1741 CA ARG A 222 71.615 -10.165 -6.814 1.00 0.00 ATOM 1742 CB ARG A 222 70.321 -10.826 -6.476 1.00 0.00 ATOM 1743 CG ARG A 222 69.204 -9.999 -7.095 1.00 0.00 ATOM 1744 CD ARG A 222 67.816 -10.426 -6.644 1.00 0.00 ATOM 1745 NE ARG A 222 67.568 -11.730 -7.201 1.00 0.00 ATOM 1746 CZ ARG A 222 67.204 -11.919 -8.457 1.00 0.00 ATOM 1747 NH1 ARG A 222 67.025 -10.866 -9.252 1.00 0.00 ATOM 1748 NH2 ARG A 222 67.041 -13.161 -8.916 1.00 0.00 ATOM 1749 O ARG A 222 72.417 -11.923 -5.396 1.00 0.00 ATOM 1750 C ARG A 222 72.350 -10.708 -5.596 1.00 0.00 ATOM 1751 N ILE A 223 72.871 -9.832 -4.760 1.00 0.00 ATOM 1752 CA ILE A 223 73.619 -10.245 -3.581 1.00 0.00 ATOM 1753 CB ILE A 223 75.110 -9.956 -3.618 1.00 0.00 ATOM 1754 CG1 ILE A 223 75.453 -8.522 -4.008 1.00 0.00 ATOM 1755 CG2 ILE A 223 75.777 -10.948 -4.537 1.00 0.00 ATOM 1756 CD1 ILE A 223 76.942 -8.251 -4.127 1.00 0.00 ATOM 1757 O ILE A 223 72.255 -8.492 -2.686 1.00 0.00 ATOM 1758 C ILE A 223 73.141 -9.319 -2.468 1.00 0.00 ATOM 1759 N GLN A 224 73.690 -9.461 -1.270 1.00 0.00 ATOM 1760 CA GLN A 224 73.249 -8.589 -0.203 1.00 0.00 ATOM 1761 CB GLN A 224 71.884 -9.035 0.324 1.00 0.00 ATOM 1762 CG GLN A 224 71.878 -10.426 0.936 1.00 0.00 ATOM 1763 CD GLN A 224 70.510 -10.834 1.444 1.00 0.00 ATOM 1764 OE1 GLN A 224 70.062 -10.369 2.492 1.00 0.00 ATOM 1765 NE2 GLN A 224 69.840 -11.707 0.700 1.00 0.00 ATOM 1766 O GLN A 224 75.083 -9.379 1.122 1.00 0.00 ATOM 1767 C GLN A 224 74.176 -8.553 0.987 1.00 0.00 ATOM 1768 N GLY A 225 73.941 -7.569 1.845 1.00 0.00 ATOM 1769 CA GLY A 225 74.710 -7.388 3.061 1.00 0.00 ATOM 1770 O GLY A 225 72.580 -7.345 4.167 1.00 0.00 ATOM 1771 C GLY A 225 73.762 -7.685 4.219 1.00 0.00 ATOM 1772 N VAL A 226 74.271 -8.328 5.261 1.00 0.00 ATOM 1773 CA VAL A 226 73.445 -8.616 6.418 1.00 0.00 ATOM 1774 CB VAL A 226 73.273 -10.143 6.621 1.00 0.00 ATOM 1775 CG1 VAL A 226 72.375 -10.422 7.790 1.00 0.00 ATOM 1776 CG2 VAL A 226 72.795 -10.877 5.362 1.00 0.00 ATOM 1777 O VAL A 226 75.045 -8.158 8.087 1.00 0.00 ATOM 1778 C VAL A 226 73.946 -7.886 7.657 1.00 0.00 ATOM 1779 N PRO A 227 73.159 -6.964 8.183 1.00 0.00 ATOM 1780 CA PRO A 227 73.549 -6.285 9.422 1.00 0.00 ATOM 1781 CB PRO A 227 73.028 -4.851 9.182 1.00 0.00 ATOM 1782 CG PRO A 227 71.780 -5.076 8.463 1.00 0.00 ATOM 1783 CD PRO A 227 72.102 -6.204 7.492 1.00 0.00 ATOM 1784 O PRO A 227 71.835 -7.315 10.739 1.00 0.00 ATOM 1785 C PRO A 227 73.037 -7.054 10.626 1.00 0.00 ATOM 1786 N LYS A 228 73.949 -7.438 11.510 1.00 0.00 ATOM 1787 CA LYS A 228 73.591 -8.185 12.702 1.00 0.00 ATOM 1788 CB LYS A 228 74.192 -9.591 12.658 1.00 0.00 ATOM 1789 CG LYS A 228 73.758 -10.413 11.454 1.00 0.00 ATOM 1790 CD LYS A 228 72.286 -10.782 11.540 1.00 0.00 ATOM 1791 CE LYS A 228 71.836 -11.551 10.309 1.00 0.00 ATOM 1792 NZ LYS A 228 70.401 -11.940 10.389 1.00 0.00 ATOM 1793 O LYS A 228 75.348 -7.296 14.060 1.00 0.00 ATOM 1794 C LYS A 228 74.134 -7.421 13.890 1.00 0.00 ATOM 1795 N VAL A 229 73.224 -6.900 14.703 1.00 0.00 ATOM 1796 CA VAL A 229 73.602 -6.133 15.873 1.00 0.00 ATOM 1797 CB VAL A 229 72.631 -4.993 16.144 1.00 0.00 ATOM 1798 CG1 VAL A 229 71.231 -5.502 16.481 1.00 0.00 ATOM 1799 CG2 VAL A 229 73.158 -4.073 17.226 1.00 0.00 ATOM 1800 O VAL A 229 72.771 -7.973 17.186 1.00 0.00 ATOM 1801 C VAL A 229 73.667 -7.145 17.030 1.00 0.00 ATOM 1802 N THR A 230 74.755 -7.093 17.773 1.00 0.00 ATOM 1803 CA THR A 230 74.971 -7.962 18.970 1.00 0.00 ATOM 1804 CB THR A 230 76.449 -8.024 19.398 1.00 0.00 ATOM 1805 CG2 THR A 230 76.611 -8.905 20.627 1.00 0.00 ATOM 1806 OG1 THR A 230 77.238 -8.565 18.331 1.00 0.00 ATOM 1807 O THR A 230 74.228 -6.185 20.416 1.00 0.00 ATOM 1808 C THR A 230 74.158 -7.379 20.123 1.00 0.00 ATOM 1809 N TYR A 231 73.382 -8.237 20.772 1.00 0.00 ATOM 1810 CA TYR A 231 72.532 -7.830 21.885 1.00 0.00 ATOM 1811 CB TYR A 231 71.083 -8.255 21.637 1.00 0.00 ATOM 1812 CG TYR A 231 70.145 -7.927 22.777 1.00 0.00 ATOM 1813 CD1 TYR A 231 69.688 -6.631 22.972 1.00 0.00 ATOM 1814 CD2 TYR A 231 69.720 -8.917 23.655 1.00 0.00 ATOM 1815 CE1 TYR A 231 68.832 -6.323 24.012 1.00 0.00 ATOM 1816 CE2 TYR A 231 68.864 -8.628 24.700 1.00 0.00 ATOM 1817 CZ TYR A 231 68.420 -7.318 24.873 1.00 0.00 ATOM 1818 OH TYR A 231 67.567 -7.014 25.908 1.00 0.00 ATOM 1819 O TYR A 231 73.252 -9.698 23.189 1.00 0.00 ATOM 1820 C TYR A 231 73.037 -8.486 23.144 1.00 0.00 ATOM 1821 N THR A 232 73.198 -7.683 24.188 1.00 0.00 ATOM 1822 CA THR A 232 73.760 -8.168 25.429 1.00 0.00 ATOM 1823 CB THR A 232 75.298 -8.224 25.369 1.00 0.00 ATOM 1824 CG2 THR A 232 75.882 -6.820 25.373 1.00 0.00 ATOM 1825 OG1 THR A 232 75.798 -8.937 26.507 1.00 0.00 ATOM 1826 O THR A 232 72.643 -6.223 26.265 1.00 0.00 ATOM 1827 C THR A 232 73.327 -7.205 26.535 1.00 0.00 ATOM 1828 N GLU A 233 73.715 -7.510 27.766 1.00 0.00 ATOM 1829 CA GLU A 233 73.424 -6.631 28.898 1.00 0.00 ATOM 1830 CB GLU A 233 72.695 -7.401 30.001 1.00 0.00 ATOM 1831 CG GLU A 233 71.317 -7.901 29.600 1.00 0.00 ATOM 1832 CD GLU A 233 70.604 -8.614 30.732 1.00 0.00 ATOM 1833 OE1 GLU A 233 71.193 -8.727 31.828 1.00 0.00 ATOM 1834 OE2 GLU A 233 69.457 -9.060 30.525 1.00 0.00 ATOM 1835 O GLU A 233 75.580 -6.996 29.853 1.00 0.00 ATOM 1836 C GLU A 233 74.636 -6.228 29.705 1.00 0.00 ATOM 1837 N PHE A 234 74.574 -4.980 30.175 1.00 0.00 ATOM 1838 CA PHE A 234 75.684 -4.429 30.924 1.00 0.00 ATOM 1839 CB PHE A 234 75.440 -2.937 31.163 1.00 0.00 ATOM 1840 CG PHE A 234 76.576 -2.240 31.855 1.00 0.00 ATOM 1841 CD1 PHE A 234 77.733 -1.918 31.165 1.00 0.00 ATOM 1842 CD2 PHE A 234 76.488 -1.906 33.195 1.00 0.00 ATOM 1843 CE1 PHE A 234 78.778 -1.276 31.803 1.00 0.00 ATOM 1844 CE2 PHE A 234 77.535 -1.266 33.832 1.00 0.00 ATOM 1845 CZ PHE A 234 78.675 -0.950 33.143 1.00 0.00 ATOM 1846 O PHE A 234 74.809 -5.402 32.928 1.00 0.00 ATOM 1847 C PHE A 234 75.813 -5.158 32.258 1.00 0.00 ATOM 1848 N CYS A 235 77.043 -5.538 32.636 1.00 0.00 ATOM 1849 CA CYS A 235 77.264 -6.222 33.906 1.00 0.00 ATOM 1850 CB CYS A 235 78.758 -6.464 34.130 1.00 0.00 ATOM 1851 SG CYS A 235 79.525 -7.572 32.925 1.00 0.00 ATOM 1852 O CYS A 235 76.596 -4.171 34.968 1.00 0.00 ATOM 1853 C CYS A 235 76.739 -5.398 35.079 1.00 0.00 ATOM 1854 N GLN A 236 76.419 -6.089 36.177 1.00 0.00 ATOM 1855 CA GLN A 236 75.939 -5.458 37.414 1.00 0.00 ATOM 1856 CB GLN A 236 76.874 -4.322 37.834 1.00 0.00 ATOM 1857 CG GLN A 236 78.256 -4.784 38.270 1.00 0.00 ATOM 1858 CD GLN A 236 79.171 -3.629 38.623 1.00 0.00 ATOM 1859 OE1 GLN A 236 78.784 -2.464 38.522 1.00 0.00 ATOM 1860 NE2 GLN A 236 80.392 -3.948 39.040 1.00 0.00 ATOM 1861 O GLN A 236 73.535 -5.481 37.568 1.00 0.00 ATOM 1862 C GLN A 236 74.540 -4.924 37.193 1.00 0.00 ATOM 1863 N GLY A 237 74.457 -3.733 36.459 1.00 0.00 ATOM 1864 CA GLY A 237 73.110 -3.190 36.278 1.00 0.00 ATOM 1865 O GLY A 237 70.953 -4.090 35.698 1.00 0.00 ATOM 1866 C GLY A 237 72.161 -4.097 35.480 1.00 0.00 ATOM 1867 N ARG A 238 72.730 -4.874 34.560 1.00 0.00 ATOM 1868 CA ARG A 238 71.994 -5.838 33.721 1.00 0.00 ATOM 1869 CB ARG A 238 71.149 -6.770 34.592 1.00 0.00 ATOM 1870 CG ARG A 238 71.946 -7.536 35.637 1.00 0.00 ATOM 1871 CD ARG A 238 71.083 -8.568 36.341 1.00 0.00 ATOM 1872 NE ARG A 238 69.863 -7.981 36.889 1.00 0.00 ATOM 1873 CZ ARG A 238 69.783 -7.400 38.082 1.00 0.00 ATOM 1874 NH1 ARG A 238 68.631 -6.892 38.497 1.00 0.00 ATOM 1875 NH2 ARG A 238 70.857 -7.327 38.856 1.00 0.00 ATOM 1876 O ARG A 238 69.966 -5.714 32.440 1.00 0.00 ATOM 1877 C ARG A 238 71.004 -5.156 32.782 1.00 0.00 ATOM 1878 N THR A 239 71.330 -3.908 32.358 1.00 0.00 ATOM 1879 CA THR A 239 70.476 -3.201 31.418 1.00 0.00 ATOM 1880 CB THR A 239 70.622 -1.673 31.546 1.00 0.00 ATOM 1881 CG2 THR A 239 69.756 -0.967 30.514 1.00 0.00 ATOM 1882 OG1 THR A 239 70.213 -1.260 32.856 1.00 0.00 ATOM 1883 O THR A 239 72.046 -3.965 29.691 1.00 0.00 ATOM 1884 C THR A 239 70.877 -3.626 29.996 1.00 0.00 ATOM 1885 N MET A 240 69.820 -3.715 29.094 1.00 0.00 ATOM 1886 CA MET A 240 70.080 -4.155 27.727 1.00 0.00 ATOM 1887 CB MET A 240 69.012 -5.179 27.340 1.00 0.00 ATOM 1888 CG MET A 240 67.607 -4.605 27.245 1.00 0.00 ATOM 1889 SD MET A 240 66.383 -5.839 26.765 1.00 0.00 ATOM 1890 CE MET A 240 66.259 -6.800 28.271 1.00 0.00 ATOM 1891 O MET A 240 69.605 -1.884 27.087 1.00 0.00 ATOM 1892 C MET A 240 70.007 -2.998 26.735 1.00 0.00 ATOM 1893 N ARG A 241 70.409 -3.272 25.497 1.00 0.00 ATOM 1894 CA ARG A 241 70.419 -2.269 24.435 1.00 0.00 ATOM 1895 CB ARG A 241 71.844 -1.682 24.345 1.00 0.00 ATOM 1896 CG ARG A 241 72.224 -0.932 25.658 1.00 0.00 ATOM 1897 CD ARG A 241 71.359 0.357 25.831 1.00 0.00 ATOM 1898 NE ARG A 241 71.714 1.027 27.081 1.00 0.00 ATOM 1899 CZ ARG A 241 70.964 1.960 27.655 1.00 0.00 ATOM 1900 NH1 ARG A 241 69.808 2.351 27.067 1.00 0.00 ATOM 1901 NH2 ARG A 241 71.310 2.480 28.843 1.00 0.00 ATOM 1902 O ARG A 241 70.138 -4.063 22.876 1.00 0.00 ATOM 1903 C ARG A 241 69.969 -2.870 23.114 1.00 0.00 ATOM 1904 N TRP A 242 69.389 -2.039 22.258 1.00 0.00 ATOM 1905 CA TRP A 242 69.002 -2.492 20.931 1.00 0.00 ATOM 1906 CB TRP A 242 67.676 -1.853 20.513 1.00 0.00 ATOM 1907 CG TRP A 242 66.500 -2.338 21.307 1.00 0.00 ATOM 1908 CD1 TRP A 242 65.971 -1.758 22.423 1.00 0.00 ATOM 1909 CD2 TRP A 242 65.709 -3.502 21.044 1.00 0.00 ATOM 1910 CE2 TRP A 242 64.717 -3.565 22.041 1.00 0.00 ATOM 1911 CE3 TRP A 242 65.740 -4.497 20.062 1.00 0.00 ATOM 1912 NE1 TRP A 242 64.898 -2.489 22.873 1.00 0.00 ATOM 1913 CZ2 TRP A 242 63.766 -4.584 22.086 1.00 0.00 ATOM 1914 CZ3 TRP A 242 64.797 -5.505 20.110 1.00 0.00 ATOM 1915 CH2 TRP A 242 63.822 -5.544 21.113 1.00 0.00 ATOM 1916 O TRP A 242 70.625 -0.901 20.177 1.00 0.00 ATOM 1917 C TRP A 242 70.154 -2.036 20.056 1.00 0.00 ATOM 1918 N ALA A 243 70.642 -2.925 19.204 1.00 0.00 ATOM 1919 CA ALA A 243 71.719 -2.581 18.298 1.00 0.00 ATOM 1920 CB ALA A 243 72.931 -3.463 18.556 1.00 0.00 ATOM 1921 O ALA A 243 70.691 -3.826 16.519 1.00 0.00 ATOM 1922 C ALA A 243 71.199 -2.769 16.875 1.00 0.00 ATOM 1923 N LEU A 244 71.244 -1.701 16.124 1.00 0.00 ATOM 1924 CA LEU A 244 70.843 -1.725 14.719 1.00 0.00 ATOM 1925 CB LEU A 244 70.081 -0.427 14.444 1.00 0.00 ATOM 1926 CG LEU A 244 68.848 -0.167 15.312 1.00 0.00 ATOM 1927 CD1 LEU A 244 68.241 1.191 14.992 1.00 0.00 ATOM 1928 CD2 LEU A 244 67.787 -1.230 15.070 1.00 0.00 ATOM 1929 O LEU A 244 73.055 -1.108 13.997 1.00 0.00 ATOM 1930 C LEU A 244 72.071 -1.822 13.808 1.00 0.00 ATOM 1931 N ALA A 245 72.020 -2.766 12.867 1.00 0.00 ATOM 1932 CA ALA A 245 73.118 -2.955 11.935 1.00 0.00 ATOM 1933 CB ALA A 245 73.693 -4.356 12.069 1.00 0.00 ATOM 1934 O ALA A 245 71.506 -3.150 10.145 1.00 0.00 ATOM 1935 C ALA A 245 72.604 -2.757 10.520 1.00 0.00 ATOM 1936 N TRP A 246 73.444 -2.111 9.740 1.00 0.00 ATOM 1937 CA TRP A 246 73.129 -1.941 8.334 1.00 0.00 ATOM 1938 CB TRP A 246 72.985 -0.821 7.701 1.00 0.00 ATOM 1939 CG TRP A 246 71.503 -0.775 7.612 1.00 0.00 ATOM 1940 CD1 TRP A 246 70.676 0.102 8.205 1.00 0.00 ATOM 1941 CD2 TRP A 246 70.651 -1.635 6.852 1.00 0.00 ATOM 1942 CE2 TRP A 246 69.317 -1.223 7.015 1.00 0.00 ATOM 1943 CE3 TRP A 246 70.900 -2.692 5.995 1.00 0.00 ATOM 1944 NE1 TRP A 246 69.352 -0.157 7.850 1.00 0.00 ATOM 1945 CZ2 TRP A 246 68.257 -1.818 6.375 1.00 0.00 ATOM 1946 CZ3 TRP A 246 69.820 -3.318 5.360 1.00 0.00 ATOM 1947 CH2 TRP A 246 68.544 -2.859 5.541 1.00 0.00 ATOM 1948 O TRP A 246 75.421 -2.221 7.800 1.00 0.00 ATOM 1949 C TRP A 246 74.269 -2.545 7.523 1.00 0.00 ATOM 1950 N SER A 247 73.894 -3.391 6.588 1.00 0.00 ATOM 1951 CA SER A 247 74.842 -3.996 5.670 1.00 0.00 ATOM 1952 CB SER A 247 74.653 -5.513 5.628 1.00 0.00 ATOM 1953 OG SER A 247 75.501 -6.106 4.661 1.00 0.00 ATOM 1954 O SER A 247 73.492 -3.353 3.822 1.00 0.00 ATOM 1955 C SER A 247 74.635 -3.425 4.277 1.00 0.00 ATOM 1956 N PHE A 248 75.733 -3.008 3.682 1.00 0.00 ATOM 1957 CA PHE A 248 75.763 -2.415 2.362 1.00 0.00 ATOM 1958 CB PHE A 248 76.611 -1.142 2.358 1.00 0.00 ATOM 1959 CG PHE A 248 76.053 -0.040 3.214 1.00 0.00 ATOM 1960 CD1 PHE A 248 76.539 0.178 4.491 1.00 0.00 ATOM 1961 CD2 PHE A 248 75.042 0.779 2.740 1.00 0.00 ATOM 1962 CE1 PHE A 248 76.025 1.193 5.277 1.00 0.00 ATOM 1963 CE2 PHE A 248 74.527 1.792 3.527 1.00 0.00 ATOM 1964 CZ PHE A 248 75.016 2.001 4.791 1.00 0.00 ATOM 1965 O PHE A 248 77.475 -3.982 1.734 1.00 0.00 ATOM 1966 C PHE A 248 76.546 -3.261 1.366 1.00 0.00 ATOM 1967 N TYR A 249 76.089 -3.175 0.121 1.00 0.00 ATOM 1968 CA TYR A 249 76.739 -3.918 -0.953 1.00 0.00 ATOM 1969 CB TYR A 249 75.541 -3.613 -2.241 1.00 0.00 ATOM 1970 CG TYR A 249 76.113 -2.542 -3.081 1.00 0.00 ATOM 1971 CD1 TYR A 249 77.009 -2.815 -4.098 1.00 0.00 ATOM 1972 CD2 TYR A 249 75.824 -1.184 -2.911 1.00 0.00 ATOM 1973 CE1 TYR A 249 77.594 -1.816 -4.882 1.00 0.00 ATOM 1974 CE2 TYR A 249 76.379 -0.194 -3.668 1.00 0.00 ATOM 1975 CZ TYR A 249 77.258 -0.507 -4.648 1.00 0.00 ATOM 1976 OH TYR A 249 77.884 0.488 -5.433 1.00 0.00 ATOM 1977 O TYR A 249 78.890 -4.299 -1.919 1.00 0.00 ATOM 1978 C TYR A 249 78.209 -3.594 -1.181 1.00 0.00 ATOM 1979 N ASP A 250 78.707 -2.527 -0.574 1.00 0.00 ATOM 1980 CA ASP A 250 80.065 -2.099 -0.883 1.00 0.00 ATOM 1981 CB ASP A 250 80.070 -1.165 -2.095 1.00 0.00 ATOM 1982 CG ASP A 250 81.469 -0.891 -2.614 1.00 0.00 ATOM 1983 OD1 ASP A 250 82.400 -1.630 -2.229 1.00 0.00 ATOM 1984 OD2 ASP A 250 81.634 0.060 -3.405 1.00 0.00 ATOM 1985 O ASP A 250 79.985 -0.633 1.030 1.00 0.00 ATOM 1986 C ASP A 250 80.661 -1.359 0.304 1.00 0.00 ENDMDL EXPDTA 2h00A MODEL 2 REMARK 44 REMARK 44 model 2 is called 2h00A ATOM 1 N VAL 1 100.112 13.323 -16.532 1.00 0.00 ATOM 2 CA VAL 1 98.954 12.434 -16.147 1.00 0.00 ATOM 3 CB VAL 1 98.455 12.691 -14.653 1.00 0.00 ATOM 4 CG1 VAL 1 97.050 12.197 -14.439 1.00 0.00 ATOM 5 CG2 VAL 1 99.361 12.000 -13.615 1.00 0.00 ATOM 6 O VAL 1 97.370 13.660 -17.491 1.00 0.00 ATOM 7 C VAL 1 97.794 12.566 -17.173 1.00 0.00 ATOM 8 N SER 2 97.272 11.444 -17.662 1.00 0.00 ATOM 9 CA SER 2 96.119 11.439 -18.573 1.00 0.00 ATOM 10 CB SER 2 95.698 9.984 -18.791 1.00 0.00 ATOM 11 OG SER 2 94.421 9.908 -19.367 1.00 0.00 ATOM 12 O SER 2 94.591 12.225 -16.877 1.00 0.00 ATOM 13 C SER 2 94.902 12.248 -18.081 1.00 0.00 ATOM 14 N LEU 3 94.208 12.929 -19.012 1.00 0.00 ATOM 15 CA LEU 3 92.937 13.684 -18.729 1.00 0.00 ATOM 16 CB LEU 3 92.854 14.946 -19.607 1.00 0.00 ATOM 17 CG LEU 3 94.036 15.909 -19.309 1.00 0.00 ATOM 18 CD1 LEU 3 94.205 16.976 -20.384 1.00 0.00 ATOM 19 CD2 LEU 3 93.896 16.545 -17.912 1.00 0.00 ATOM 20 O LEU 3 90.562 13.301 -18.473 1.00 0.00 ATOM 21 C LEU 3 91.660 12.856 -18.851 1.00 0.00 ATOM 22 N ASN 4 91.817 11.630 -19.355 1.00 0.00 ATOM 23 CA ASN 4 90.727 10.708 -19.584 1.00 0.00 ATOM 24 CB ASN 4 91.085 9.786 -20.801 1.00 0.00 ATOM 25 CG ASN 4 90.111 8.670 -21.008 1.00 0.00 ATOM 26 ND2 ASN 4 88.889 8.818 -20.500 1.00 0.00 ATOM 27 OD1 ASN 4 90.447 7.658 -21.658 1.00 0.00 ATOM 28 O ASN 4 91.365 9.085 -17.984 1.00 0.00 ATOM 29 C ASN 4 90.501 9.869 -18.345 1.00 0.00 ATOM 30 N PHE 5 89.326 9.989 -17.730 1.00 0.00 ATOM 31 CA PHE 5 89.062 9.306 -16.441 1.00 0.00 ATOM 32 CB PHE 5 88.059 10.099 -15.577 1.00 0.00 ATOM 33 CG PHE 5 88.734 11.232 -14.869 1.00 0.00 ATOM 34 CD1 PHE 5 89.526 10.974 -13.754 1.00 0.00 ATOM 35 CD2 PHE 5 88.706 12.520 -15.390 1.00 0.00 ATOM 36 CE1 PHE 5 90.256 12.014 -13.130 1.00 0.00 ATOM 37 CE2 PHE 5 89.423 13.567 -14.770 1.00 0.00 ATOM 38 CZ PHE 5 90.186 13.300 -13.636 1.00 0.00 ATOM 39 O PHE 5 88.642 7.197 -15.478 1.00 0.00 ATOM 40 C PHE 5 88.757 7.844 -16.502 1.00 0.00 ATOM 41 N LYS 6 88.648 7.298 -17.719 1.00 0.00 ATOM 42 CA LYS 6 88.770 5.841 -17.915 1.00 0.00 ATOM 43 CB LYS 6 88.241 5.433 -19.320 1.00 0.00 ATOM 44 CG LYS 6 86.787 5.737 -19.511 1.00 0.00 ATOM 45 CD LYS 6 86.207 5.169 -20.817 1.00 0.00 ATOM 46 CE LYS 6 84.707 5.329 -20.750 1.00 0.00 ATOM 47 NZ LYS 6 83.914 4.999 -21.988 1.00 0.00 ATOM 48 O LYS 6 90.329 4.096 -17.519 1.00 0.00 ATOM 49 C LYS 6 90.184 5.284 -17.678 1.00 0.00 ATOM 50 N ASP 7 91.232 6.107 -17.703 1.00 0.00 ATOM 51 CA ASP 7 92.589 5.633 -17.513 1.00 0.00 ATOM 52 CB ASP 7 93.594 6.592 -18.197 1.00 0.00 ATOM 53 CG ASP 7 93.475 6.577 -19.790 1.00 0.00 ATOM 54 OD1 ASP 7 93.199 5.486 -20.368 1.00 0.00 ATOM 55 OD2 ASP 7 93.685 7.627 -20.440 1.00 0.00 ATOM 56 O ASP 7 92.718 6.572 -15.288 1.00 0.00 ATOM 57 C ASP 7 92.872 5.561 -15.962 1.00 0.00 ATOM 58 N PRO 8 93.271 4.387 -15.438 1.00 0.00 ATOM 59 CA PRO 8 93.627 4.234 -14.000 1.00 0.00 ATOM 60 CB PRO 8 94.214 2.850 -13.922 1.00 0.00 ATOM 61 CG PRO 8 93.490 2.092 -15.023 1.00 0.00 ATOM 62 CD PRO 8 93.354 3.104 -16.164 1.00 0.00 ATOM 63 O PRO 8 94.627 5.653 -12.397 1.00 0.00 ATOM 64 C PRO 8 94.670 5.239 -13.545 1.00 0.00 ATOM 65 N GLU 9 95.608 5.630 -14.413 1.00 0.00 ATOM 66 CA GLU 9 96.554 6.675 -14.010 1.00 0.00 ATOM 67 CB GLU 9 97.619 6.936 -15.080 1.00 0.00 ATOM 68 CG GLU 9 98.568 8.061 -14.775 1.00 0.00 ATOM 69 CD GLU 9 99.405 8.421 -16.001 1.00 0.00 ATOM 70 OE1 GLU 9 98.860 8.896 -17.014 1.00 0.00 ATOM 71 OE2 GLU 9 100.615 8.210 -15.944 1.00 0.00 ATOM 72 O GLU 9 96.257 8.633 -12.646 1.00 0.00 ATOM 73 C GLU 9 95.842 7.993 -13.614 1.00 0.00 ATOM 74 N ALA 10 94.773 8.352 -14.328 1.00 0.00 ATOM 75 CA ALA 10 93.964 9.521 -14.007 1.00 0.00 ATOM 76 CB ALA 10 93.084 9.977 -15.155 1.00 0.00 ATOM 77 O ALA 10 93.059 10.233 -11.938 1.00 0.00 ATOM 78 C ALA 10 93.116 9.315 -12.755 1.00 0.00 ATOM 79 N VAL 11 92.416 8.183 -12.633 1.00 0.00 ATOM 80 CA VAL 11 91.661 7.893 -11.389 1.00 0.00 ATOM 81 CB VAL 11 90.896 6.539 -11.451 1.00 0.00 ATOM 82 CG1 VAL 11 89.965 6.331 -10.203 1.00 0.00 ATOM 83 CG2 VAL 11 90.058 6.444 -12.774 1.00 0.00 ATOM 84 O VAL 11 92.223 8.585 -9.122 1.00 0.00 ATOM 85 C VAL 11 92.607 7.987 -10.123 1.00 0.00 ATOM 86 N ARG 12 93.764 7.319 -10.182 1.00 0.00 ATOM 87 CA ARG 12 94.753 7.302 -9.059 1.00 0.00 ATOM 88 CB ARG 12 95.966 6.387 -9.311 1.00 0.00 ATOM 89 CG ARG 12 96.925 6.336 -8.104 1.00 0.00 ATOM 90 CD ARG 12 98.147 5.462 -8.256 1.00 0.00 ATOM 91 NE ARG 12 99.031 5.918 -9.332 1.00 0.00 ATOM 92 CZ ARG 12 100.197 5.357 -9.645 1.00 0.00 ATOM 93 NH1 ARG 12 100.675 4.300 -8.947 1.00 0.00 ATOM 94 NH2 ARG 12 100.884 5.862 -10.685 1.00 0.00 ATOM 95 O ARG 12 95.265 9.042 -7.483 1.00 0.00 ATOM 96 C ARG 12 95.229 8.695 -8.694 1.00 0.00 ATOM 97 N ALA 13 95.508 9.515 -9.721 1.00 0.00 ATOM 98 CA ALA 13 95.967 10.899 -9.508 1.00 0.00 ATOM 99 CB ALA 13 96.424 11.582 -10.849 1.00 0.00 ATOM 100 O ALA 13 95.096 12.451 -7.855 1.00 0.00 ATOM 101 C ALA 13 94.843 11.712 -8.828 1.00 0.00 ATOM 102 N LEU 14 93.604 11.525 -9.295 1.00 0.00 ATOM 103 CA LEU 14 92.469 12.227 -8.704 1.00 0.00 ATOM 104 CB LEU 14 91.199 12.115 -9.536 1.00 0.00 ATOM 105 CG LEU 14 89.940 12.600 -8.814 1.00 0.00 ATOM 106 CD1 LEU 14 89.973 14.112 -8.683 1.00 0.00 ATOM 107 CD2 LEU 14 88.633 12.121 -9.475 1.00 0.00 ATOM 108 O LEU 14 92.073 12.691 -6.401 1.00 0.00 ATOM 109 C LEU 14 92.195 11.820 -7.244 1.00 0.00 ATOM 110 N THR 15 92.114 10.520 -6.978 1.00 0.00 ATOM 111 CA THR 15 91.967 9.987 -5.631 1.00 0.00 ATOM 112 CB THR 15 91.901 8.415 -5.664 1.00 0.00 ATOM 113 CG2 THR 15 92.340 7.770 -4.317 1.00 0.00 ATOM 114 OG1 THR 15 90.568 8.024 -5.997 1.00 0.00 ATOM 115 O THR 15 92.771 10.942 -3.567 1.00 0.00 ATOM 116 C THR 15 93.072 10.500 -4.687 1.00 0.00 ATOM 117 N CYS 16 94.317 10.512 -5.154 1.00 0.00 ATOM 118 CA CYS 16 95.456 10.850 -4.262 1.00 0.00 ATOM 119 CB CYS 16 96.790 10.329 -4.785 1.00 0.00 ATOM 120 SG CYS 16 96.803 8.521 -4.738 1.00 0.00 ATOM 121 O CYS 16 95.848 12.780 -2.895 1.00 0.00 ATOM 122 C CYS 16 95.501 12.347 -4.020 1.00 0.00 ATOM 123 N THR 17 95.124 13.119 -5.058 1.00 0.00 ATOM 124 CA THR 17 94.980 14.582 -4.973 1.00 0.00 ATOM 125 CB THR 17 94.944 15.258 -6.356 1.00 0.00 ATOM 126 CG2 THR 17 94.947 16.748 -6.193 1.00 0.00 ATOM 127 OG1 THR 17 96.141 14.915 -7.102 1.00 0.00 ATOM 128 O THR 17 93.988 15.942 -3.255 1.00 0.00 ATOM 129 C THR 17 93.793 15.045 -4.085 1.00 0.00 ATOM 130 N LEU 18 92.614 14.423 -4.237 1.00 0.00 ATOM 131 CA LEU 18 91.490 14.609 -3.344 1.00 0.00 ATOM 132 CB LEU 18 90.351 13.666 -3.709 1.00 0.00 ATOM 133 CG LEU 18 89.126 14.335 -4.306 1.00 0.00 ATOM 134 CD1 LEU 18 89.519 15.217 -5.485 1.00 0.00 ATOM 135 CD2 LEU 18 88.109 13.266 -4.669 1.00 0.00 ATOM 136 O LEU 18 91.407 15.166 -0.978 1.00 0.00 ATOM 137 C LEU 18 91.811 14.369 -1.854 1.00 0.00 ATOM 138 N LEU 19 92.478 13.262 -1.579 1.00 0.00 ATOM 139 CA LEU 19 92.816 12.886 -0.210 1.00 0.00 ATOM 140 CB LEU 19 93.427 11.467 -0.183 1.00 0.00 ATOM 141 CG LEU 19 92.422 10.285 -0.352 1.00 0.00 ATOM 142 CD1 LEU 19 93.199 9.004 -0.453 1.00 0.00 ATOM 143 CD2 LEU 19 91.374 10.229 0.804 1.00 0.00 ATOM 144 O LEU 19 93.590 14.333 1.575 1.00 0.00 ATOM 145 C LEU 19 93.776 13.928 0.411 1.00 0.00 ATOM 146 N ARG 20 94.794 14.348 -0.347 1.00 0.00 ATOM 147 CA ARG 20 95.681 15.464 0.114 1.00 0.00 ATOM 148 CB ARG 20 96.851 15.670 -0.796 1.00 0.00 ATOM 149 CG ARG 20 97.778 14.556 -0.808 1.00 0.00 ATOM 150 CD ARG 20 98.848 14.782 -1.899 1.00 0.00 ATOM 151 NE ARG 20 99.666 13.596 -1.816 1.00 0.00 ATOM 152 CZ ARG 20 99.697 12.619 -2.716 1.00 0.00 ATOM 153 NH1 ARG 20 99.054 12.735 -3.887 1.00 0.00 ATOM 154 NH2 ARG 20 100.459 11.571 -2.453 1.00 0.00 ATOM 155 O ARG 20 95.095 17.388 1.471 1.00 0.00 ATOM 156 C ARG 20 94.983 16.788 0.362 1.00 0.00 ATOM 157 N GLU 21 94.257 17.247 -0.642 1.00 0.00 ATOM 158 CA GLU 21 93.509 18.526 -0.577 1.00 0.00 ATOM 159 CB GLU 21 92.884 18.854 -1.967 1.00 0.00 ATOM 160 CG GLU 21 94.036 19.058 -3.031 1.00 0.00 ATOM 161 CD GLU 21 93.573 19.515 -4.427 1.00 0.00 ATOM 162 OE1 GLU 21 92.357 19.402 -4.745 1.00 0.00 ATOM 163 OE2 GLU 21 94.458 19.952 -5.217 1.00 0.00 ATOM 164 O GLU 21 92.358 19.576 1.289 1.00 0.00 ATOM 165 C GLU 21 92.421 18.600 0.527 1.00 0.00 ATOM 166 N ASP 22 91.530 17.617 0.571 1.00 0.00 ATOM 167 CA ASP 22 90.414 17.696 1.496 1.00 0.00 ATOM 168 CB ASP 22 89.164 16.921 1.030 1.00 0.00 ATOM 169 CG ASP 22 88.752 17.246 -0.413 1.00 0.00 ATOM 170 OD1 ASP 22 88.701 18.441 -0.825 1.00 0.00 ATOM 171 OD2 ASP 22 88.504 16.277 -1.158 1.00 0.00 ATOM 172 O ASP 22 90.268 17.735 3.843 1.00 0.00 ATOM 173 C ASP 22 90.816 17.231 2.905 1.00 0.00 ATOM 174 N PHE 23 91.782 16.336 3.061 1.00 0.00 ATOM 175 CA PHE 23 91.988 15.661 4.357 1.00 0.00 ATOM 176 CB PHE 23 91.522 14.172 4.313 1.00 0.00 ATOM 177 CG PHE 23 90.069 14.001 3.906 1.00 0.00 ATOM 178 CD1 PHE 23 89.051 14.648 4.605 1.00 0.00 ATOM 179 CD2 PHE 23 89.723 13.229 2.804 1.00 0.00 ATOM 180 CE1 PHE 23 87.720 14.520 4.216 1.00 0.00 ATOM 181 CE2 PHE 23 88.392 13.111 2.381 1.00 0.00 ATOM 182 CZ PHE 23 87.385 13.758 3.068 1.00 0.00 ATOM 183 O PHE 23 93.691 15.215 6.012 1.00 0.00 ATOM 184 C PHE 23 93.386 15.696 4.863 1.00 0.00 ATOM 185 N GLY 24 94.275 16.184 4.023 1.00 0.00 ATOM 186 CA GLY 24 95.698 16.028 4.328 1.00 0.00 ATOM 187 O GLY 24 97.158 14.348 5.286 1.00 0.00 ATOM 188 C GLY 24 96.221 14.606 4.494 1.00 0.00 ATOM 189 N LEU 25 95.654 13.671 3.735 1.00 0.00 ATOM 190 CA LEU 25 96.166 12.320 3.705 1.00 0.00 ATOM 191 CB LEU 25 94.969 11.346 3.757 1.00 0.00 ATOM 192 CG LEU 25 94.266 11.268 5.114 1.00 0.00 ATOM 193 CD1 LEU 25 92.902 10.605 4.934 1.00 0.00 ATOM 194 CD2 LEU 25 95.143 10.464 6.083 1.00 0.00 ATOM 195 O LEU 25 96.507 12.377 1.380 1.00 0.00 ATOM 196 C LEU 25 96.995 12.127 2.427 1.00 0.00 ATOM 197 N SER 26 98.246 11.714 2.558 1.00 0.00 ATOM 198 CA SER 26 99.101 11.410 1.433 1.00 0.00 ATOM 199 CB SER 26 100.471 12.076 1.555 1.00 0.00 ATOM 200 OG SER 26 100.979 12.296 0.258 1.00 0.00 ATOM 201 O SER 26 99.842 9.278 2.289 1.00 0.00 ATOM 202 C SER 26 99.284 9.911 1.359 1.00 0.00 ATOM 203 N ILE 27 98.749 9.320 0.287 1.00 0.00 ATOM 204 CA ILE 27 98.904 7.884 0.117 1.00 0.00 ATOM 205 CB ILE 27 97.575 7.112 0.151 1.00 0.00 ATOM 206 CG1 ILE 27 96.690 7.478 -1.027 1.00 0.00 ATOM 207 CG2 ILE 27 96.846 7.361 1.542 1.00 0.00 ATOM 208 CD1 ILE 27 95.552 6.539 -1.187 1.00 0.00 ATOM 209 O ILE 27 99.665 8.235 -2.155 1.00 0.00 ATOM 210 C ILE 27 99.687 7.499 -1.142 1.00 0.00 ATOM 211 N ASP 28 100.320 6.339 -1.062 1.00 0.00 ATOM 212 CA ASP 28 101.021 5.759 -2.189 1.00 0.00 ATOM 213 CB ASP 28 102.504 5.551 -1.860 1.00 0.00 ATOM 214 CG ASP 28 103.297 4.967 -3.031 1.00 0.00 ATOM 215 OD1 ASP 28 102.942 5.229 -4.207 1.00 0.00 ATOM 216 OD2 ASP 28 104.318 4.278 -2.778 1.00 0.00 ATOM 217 O ASP 28 100.352 3.554 -1.589 1.00 0.00 ATOM 218 C ASP 28 100.361 4.443 -2.463 1.00 0.00 ATOM 219 N ILE 29 99.806 4.295 -3.678 1.00 0.00 ATOM 220 CA ILE 29 99.160 3.050 -4.033 1.00 0.00 ATOM 221 CB ILE 29 97.633 3.154 -3.961 1.00 0.00 ATOM 222 CG1 ILE 29 97.136 4.340 -4.784 1.00 0.00 ATOM 223 CG2 ILE 29 97.119 3.252 -2.432 1.00 0.00 ATOM 224 CD1 ILE 29 95.578 4.485 -4.697 1.00 0.00 ATOM 225 O ILE 29 99.732 3.467 -6.336 1.00 0.00 ATOM 226 C ILE 29 99.577 2.609 -5.456 1.00 0.00 ATOM 227 N PRO 30 99.748 1.282 -5.652 1.00 0.00 ATOM 228 CA PRO 30 100.195 0.692 -6.911 1.00 0.00 ATOM 229 CB PRO 30 100.687 -0.669 -6.479 1.00 0.00 ATOM 230 CG PRO 30 99.762 -1.038 -5.278 1.00 0.00 ATOM 231 CD PRO 30 99.413 0.251 -4.643 1.00 0.00 ATOM 232 O PRO 30 97.875 0.223 -7.419 1.00 0.00 ATOM 233 C PRO 30 99.016 0.537 -7.855 1.00 0.00 ATOM 234 N LEU 31 99.267 0.763 -9.154 1.00 0.00 ATOM 235 CA LEU 31 98.224 0.571 -10.183 1.00 0.00 ATOM 236 CB LEU 31 98.705 1.133 -11.562 1.00 0.00 ATOM 237 CG LEU 31 98.994 2.633 -11.530 1.00 0.00 ATOM 238 CD1 LEU 31 99.763 3.054 -12.782 1.00 0.00 ATOM 239 CD2 LEU 31 97.685 3.482 -11.373 1.00 0.00 ATOM 240 O LEU 31 96.802 -1.255 -10.839 1.00 0.00 ATOM 241 C LEU 31 97.834 -0.922 -10.275 1.00 0.00 ATOM 242 N GLU 32 98.618 -1.812 -9.664 1.00 0.00 ATOM 243 CA GLU 32 98.317 -3.253 -9.627 1.00 0.00 ATOM 244 CB GLU 32 99.495 -4.044 -9.065 1.00 0.00 ATOM 245 CG GLU 32 100.662 -4.250 -10.046 1.00 0.00 ATOM 246 CD GLU 32 101.570 -3.047 -10.139 1.00 0.00 ATOM 247 OE1 GLU 32 101.325 -2.036 -9.444 1.00 0.00 ATOM 248 OE2 GLU 32 102.514 -3.098 -10.938 1.00 0.00 ATOM 249 O GLU 32 96.498 -4.729 -9.038 1.00 0.00 ATOM 250 C GLU 32 97.060 -3.636 -8.815 1.00 0.00 ATOM 251 N ARG 33 96.656 -2.763 -7.875 1.00 0.00 ATOM 252 CA ARG 33 95.508 -3.055 -6.960 1.00 0.00 ATOM 253 CB ARG 33 95.971 -3.156 -5.474 1.00 0.00 ATOM 254 CG ARG 33 97.125 -4.182 -5.189 1.00 0.00 ATOM 255 CD ARG 33 96.511 -5.518 -5.054 1.00 0.00 ATOM 256 NE ARG 33 97.421 -6.638 -4.886 1.00 0.00 ATOM 257 CZ ARG 33 98.037 -7.337 -5.836 1.00 0.00 ATOM 258 NH1 ARG 33 97.900 -7.042 -7.149 1.00 0.00 ATOM 259 NH2 ARG 33 98.802 -8.353 -5.468 1.00 0.00 ATOM 260 O ARG 33 94.663 -0.961 -7.652 1.00 0.00 ATOM 261 C ARG 33 94.426 -2.027 -7.105 1.00 0.00 ATOM 262 N LEU 34 93.224 -2.373 -6.629 1.00 0.00 ATOM 263 CA LEU 34 92.039 -1.582 -6.713 1.00 0.00 ATOM 264 CB LEU 34 90.907 -2.211 -5.851 1.00 0.00 ATOM 265 CG LEU 34 89.615 -1.410 -5.618 1.00 0.00 ATOM 266 CD1 LEU 34 88.837 -1.104 -6.917 1.00 0.00 ATOM 267 CD2 LEU 34 88.672 -2.167 -4.642 1.00 0.00 ATOM 268 O LEU 34 92.907 -0.051 -5.076 1.00 0.00 ATOM 269 C LEU 34 92.362 -0.196 -6.214 1.00 0.00 ATOM 270 N ILE 35 92.030 0.786 -7.052 1.00 0.00 ATOM 271 CA ILE 35 92.266 2.214 -6.807 1.00 0.00 ATOM 272 CB ILE 35 92.570 3.035 -8.138 1.00 0.00 ATOM 273 CG1 ILE 35 93.815 2.498 -8.890 1.00 0.00 ATOM 274 CG2 ILE 35 92.619 4.541 -7.893 1.00 0.00 ATOM 275 CD1 ILE 35 95.129 2.478 -8.083 1.00 0.00 ATOM 276 O ILE 35 89.928 2.659 -6.982 1.00 0.00 ATOM 277 C ILE 35 90.914 2.662 -6.261 1.00 0.00 ATOM 278 N PRO 36 90.852 2.987 -4.948 1.00 0.00 ATOM 279 CA PRO 36 89.549 3.375 -4.424 1.00 0.00 ATOM 280 CB PRO 36 89.788 3.461 -2.886 1.00 0.00 ATOM 281 CG PRO 36 91.174 3.881 -2.760 1.00 0.00 ATOM 282 CD PRO 36 91.907 3.055 -3.900 1.00 0.00 ATOM 283 O PRO 36 89.858 5.595 -5.289 1.00 0.00 ATOM 284 C PRO 36 89.070 4.724 -4.967 1.00 0.00 ATOM 285 N THR 37 87.784 4.928 -5.027 1.00 0.00 ATOM 286 CA THR 37 87.315 6.243 -5.276 1.00 0.00 ATOM 287 CB THR 37 86.338 6.266 -6.455 1.00 0.00 ATOM 288 CG2 THR 37 87.070 5.805 -7.783 1.00 0.00 ATOM 289 OG1 THR 37 85.216 5.424 -6.167 1.00 0.00 ATOM 290 O THR 37 85.835 6.131 -3.360 1.00 0.00 ATOM 291 C THR 37 86.652 6.823 -4.002 1.00 0.00 ATOM 292 N VAL 38 86.972 8.078 -3.707 1.00 0.00 ATOM 293 CA VAL 38 86.803 8.643 -2.356 1.00 0.00 ATOM 294 CB VAL 38 87.717 9.907 -2.059 1.00 0.00 ATOM 295 CG1 VAL 38 87.462 10.479 -0.616 1.00 0.00 ATOM 296 CG2 VAL 38 89.182 9.630 -2.256 1.00 0.00 ATOM 297 O VAL 38 84.953 8.481 -0.916 1.00 0.00 ATOM 298 C VAL 38 85.331 8.875 -1.991 1.00 0.00 ATOM 299 N PRO 39 84.483 9.466 -2.890 1.00 0.00 ATOM 300 CA PRO 39 83.115 9.728 -2.558 1.00 0.00 ATOM 301 CB PRO 39 82.548 10.328 -3.886 1.00 0.00 ATOM 302 CG PRO 39 83.641 11.033 -4.446 1.00 0.00 ATOM 303 CD PRO 39 84.777 10.013 -4.244 1.00 0.00 ATOM 304 O PRO 39 81.577 8.607 -1.054 1.00 0.00 ATOM 305 C PRO 39 82.308 8.511 -2.084 1.00 0.00 ATOM 306 N LEU 40 82.449 7.379 -2.790 1.00 0.00 ATOM 307 CA LEU 40 81.765 6.152 -2.359 1.00 0.00 ATOM 308 CB LEU 40 81.905 5.014 -3.389 1.00 0.00 ATOM 309 CG LEU 40 80.663 4.179 -3.757 1.00 0.00 ATOM 310 CD1 LEU 40 80.238 3.361 -2.596 1.00 0.00 ATOM 311 CD2 LEU 40 79.478 4.996 -4.229 1.00 0.00 ATOM 312 O LEU 40 81.530 5.134 -0.207 1.00 0.00 ATOM 313 C LEU 40 82.313 5.632 -0.998 1.00 0.00 ATOM 314 N ARG 41 83.621 5.718 -0.782 1.00 0.00 ATOM 315 CA ARG 41 84.236 5.285 0.503 1.00 0.00 ATOM 316 CB ARG 41 85.759 5.293 0.460 1.00 0.00 ATOM 317 CG ARG 41 86.429 4.420 -0.599 1.00 0.00 ATOM 318 CD ARG 41 85.809 3.029 -0.685 1.00 0.00 ATOM 319 NE ARG 41 86.630 2.111 -1.454 1.00 0.00 ATOM 320 CZ ARG 41 86.480 1.919 -2.787 1.00 0.00 ATOM 321 NH1 ARG 41 87.224 1.011 -3.427 1.00 0.00 ATOM 322 NH2 ARG 41 85.540 2.593 -3.428 1.00 0.00 ATOM 323 O ARG 41 83.465 5.646 2.763 1.00 0.00 ATOM 324 C ARG 41 83.720 6.162 1.655 1.00 0.00 ATOM 325 N LEU 42 83.557 7.462 1.405 1.00 0.00 ATOM 326 CA LEU 42 82.945 8.358 2.370 1.00 0.00 ATOM 327 CB LEU 42 83.059 9.842 1.984 1.00 0.00 ATOM 328 CG LEU 42 84.473 10.407 2.131 1.00 0.00 ATOM 329 CD1 LEU 42 84.574 11.720 1.326 1.00 0.00 ATOM 330 CD2 LEU 42 84.805 10.608 3.641 1.00 0.00 ATOM 331 O LEU 42 81.121 8.124 3.878 1.00 0.00 ATOM 332 C LEU 42 81.498 8.035 2.698 1.00 0.00 ATOM 333 N ASN 43 80.684 7.656 1.695 1.00 0.00 ATOM 334 CA ASN 43 79.275 7.370 1.970 1.00 0.00 ATOM 335 CB ASN 43 78.474 6.881 0.746 1.00 0.00 ATOM 336 CG ASN 43 78.414 7.907 -0.416 1.00 0.00 ATOM 337 ND2 ASN 43 78.531 7.387 -1.628 1.00 0.00 ATOM 338 OD1 ASN 43 78.213 9.145 -0.214 1.00 0.00 ATOM 339 O ASN 43 78.224 6.280 3.839 1.00 0.00 ATOM 340 C ASN 43 79.143 6.270 3.016 1.00 0.00 ATOM 341 N TYR 44 79.968 5.249 2.851 1.00 0.00 ATOM 342 CA TYR 44 79.971 4.098 3.744 1.00 0.00 ATOM 343 CB TYR 44 80.903 3.042 3.192 1.00 0.00 ATOM 344 CG TYR 44 80.715 1.626 3.718 1.00 0.00 ATOM 345 CD1 TYR 44 79.813 1.305 4.760 1.00 0.00 ATOM 346 CD2 TYR 44 81.512 0.634 3.228 1.00 0.00 ATOM 347 CE1 TYR 44 79.727 -0.051 5.248 1.00 0.00 ATOM 348 CE2 TYR 44 81.447 -0.685 3.666 1.00 0.00 ATOM 349 CZ TYR 44 80.555 -1.007 4.694 1.00 0.00 ATOM 350 OH TYR 44 80.564 -2.302 5.063 1.00 0.00 ATOM 351 O TYR 44 79.857 4.088 6.151 1.00 0.00 ATOM 352 C TYR 44 80.444 4.498 5.175 1.00 0.00 ATOM 353 N ILE 45 81.547 5.236 5.269 1.00 0.00 ATOM 354 CA ILE 45 81.969 5.803 6.563 1.00 0.00 ATOM 355 CB ILE 45 83.172 6.728 6.439 1.00 0.00 ATOM 356 CG1 ILE 45 84.404 5.980 5.940 1.00 0.00 ATOM 357 CG2 ILE 45 83.432 7.535 7.824 1.00 0.00 ATOM 358 CD1 ILE 45 85.158 5.018 6.986 1.00 0.00 ATOM 359 O ILE 45 80.631 6.268 8.458 1.00 0.00 ATOM 360 C ILE 45 80.850 6.519 7.263 1.00 0.00 ATOM 361 N HIS 46 80.139 7.423 6.571 1.00 0.00 ATOM 362 CA HIS 46 78.995 8.080 7.182 1.00 0.00 ATOM 363 CB HIS 46 78.486 9.294 6.382 1.00 0.00 ATOM 364 CG HIS 46 79.544 10.315 6.159 1.00 0.00 ATOM 365 CD2 HIS 46 80.522 10.767 6.982 1.00 0.00 ATOM 366 ND1 HIS 46 79.785 10.882 4.924 1.00 0.00 ATOM 367 CE1 HIS 46 80.819 11.698 5.026 1.00 0.00 ATOM 368 NE2 HIS 46 81.285 11.639 6.262 1.00 0.00 ATOM 369 O HIS 46 77.186 7.363 8.558 1.00 0.00 ATOM 370 C HIS 46 77.868 7.144 7.534 1.00 0.00 ATOM 371 N TRP 47 77.649 6.101 6.716 1.00 0.00 ATOM 372 CA TRP 47 76.578 5.150 7.076 1.00 0.00 ATOM 373 CB TRP 47 76.297 4.139 5.975 1.00 0.00 ATOM 374 CG TRP 47 74.968 3.400 6.199 1.00 0.00 ATOM 375 CD1 TRP 47 73.757 3.961 6.527 1.00 0.00 ATOM 376 CD2 TRP 47 74.733 1.989 6.119 1.00 0.00 ATOM 377 CE2 TRP 47 73.373 1.773 6.384 1.00 0.00 ATOM 378 CE3 TRP 47 75.533 0.890 5.801 1.00 0.00 ATOM 379 NE1 TRP 47 72.803 2.987 6.639 1.00 0.00 ATOM 380 CZ2 TRP 47 72.800 0.511 6.337 1.00 0.00 ATOM 381 CZ3 TRP 47 74.973 -0.356 5.792 1.00 0.00 ATOM 382 CH2 TRP 47 73.622 -0.541 6.042 1.00 0.00 ATOM 383 O TRP 47 76.030 4.147 9.204 1.00 0.00 ATOM 384 C TRP 47 76.923 4.390 8.403 1.00 0.00 ATOM 385 N VAL 48 78.198 4.037 8.578 1.00 0.00 ATOM 386 CA VAL 48 78.741 3.468 9.835 1.00 0.00 ATOM 387 CB VAL 48 80.211 3.037 9.680 1.00 0.00 ATOM 388 CG1 VAL 48 80.821 2.552 11.035 1.00 0.00 ATOM 389 CG2 VAL 48 80.362 1.916 8.577 1.00 0.00 ATOM 390 O VAL 48 78.017 4.019 12.081 1.00 0.00 ATOM 391 C VAL 48 78.499 4.452 11.023 1.00 0.00 ATOM 392 N GLU 49 78.789 5.745 10.837 1.00 0.00 ATOM 393 CA GLU 49 78.435 6.774 11.808 1.00 0.00 ATOM 394 CB GLU 49 78.663 8.176 11.270 1.00 0.00 ATOM 395 CG GLU 49 80.126 8.580 11.085 1.00 0.00 ATOM 396 CD GLU 49 80.290 9.870 10.299 1.00 0.00 ATOM 397 OE1 GLU 49 79.340 10.698 10.317 1.00 0.00 ATOM 398 OE2 GLU 49 81.374 10.051 9.692 1.00 0.00 ATOM 399 O GLU 49 76.731 6.606 13.474 1.00 0.00 ATOM 400 C GLU 49 76.982 6.649 12.271 1.00 0.00 ATOM 401 N ASP 50 76.049 6.612 11.315 1.00 0.00 ATOM 402 CA ASP 50 74.599 6.465 11.595 1.00 0.00 ATOM 403 CB ASP 50 73.766 6.539 10.302 1.00 0.00 ATOM 404 CG ASP 50 73.901 7.900 9.583 1.00 0.00 ATOM 405 OD1 ASP 50 74.352 8.886 10.231 1.00 0.00 ATOM 406 OD2 ASP 50 73.554 7.972 8.377 1.00 0.00 ATOM 407 O ASP 50 73.484 5.183 13.304 1.00 0.00 ATOM 408 C ASP 50 74.279 5.178 12.340 1.00 0.00 ATOM 409 N LEU 51 74.927 4.096 11.932 1.00 0.00 ATOM 410 CA LEU 51 74.714 2.815 12.565 1.00 0.00 ATOM 411 CB LEU 51 75.394 1.698 11.759 1.00 0.00 ATOM 412 CG LEU 51 74.745 1.353 10.410 1.00 0.00 ATOM 413 CD1 LEU 51 75.639 0.355 9.662 1.00 0.00 ATOM 414 CD2 LEU 51 73.331 0.795 10.629 1.00 0.00 ATOM 415 O LEU 51 74.499 2.198 14.887 1.00 0.00 ATOM 416 C LEU 51 75.192 2.759 14.055 1.00 0.00 ATOM 417 N ILE 52 76.363 3.315 14.351 1.00 0.00 ATOM 418 CA ILE 52 76.963 3.161 15.673 1.00 0.00 ATOM 419 CB ILE 52 78.497 3.043 15.640 1.00 0.00 ATOM 420 CG1 ILE 52 79.164 4.393 15.354 1.00 0.00 ATOM 421 CG2 ILE 52 78.902 1.886 14.685 1.00 0.00 ATOM 422 CD1 ILE 52 80.709 4.348 15.427 1.00 0.00 ATOM 423 O ILE 52 76.758 4.013 17.889 1.00 0.00 ATOM 424 C ILE 52 76.498 4.184 16.691 1.00 0.00 ATOM 425 N GLY 53 75.819 5.232 16.234 1.00 0.00 ATOM 426 CA GLY 53 75.123 6.157 17.129 1.00 0.00 ATOM 427 O GLY 53 77.169 7.299 17.586 1.00 0.00 ATOM 428 C GLY 53 75.959 7.388 17.462 1.00 0.00 ATOM 429 N HIS 54 75.293 8.533 17.596 1.00 0.00 ATOM 430 CA HIS 54 75.893 9.762 18.143 1.00 0.00 ATOM 431 CB HIS 54 74.981 10.949 17.859 1.00 0.00 ATOM 432 CG HIS 54 75.456 12.225 18.489 1.00 0.00 ATOM 433 CD2 HIS 54 76.586 12.946 18.284 1.00 0.00 ATOM 434 ND1 HIS 54 74.785 12.843 19.533 1.00 0.00 ATOM 435 CE1 HIS 54 75.457 13.925 19.900 1.00 0.00 ATOM 436 NE2 HIS 54 76.554 14.010 19.159 1.00 0.00 ATOM 437 O HIS 54 75.144 9.166 20.384 1.00 0.00 ATOM 438 C HIS 54 76.065 9.634 19.685 1.00 0.00 ATOM 439 N GLN 55 77.207 10.064 20.209 1.00 0.00 ATOM 440 CA GLN 55 77.430 10.053 21.697 1.00 0.00 ATOM 441 CB GLN 55 78.780 9.411 22.052 1.00 0.00 ATOM 442 CG GLN 55 78.844 7.944 21.711 1.00 0.00 ATOM 443 CD GLN 55 80.209 7.325 21.867 1.00 0.00 ATOM 444 OE1 GLN 55 81.251 7.944 21.609 1.00 0.00 ATOM 445 NE2 GLN 55 80.219 6.114 22.308 1.00 0.00 ATOM 446 O GLN 55 78.010 12.369 21.776 1.00 0.00 ATOM 447 C GLN 55 77.371 11.465 22.279 1.00 0.00 ATOM 448 N ASP 56 76.607 11.660 23.348 1.00 0.00 ATOM 449 CA ASP 56 76.783 12.862 24.160 1.00 0.00 ATOM 450 CB ASP 56 75.692 12.953 25.220 1.00 0.00 ATOM 451 CG ASP 56 74.296 13.187 24.582 1.00 0.00 ATOM 452 OD1 ASP 56 74.237 13.944 23.556 1.00 0.00 ATOM 453 OD2 ASP 56 73.282 12.594 25.060 1.00 0.00 ATOM 454 O ASP 56 78.941 11.949 24.806 1.00 0.00 ATOM 455 C ASP 56 78.225 12.953 24.692 1.00 0.00 ATOM 456 N SER 57 78.666 14.186 24.877 1.00 0.00 ATOM 457 CA SER 57 80.012 14.516 25.311 1.00 0.00 ATOM 458 CB SER 57 80.059 16.029 25.539 1.00 0.00 ATOM 459 OG SER 57 81.364 16.432 25.888 1.00 0.00 ATOM 460 O SER 57 81.583 13.368 26.740 1.00 0.00 ATOM 461 C SER 57 80.431 13.774 26.602 1.00 0.00 ATOM 462 N ASP 58 79.485 13.591 27.525 1.00 0.00 ATOM 463 CA ASP 58 79.770 12.860 28.789 1.00 0.00 ATOM 464 CB ASP 58 78.745 13.194 29.883 1.00 0.00 ATOM 465 CG ASP 58 77.309 12.916 29.459 1.00 0.00 ATOM 466 OD1 ASP 58 77.013 12.886 28.242 1.00 0.00 ATOM 467 OD2 ASP 58 76.450 12.731 30.337 1.00 0.00 ATOM 468 O ASP 58 80.326 10.656 29.553 1.00 0.00 ATOM 469 C ASP 58 79.886 11.343 28.620 1.00 0.00 ATOM 470 N LYS 59 79.476 10.798 27.462 1.00 0.00 ATOM 471 CA LYS 59 79.686 9.363 27.206 1.00 0.00 ATOM 472 CB LYS 59 78.386 8.565 27.316 1.00 0.00 ATOM 473 CG LYS 59 77.206 9.213 26.641 1.00 0.00 ATOM 474 CD LYS 59 76.096 8.232 26.471 1.00 0.00 ATOM 475 CE LYS 59 75.401 8.452 25.148 1.00 0.00 ATOM 476 NZ LYS 59 75.052 7.125 24.559 1.00 0.00 ATOM 477 O LYS 59 80.371 7.961 25.355 1.00 0.00 ATOM 478 C LYS 59 80.437 9.070 25.906 1.00 0.00 ATOM 479 N SER 60 81.167 10.074 25.441 1.00 0.00 ATOM 480 CA SER 60 82.130 9.916 24.360 1.00 0.00 ATOM 481 CB SER 60 82.868 11.243 24.132 1.00 0.00 ATOM 482 OG SER 60 83.336 11.341 22.785 1.00 0.00 ATOM 483 O SER 60 83.658 8.644 25.825 1.00 0.00 ATOM 484 C SER 60 83.128 8.772 24.678 1.00 0.00 ATOM 485 N THR 61 83.342 7.901 23.696 1.00 0.00 ATOM 486 CA THR 61 84.303 6.813 23.853 1.00 0.00 ATOM 487 CB THR 61 83.622 5.403 24.070 1.00 0.00 ATOM 488 CG2 THR 61 82.790 5.348 25.353 1.00 0.00 ATOM 489 OG1 THR 61 82.774 5.058 22.960 1.00 0.00 ATOM 490 O THR 61 84.799 7.321 21.555 1.00 0.00 ATOM 491 C THR 61 85.154 6.732 22.586 1.00 0.00 ATOM 492 N LEU 62 86.242 5.985 22.658 1.00 0.00 ATOM 493 CA LEU 62 86.988 5.676 21.459 1.00 0.00 ATOM 494 CB LEU 62 88.364 5.092 21.817 1.00 0.00 ATOM 495 CG LEU 62 89.207 4.576 20.644 1.00 0.00 ATOM 496 CD1 LEU 62 89.736 5.771 19.816 1.00 0.00 ATOM 497 CD2 LEU 62 90.336 3.701 21.167 1.00 0.00 ATOM 498 O LEU 62 85.913 3.548 21.167 1.00 0.00 ATOM 499 C LEU 62 86.153 4.644 20.676 1.00 0.00 ATOM 500 N ARG 63 85.669 4.999 19.482 1.00 0.00 ATOM 501 CA ARG 63 84.939 3.983 18.667 1.00 0.00 ATOM 502 CB ARG 63 83.971 4.620 17.688 1.00 0.00 ATOM 503 CG ARG 63 83.137 5.675 18.361 1.00 0.00 ATOM 504 CD ARG 63 82.152 5.025 19.433 1.00 0.00 ATOM 505 NE ARG 63 80.888 5.651 19.202 1.00 0.00 ATOM 506 CZ ARG 63 79.745 5.043 19.019 1.00 0.00 ATOM 507 NH1 ARG 63 79.612 3.738 19.143 1.00 0.00 ATOM 508 NH2 ARG 63 78.713 5.790 18.758 1.00 0.00 ATOM 509 O ARG 63 87.048 3.435 17.735 1.00 0.00 ATOM 510 C ARG 63 85.938 3.035 18.025 1.00 0.00 ATOM 511 N ARG 64 85.583 1.763 17.891 1.00 0.00 ATOM 512 CA ARG 64 86.541 0.743 17.463 1.00 0.00 ATOM 513 CB ARG 64 86.975 -0.231 18.582 1.00 0.00 ATOM 514 CG ARG 64 87.828 0.413 19.705 1.00 0.00 ATOM 515 CD ARG 64 88.187 -0.603 20.806 1.00 0.00 ATOM 516 NE ARG 64 88.758 0.083 21.999 1.00 0.00 ATOM 517 CZ ARG 64 88.027 0.607 23.000 1.00 0.00 ATOM 518 NH1 ARG 64 86.693 0.566 22.965 1.00 0.00 ATOM 519 NH2 ARG 64 88.628 1.202 24.041 1.00 0.00 ATOM 520 O ARG 64 84.803 -0.586 16.488 1.00 0.00 ATOM 521 C ARG 64 85.890 -0.103 16.347 1.00 0.00 ATOM 522 N GLY 65 86.606 -0.304 15.248 1.00 0.00 ATOM 523 CA GLY 65 86.028 -1.059 14.150 1.00 0.00 ATOM 524 O GLY 65 88.207 -1.825 13.752 1.00 0.00 ATOM 525 C GLY 65 87.037 -1.949 13.499 1.00 0.00 ATOM 526 N ILE 66 86.560 -2.817 12.602 1.00 0.00 ATOM 527 CA ILE 66 87.397 -3.809 11.979 1.00 0.00 ATOM 528 CB ILE 66 87.020 -5.255 12.388 1.00 0.00 ATOM 529 CG1 ILE 66 87.220 -5.529 13.919 1.00 0.00 ATOM 530 CG2 ILE 66 87.825 -6.322 11.578 1.00 0.00 ATOM 531 CD1 ILE 66 86.400 -6.723 14.351 1.00 0.00 ATOM 532 O ILE 66 85.944 -3.510 10.003 1.00 0.00 ATOM 533 C ILE 66 87.095 -3.578 10.435 1.00 0.00 ATOM 534 N ASP 67 88.142 -3.380 9.657 1.00 0.00 ATOM 535 CA ASP 67 87.935 -3.284 8.180 1.00 0.00 ATOM 536 CB ASP 67 88.641 -2.057 7.642 1.00 0.00 ATOM 537 CG ASP 67 88.548 -1.942 6.076 1.00 0.00 ATOM 538 OD1 ASP 67 87.615 -2.509 5.486 1.00 0.00 ATOM 539 OD2 ASP 67 89.362 -1.213 5.517 1.00 0.00 ATOM 540 O ASP 67 89.708 -4.697 7.639 1.00 0.00 ATOM 541 C ASP 67 88.530 -4.544 7.605 1.00 0.00 ATOM 542 N ILE 68 87.681 -5.454 7.143 1.00 0.00 ATOM 543 CA ILE 68 88.101 -6.709 6.485 1.00 0.00 ATOM 544 CB ILE 68 86.889 -7.709 6.411 1.00 0.00 ATOM 545 CG1 ILE 68 86.262 -7.943 7.826 1.00 0.00 ATOM 546 CG2 ILE 68 87.286 -9.053 5.696 1.00 0.00 ATOM 547 CD1 ILE 68 84.743 -8.364 7.731 1.00 0.00 ATOM 548 O ILE 68 87.704 -6.002 4.214 1.00 0.00 ATOM 549 C ILE 68 88.535 -6.420 5.007 1.00 0.00 ATOM 550 N GLY 69 89.810 -6.624 4.697 1.00 0.00 ATOM 551 CA GLY 69 90.289 -6.520 3.307 1.00 0.00 ATOM 552 O GLY 69 89.841 -4.435 2.285 1.00 0.00 ATOM 553 C GLY 69 90.550 -5.060 3.051 1.00 0.00 ATOM 554 N THR 70 91.538 -4.541 3.756 1.00 0.00 ATOM 555 CA THR 70 91.765 -3.114 3.854 1.00 0.00 ATOM 556 CB THR 70 92.604 -2.691 5.120 1.00 0.00 ATOM 557 CG2 THR 70 94.182 -2.742 4.853 1.00 0.00 ATOM 558 OG1 THR 70 92.259 -1.327 5.407 1.00 0.00 ATOM 559 O THR 70 92.161 -1.276 2.377 1.00 0.00 ATOM 560 C THR 70 92.375 -2.459 2.591 1.00 0.00 ATOM 561 N GLY 71 93.082 -3.237 1.754 1.00 0.00 ATOM 562 CA GLY 71 93.549 -2.729 0.437 1.00 0.00 ATOM 563 O GLY 71 95.407 -1.894 1.731 1.00 0.00 ATOM 564 C GLY 71 94.901 -2.073 0.598 1.00 0.00 ATOM 565 N ALA 72 95.527 -1.727 -0.520 1.00 0.00 ATOM 566 CA ALA 72 96.790 -1.047 -0.502 1.00 0.00 ATOM 567 CB ALA 72 97.459 -0.982 -1.938 1.00 0.00 ATOM 568 O ALA 72 97.552 0.854 0.689 1.00 0.00 ATOM 569 C ALA 72 96.631 0.357 0.068 1.00 0.00 ATOM 570 N SER 73 95.492 0.973 -0.195 1.00 0.00 ATOM 571 CA SER 73 95.165 2.346 0.204 1.00 0.00 ATOM 572 CB SER 73 93.939 2.801 -0.568 1.00 0.00 ATOM 573 OG SER 73 92.704 2.174 -0.122 1.00 0.00 ATOM 574 O SER 73 95.074 3.576 2.313 1.00 0.00 ATOM 575 C SER 73 94.916 2.480 1.758 1.00 0.00 ATOM 576 N CYS 74 94.483 1.370 2.357 1.00 0.00 ATOM 577 CA CYS 74 93.909 1.295 3.729 1.00 0.00 ATOM 578 CB CYS 74 95.049 1.469 4.750 1.00 0.00 ATOM 579 SG CYS 74 94.661 1.034 6.514 1.00 0.00 ATOM 580 O CYS 74 92.842 3.106 4.891 1.00 0.00 ATOM 581 C CYS 74 92.884 2.400 3.869 1.00 0.00 ATOM 582 N ILE 75 92.056 2.581 2.826 1.00 0.00 ATOM 583 CA ILE 75 91.222 3.726 2.727 1.00 0.00 ATOM 584 CB ILE 75 90.519 3.908 1.348 1.00 0.00 ATOM 585 CG1 ILE 75 89.783 5.272 1.341 1.00 0.00 ATOM 586 CG2 ILE 75 89.483 2.792 1.083 1.00 0.00 ATOM 587 CD1 ILE 75 90.652 6.541 1.239 1.00 0.00 ATOM 588 O ILE 75 89.994 5.075 4.309 1.00 0.00 ATOM 589 C ILE 75 90.167 3.941 3.851 1.00 0.00 ATOM 590 N TYR 76 89.435 2.898 4.209 1.00 0.00 ATOM 591 CA TYR 76 88.420 3.123 5.199 1.00 0.00 ATOM 592 CB TYR 76 87.392 1.998 5.347 1.00 0.00 ATOM 593 CG TYR 76 86.517 1.651 4.135 1.00 0.00 ATOM 594 CD1 TYR 76 85.590 2.564 3.625 1.00 0.00 ATOM 595 CD2 TYR 76 86.506 0.352 3.621 1.00 0.00 ATOM 596 CE1 TYR 76 84.716 2.186 2.627 1.00 0.00 ATOM 597 CE2 TYR 76 85.662 -0.019 2.550 1.00 0.00 ATOM 598 CZ TYR 76 84.794 0.927 2.067 1.00 0.00 ATOM 599 OH TYR 76 83.952 0.584 1.055 1.00 0.00 ATOM 600 O TYR 76 88.579 4.459 7.161 1.00 0.00 ATOM 601 C TYR 76 89.045 3.500 6.576 1.00 0.00 ATOM 602 N PRO 77 90.044 2.763 7.076 1.00 0.00 ATOM 603 CA PRO 77 90.626 3.289 8.349 1.00 0.00 ATOM 604 CB PRO 77 91.687 2.247 8.719 1.00 0.00 ATOM 605 CG PRO 77 91.181 0.923 8.012 1.00 0.00 ATOM 606 CD PRO 77 90.666 1.489 6.690 1.00 0.00 ATOM 607 O PRO 77 91.027 5.440 9.171 1.00 0.00 ATOM 608 C PRO 77 91.237 4.679 8.266 1.00 0.00 ATOM 609 N LEU 78 91.992 5.015 7.208 1.00 0.00 ATOM 610 CA LEU 78 92.505 6.375 7.041 1.00 0.00 ATOM 611 CB LEU 78 93.377 6.571 5.771 1.00 0.00 ATOM 612 CG LEU 78 94.657 5.751 5.624 1.00 0.00 ATOM 613 CD1 LEU 78 95.278 6.107 4.240 1.00 0.00 ATOM 614 CD2 LEU 78 95.686 6.066 6.693 1.00 0.00 ATOM 615 O LEU 78 91.645 8.459 7.830 1.00 0.00 ATOM 616 C LEU 78 91.443 7.445 7.118 1.00 0.00 ATOM 617 N LEU 79 90.326 7.246 6.425 1.00 0.00 ATOM 618 CA LEU 79 89.204 8.139 6.495 1.00 0.00 ATOM 619 CB LEU 79 88.156 7.811 5.419 1.00 0.00 ATOM 620 CG LEU 79 88.526 8.030 3.900 1.00 0.00 ATOM 621 CD1 LEU 79 87.281 7.693 3.066 1.00 0.00 ATOM 622 CD2 LEU 79 88.960 9.445 3.614 1.00 0.00 ATOM 623 O LEU 79 88.237 9.143 8.457 1.00 0.00 ATOM 624 C LEU 79 88.513 8.104 7.908 1.00 0.00 ATOM 625 N GLY 80 88.185 6.923 8.406 1.00 0.00 ATOM 626 CA GLY 80 87.500 6.760 9.734 1.00 0.00 ATOM 627 O GLY 80 87.792 8.194 11.638 1.00 0.00 ATOM 628 C GLY 80 88.320 7.426 10.841 1.00 0.00 ATOM 629 N ALA 81 89.615 7.138 10.852 1.00 0.00 ATOM 630 CA ALA 81 90.538 7.626 11.867 1.00 0.00 ATOM 631 CB ALA 81 91.843 6.826 11.817 1.00 0.00 ATOM 632 O ALA 81 90.907 9.897 12.725 1.00 0.00 ATOM 633 C ALA 81 90.782 9.144 11.723 1.00 0.00 ATOM 634 N THR 82 90.802 9.634 10.485 1.00 0.00 ATOM 635 CA THR 82 91.055 11.041 10.237 1.00 0.00 ATOM 636 CB THR 82 91.606 11.318 8.779 1.00 0.00 ATOM 637 CG2 THR 82 91.846 12.810 8.528 1.00 0.00 ATOM 638 OG1 THR 82 92.831 10.611 8.603 1.00 0.00 ATOM 639 O THR 82 89.929 12.916 11.148 1.00 0.00 ATOM 640 C THR 82 89.842 11.871 10.497 1.00 0.00 ATOM 641 N LEU 83 88.689 11.433 10.009 1.00 0.00 ATOM 642 CA LEU 83 87.514 12.270 10.159 1.00 0.00 ATOM 643 CB LEU 83 86.386 11.906 9.199 1.00 0.00 ATOM 644 CG LEU 83 86.654 12.013 7.669 1.00 0.00 ATOM 645 CD1 LEU 83 85.357 11.938 6.859 1.00 0.00 ATOM 646 CD2 LEU 83 87.432 13.223 7.341 1.00 0.00 ATOM 647 O LEU 83 86.582 13.185 12.163 1.00 0.00 ATOM 648 C LEU 83 87.004 12.181 11.608 1.00 0.00 ATOM 649 N ASN 84 87.008 10.974 12.179 1.00 0.00 ATOM 650 CA ASN 84 86.162 10.695 13.336 1.00 0.00 ATOM 651 CB ASN 84 85.094 9.634 13.023 1.00 0.00 ATOM 652 CG ASN 84 84.131 10.060 11.890 1.00 0.00 ATOM 653 ND2 ASN 84 83.674 9.094 11.107 1.00 0.00 ATOM 654 OD1 ASN 84 83.812 11.243 11.735 1.00 0.00 ATOM 655 O ASN 84 86.384 10.166 15.639 1.00 0.00 ATOM 656 C ASN 84 86.962 10.299 14.568 1.00 0.00 ATOM 657 N GLY 85 88.263 10.111 14.411 1.00 0.00 ATOM 658 CA GLY 85 89.139 9.579 15.451 1.00 0.00 ATOM 659 O GLY 85 89.049 7.764 16.961 1.00 0.00 ATOM 660 C GLY 85 88.818 8.132 15.839 1.00 0.00 ATOM 661 N TRP 86 88.260 7.331 14.906 1.00 0.00 ATOM 662 CA TRP 86 88.052 5.907 15.122 1.00 0.00 ATOM 663 CB TRP 86 87.099 5.315 14.077 1.00 0.00 ATOM 664 CG TRP 86 85.726 5.864 14.089 1.00 0.00 ATOM 665 CD1 TRP 86 85.143 6.618 15.081 1.00 0.00 ATOM 666 CD2 TRP 86 84.730 5.699 13.061 1.00 0.00 ATOM 667 CE2 TRP 86 83.572 6.373 13.503 1.00 0.00 ATOM 668 CE3 TRP 86 84.723 5.063 11.784 1.00 0.00 ATOM 669 NE1 TRP 86 83.854 6.926 14.744 1.00 0.00 ATOM 670 CZ2 TRP 86 82.402 6.414 12.751 1.00 0.00 ATOM 671 CZ3 TRP 86 83.556 5.088 11.035 1.00 0.00 ATOM 672 CH2 TRP 86 82.402 5.756 11.511 1.00 0.00 ATOM 673 O TRP 86 90.256 5.445 14.313 1.00 0.00 ATOM 674 C TRP 86 89.373 5.140 15.104 1.00 0.00 ATOM 675 N TYR 87 89.484 4.175 16.012 1.00 0.00 ATOM 676 CA TYR 87 90.406 3.053 15.970 1.00 0.00 ATOM 677 CB TYR 87 90.560 2.440 17.397 1.00 0.00 ATOM 678 CG TYR 87 91.468 1.242 17.465 1.00 0.00 ATOM 679 CD1 TYR 87 92.843 1.400 17.660 1.00 0.00 ATOM 680 CD2 TYR 87 90.951 -0.049 17.350 1.00 0.00 ATOM 681 CE1 TYR 87 93.679 0.327 17.700 1.00 0.00 ATOM 682 CE2 TYR 87 91.784 -1.146 17.409 1.00 0.00 ATOM 683 CZ TYR 87 93.152 -0.936 17.571 1.00 0.00 ATOM 684 OH TYR 87 94.002 -2.019 17.615 1.00 0.00 ATOM 685 O TYR 87 88.762 1.508 15.045 1.00 0.00 ATOM 686 C TYR 87 89.912 1.893 15.019 1.00 0.00 ATOM 687 N PHE 88 90.848 1.285 14.337 1.00 0.00 ATOM 688 CA PHE 88 90.607 0.162 13.416 1.00 0.00 ATOM 689 CB PHE 88 90.751 0.668 11.947 1.00 0.00 ATOM 690 CG PHE 88 89.563 1.422 11.432 1.00 0.00 ATOM 691 CD1 PHE 88 88.574 0.754 10.684 1.00 0.00 ATOM 692 CD2 PHE 88 89.427 2.804 11.643 1.00 0.00 ATOM 693 CE1 PHE 88 87.457 1.501 10.168 1.00 0.00 ATOM 694 CE2 PHE 88 88.325 3.515 11.141 1.00 0.00 ATOM 695 CZ PHE 88 87.339 2.866 10.416 1.00 0.00 ATOM 696 O PHE 88 92.805 -0.763 13.649 1.00 0.00 ATOM 697 C PHE 88 91.588 -0.965 13.604 1.00 0.00 ATOM 698 N LEU 89 91.062 -2.181 13.670 1.00 0.00 ATOM 699 CA LEU 89 91.861 -3.349 13.271 1.00 0.00 ATOM 700 CB LEU 89 91.352 -4.610 13.955 1.00 0.00 ATOM 701 CG LEU 89 92.158 -5.883 13.685 1.00 0.00 ATOM 702 CD1 LEU 89 93.650 -5.756 14.073 1.00 0.00 ATOM 703 CD2 LEU 89 91.495 -7.004 14.439 1.00 0.00 ATOM 704 O LEU 89 90.427 -3.410 11.366 1.00 0.00 ATOM 705 C LEU 89 91.577 -3.456 11.747 1.00 0.00 ATOM 706 N ALA 90 92.610 -3.479 10.917 1.00 0.00 ATOM 707 CA ALA 90 92.434 -3.515 9.425 1.00 0.00 ATOM 708 CB ALA 90 93.052 -2.241 8.734 1.00 0.00 ATOM 709 O ALA 90 94.296 -4.914 9.213 1.00 0.00 ATOM 710 C ALA 90 93.133 -4.768 8.972 1.00 0.00 ATOM 711 N THR 91 92.420 -5.720 8.353 1.00 0.00 ATOM 712 CA THR 91 93.064 -6.962 7.925 1.00 0.00 ATOM 713 CB THR 91 92.234 -8.191 8.320 1.00 0.00 ATOM 714 CG2 THR 91 91.982 -8.226 9.840 1.00 0.00 ATOM 715 OG1 THR 91 90.963 -8.122 7.701 1.00 0.00 ATOM 716 O THR 91 92.563 -6.369 5.663 1.00 0.00 ATOM 717 C THR 91 93.297 -7.014 6.411 1.00 0.00 ATOM 718 N GLU 92 94.319 -7.779 6.011 1.00 0.00 ATOM 719 CA GLU 92 94.632 -8.092 4.581 1.00 0.00 ATOM 720 CB GLU 92 95.728 -7.188 4.003 1.00 0.00 ATOM 721 CG GLU 92 95.270 -6.195 2.929 1.00 0.00 ATOM 722 CD GLU 92 94.438 -6.844 1.832 1.00 0.00 ATOM 723 OE1 GLU 92 93.501 -6.211 1.391 1.00 0.00 ATOM 724 OE2 GLU 92 94.702 -7.998 1.426 1.00 0.00 ATOM 725 O GLU 92 95.770 -9.970 5.491 1.00 0.00 ATOM 726 C GLU 92 95.153 -9.513 4.521 1.00 0.00 ATOM 727 N VAL 93 94.914 -10.193 3.389 1.00 0.00 ATOM 728 CA VAL 93 95.601 -11.443 3.067 1.00 0.00 ATOM 729 CB VAL 93 94.644 -12.567 2.594 1.00 0.00 ATOM 730 CG1 VAL 93 93.693 -12.939 3.696 1.00 0.00 ATOM 731 CG2 VAL 93 93.870 -12.192 1.277 1.00 0.00 ATOM 732 O VAL 93 97.620 -12.003 1.944 1.00 0.00 ATOM 733 C VAL 93 96.678 -11.225 2.016 1.00 0.00 ATOM 734 N ASP 94 96.556 -10.157 1.216 1.00 0.00 ATOM 735 CA ASP 94 97.505 -9.900 0.116 1.00 0.00 ATOM 736 CB ASP 94 96.811 -9.110 -0.992 1.00 0.00 ATOM 737 CG ASP 94 97.720 -8.868 -2.200 1.00 0.00 ATOM 738 OD1 ASP 94 98.052 -9.848 -2.903 1.00 0.00 ATOM 739 OD2 ASP 94 98.145 -7.711 -2.423 1.00 0.00 ATOM 740 O ASP 94 98.749 -8.151 1.213 1.00 0.00 ATOM 741 C ASP 94 98.798 -9.209 0.591 1.00 0.00 ATOM 742 N ASP 95 99.961 -9.796 0.322 1.00 0.00 ATOM 743 CA ASP 95 101.220 -9.202 0.786 1.00 0.00 ATOM 744 CB ASP 95 102.440 -10.004 0.328 1.00 0.00 ATOM 745 CG ASP 95 103.017 -10.863 1.422 1.00 0.00 ATOM 746 OD1 ASP 95 103.375 -10.308 2.503 1.00 0.00 ATOM 747 OD2 ASP 95 103.132 -12.109 1.170 1.00 0.00 ATOM 748 O ASP 95 101.902 -6.914 0.973 1.00 0.00 ATOM 749 C ASP 95 101.421 -7.787 0.263 1.00 0.00 ATOM 750 N MET 96 101.145 -7.571 -1.014 1.00 0.00 ATOM 751 CA MET 96 101.414 -6.239 -1.580 1.00 0.00 ATOM 752 CB MET 96 101.254 -6.224 -3.114 1.00 0.00 ATOM 753 CG MET 96 101.340 -4.854 -3.705 1.00 0.00 ATOM 754 SD MET 96 100.952 -4.801 -5.522 1.00 0.00 ATOM 755 CE MET 96 102.198 -5.912 -6.129 1.00 0.00 ATOM 756 O MET 96 100.884 -4.123 -0.619 1.00 0.00 ATOM 757 C MET 96 100.474 -5.218 -0.943 1.00 0.00 ATOM 758 N CYS 97 99.212 -5.566 -0.783 1.00 0.00 ATOM 759 CA CYS 97 98.288 -4.637 -0.153 1.00 0.00 ATOM 760 CB CYS 97 96.856 -5.171 -0.192 1.00 0.00 ATOM 761 SG CYS 97 95.969 -4.999 -1.833 1.00 0.00 ATOM 762 O CYS 97 98.639 -3.189 1.824 1.00 0.00 ATOM 763 C CYS 97 98.703 -4.331 1.354 1.00 0.00 ATOM 764 N PHE 98 99.082 -5.380 2.061 1.00 0.00 ATOM 765 CA PHE 98 99.535 -5.303 3.442 1.00 0.00 ATOM 766 CB PHE 98 99.937 -6.696 3.946 1.00 0.00 ATOM 767 CG PHE 98 100.540 -6.702 5.345 1.00 0.00 ATOM 768 CD1 PHE 98 99.772 -6.337 6.444 1.00 0.00 ATOM 769 CD2 PHE 98 101.869 -7.055 5.541 1.00 0.00 ATOM 770 CE1 PHE 98 100.314 -6.356 7.759 1.00 0.00 ATOM 771 CE2 PHE 98 102.421 -7.096 6.871 1.00 0.00 ATOM 772 CZ PHE 98 101.624 -6.736 7.958 1.00 0.00 ATOM 773 O PHE 98 100.593 -3.365 4.360 1.00 0.00 ATOM 774 C PHE 98 100.691 -4.315 3.572 1.00 0.00 ATOM 775 N ASN 99 101.728 -4.480 2.745 1.00 0.00 ATOM 776 CA ASN 99 102.900 -3.645 2.780 1.00 0.00 ATOM 777 CB ASN 99 103.962 -4.123 1.760 1.00 0.00 ATOM 778 CG ASN 99 104.641 -5.443 2.196 1.00 0.00 ATOM 779 ND2 ASN 99 104.894 -5.577 3.487 1.00 0.00 ATOM 780 OD1 ASN 99 104.913 -6.328 1.376 1.00 0.00 ATOM 781 O ASN 99 102.977 -1.345 3.294 1.00 0.00 ATOM 782 C ASN 99 102.539 -2.219 2.562 1.00 0.00 ATOM 783 N TYR 100 101.692 -1.976 1.560 1.00 0.00 ATOM 784 CA TYR 100 101.280 -0.653 1.212 1.00 0.00 ATOM 785 CB TYR 100 100.535 -0.673 -0.138 1.00 0.00 ATOM 786 CG TYR 100 101.456 -0.471 -1.330 1.00 0.00 ATOM 787 CD1 TYR 100 101.856 -1.542 -2.119 1.00 0.00 ATOM 788 CD2 TYR 100 101.917 0.800 -1.642 1.00 0.00 ATOM 789 CE1 TYR 100 102.710 -1.329 -3.239 1.00 0.00 ATOM 790 CE2 TYR 100 102.722 1.038 -2.727 1.00 0.00 ATOM 791 CZ TYR 100 103.118 -0.030 -3.531 1.00 0.00 ATOM 792 OH TYR 100 103.952 0.257 -4.564 1.00 0.00 ATOM 793 O TYR 100 100.595 1.187 2.592 1.00 0.00 ATOM 794 C TYR 100 100.400 0.012 2.287 1.00 0.00 ATOM 795 N ALA 101 99.445 -0.736 2.819 1.00 0.00 ATOM 796 CA ALA 101 98.568 -0.266 3.884 1.00 0.00 ATOM 797 CB ALA 101 97.532 -1.317 4.224 1.00 0.00 ATOM 798 O ALA 101 99.046 1.308 5.699 1.00 0.00 ATOM 799 C ALA 101 99.341 0.205 5.151 1.00 0.00 ATOM 800 N LYS 102 100.316 -0.617 5.574 1.00 0.00 ATOM 801 CA LYS 102 101.243 -0.311 6.690 1.00 0.00 ATOM 802 CB LYS 102 102.286 -1.423 6.857 1.00 0.00 ATOM 803 CG LYS 102 101.800 -2.571 7.735 1.00 0.00 ATOM 804 CD LYS 102 102.737 -3.780 7.725 1.00 0.00 ATOM 805 CE LYS 102 104.225 -3.467 7.889 1.00 0.00 ATOM 806 NZ LYS 102 105.069 -4.744 7.765 1.00 0.00 ATOM 807 O LYS 102 102.025 1.923 7.265 1.00 0.00 ATOM 808 C LYS 102 101.978 1.007 6.421 1.00 0.00 ATOM 809 N LYS 103 102.533 1.109 5.215 1.00 0.00 ATOM 810 CA LYS 103 103.264 2.290 4.819 1.00 0.00 ATOM 811 CB LYS 103 103.883 2.115 3.422 1.00 0.00 ATOM 812 CG LYS 103 104.971 3.118 3.112 1.00 0.00 ATOM 813 CD LYS 103 104.698 3.892 1.816 1.00 0.00 ATOM 814 CE LYS 103 105.903 4.748 1.411 1.00 0.00 ATOM 815 NZ LYS 103 105.576 5.767 0.348 1.00 0.00 ATOM 816 O LYS 103 102.773 4.596 5.291 1.00 0.00 ATOM 817 C LYS 103 102.347 3.508 4.825 1.00 0.00 ATOM 818 N ASN 104 101.123 3.365 4.270 1.00 0.00 ATOM 819 CA ASN 104 100.176 4.482 4.280 1.00 0.00 ATOM 820 CB ASN 104 98.973 4.223 3.376 1.00 0.00 ATOM 821 CG ASN 104 99.343 4.225 1.868 1.00 0.00 ATOM 822 ND2 ASN 104 100.268 5.030 1.507 1.00 0.00 ATOM 823 OD1 ASN 104 98.801 3.454 1.071 1.00 0.00 ATOM 824 O ASN 104 99.559 6.049 6.014 1.00 0.00 ATOM 825 C ASN 104 99.740 4.883 5.723 1.00 0.00 ATOM 826 N VAL 105 99.557 3.913 6.605 1.00 0.00 ATOM 827 CA VAL 105 99.272 4.280 8.045 1.00 0.00 ATOM 828 CB VAL 105 98.913 3.073 8.884 1.00 0.00 ATOM 829 CG1 VAL 105 98.842 3.464 10.469 1.00 0.00 ATOM 830 CG2 VAL 105 97.602 2.543 8.438 1.00 0.00 ATOM 831 O VAL 105 100.170 6.226 9.129 1.00 0.00 ATOM 832 C VAL 105 100.415 5.116 8.656 1.00 0.00 ATOM 833 N GLU 106 101.656 4.620 8.524 1.00 0.00 ATOM 834 CA GLU 106 102.834 5.240 9.094 1.00 0.00 ATOM 835 CB GLU 106 104.075 4.388 8.847 1.00 0.00 ATOM 836 CG GLU 106 104.057 3.113 9.649 1.00 0.00 ATOM 837 CD GLU 106 104.904 2.021 9.053 1.00 0.00 ATOM 838 OE1 GLU 106 105.546 2.270 7.991 1.00 0.00 ATOM 839 OE2 GLU 106 104.919 0.907 9.640 1.00 0.00 ATOM 840 O GLU 106 103.387 7.551 9.286 1.00 0.00 ATOM 841 C GLU 106 103.072 6.608 8.544 1.00 0.00 ATOM 842 N GLN 107 102.884 6.749 7.229 1.00 0.00 ATOM 843 CA GLN 107 103.226 7.993 6.595 1.00 0.00 ATOM 844 CB GLN 107 103.335 7.759 5.072 1.00 0.00 ATOM 845 CG GLN 107 102.267 8.380 4.208 1.00 0.00 ATOM 846 CD GLN 107 102.613 8.231 2.676 1.00 0.00 ATOM 847 OE1 GLN 107 102.212 7.264 2.027 1.00 0.00 ATOM 848 NE2 GLN 107 103.377 9.176 2.139 1.00 0.00 ATOM 849 O GLN 107 102.460 10.201 6.773 1.00 0.00 ATOM 850 C GLN 107 102.207 9.036 6.931 1.00 0.00 ATOM 851 N ASN 108 101.015 8.648 7.351 1.00 0.00 ATOM 852 CA ASN 108 100.086 9.673 7.811 1.00 0.00 ATOM 853 CB ASN 108 98.723 9.494 7.172 1.00 0.00 ATOM 854 CG ASN 108 98.812 9.653 5.673 1.00 0.00 ATOM 855 ND2 ASN 108 98.796 10.875 5.219 1.00 0.00 ATOM 856 OD1 ASN 108 98.969 8.664 4.946 1.00 0.00 ATOM 857 O ASN 108 99.051 10.336 9.882 1.00 0.00 ATOM 858 C ASN 108 99.994 9.777 9.345 1.00 0.00 ATOM 859 N ASN 109 100.995 9.193 9.982 1.00 0.00 ATOM 860 CA ASN 109 101.162 9.142 11.449 1.00 0.00 ATOM 861 CB ASN 109 101.538 10.537 11.987 1.00 0.00 ATOM 862 CG ASN 109 102.836 11.067 11.396 1.00 0.00 ATOM 863 ND2 ASN 109 103.888 10.285 11.469 1.00 0.00 ATOM 864 OD1 ASN 109 102.866 12.159 10.843 1.00 0.00 ATOM 865 O ASN 109 99.441 9.342 13.041 1.00 0.00 ATOM 866 C ASN 109 99.942 8.655 12.176 1.00 0.00 ATOM 867 N LEU 110 99.466 7.460 11.855 1.00 0.00 ATOM 868 CA LEU 110 98.207 7.003 12.404 1.00 0.00 ATOM 869 CB LEU 110 97.121 7.030 11.331 1.00 0.00 ATOM 870 CG LEU 110 96.485 8.388 11.096 1.00 0.00 ATOM 871 CD1 LEU 110 95.774 8.366 9.733 1.00 0.00 ATOM 872 CD2 LEU 110 95.526 8.799 12.267 1.00 0.00 ATOM 873 O LEU 110 97.375 4.957 13.177 1.00 0.00 ATOM 874 C LEU 110 98.334 5.632 12.987 1.00 0.00 ATOM 875 N SER 111 99.554 5.216 13.262 1.00 0.00 ATOM 876 CA SER 111 99.815 3.926 13.858 1.00 0.00 ATOM 877 CB SER 111 101.300 3.780 14.027 1.00 0.00 ATOM 878 OG SER 111 101.826 3.777 12.719 1.00 0.00 ATOM 879 O SER 111 98.855 2.578 15.560 1.00 0.00 ATOM 880 C SER 111 99.141 3.703 15.215 1.00 0.00 ATOM 881 N ASP 112 98.844 4.783 15.933 1.00 0.00 ATOM 882 CA ASP 112 98.075 4.686 17.202 1.00 0.00 ATOM 883 CB ASP 112 98.232 6.003 17.999 1.00 0.00 ATOM 884 CG ASP 112 99.671 6.205 18.500 1.00 0.00 ATOM 885 OD1 ASP 112 100.382 5.184 18.664 1.00 0.00 ATOM 886 OD2 ASP 112 100.088 7.365 18.719 1.00 0.00 ATOM 887 O ASP 112 95.929 3.763 17.872 1.00 0.00 ATOM 888 C ASP 112 96.591 4.351 16.985 1.00 0.00 ATOM 889 N LEU 113 96.056 4.724 15.818 1.00 0.00 ATOM 890 CA LEU 113 94.645 4.482 15.593 1.00 0.00 ATOM 891 CB LEU 113 93.931 5.761 15.153 1.00 0.00 ATOM 892 CG LEU 113 93.653 6.914 16.153 1.00 0.00 ATOM 893 CD1 LEU 113 92.879 8.038 15.512 1.00 0.00 ATOM 894 CD2 LEU 113 92.906 6.427 17.367 1.00 0.00 ATOM 895 O LEU 113 93.298 2.812 14.599 1.00 0.00 ATOM 896 C LEU 113 94.384 3.306 14.651 1.00 0.00 ATOM 897 N ILE 114 95.406 2.815 13.953 1.00 0.00 ATOM 898 CA ILE 114 95.161 1.739 13.006 1.00 0.00 ATOM 899 CB ILE 114 95.159 2.264 11.498 1.00 0.00 ATOM 900 CG1 ILE 114 94.254 3.469 11.339 1.00 0.00 ATOM 901 CG2 ILE 114 94.847 1.082 10.542 1.00 0.00 ATOM 902 CD1 ILE 114 94.488 4.260 9.979 1.00 0.00 ATOM 903 O ILE 114 97.367 0.888 12.971 1.00 0.00 ATOM 904 C ILE 114 96.164 0.667 13.113 1.00 0.00 ATOM 905 N LYS 115 95.673 -0.527 13.311 1.00 0.00 ATOM 906 CA LYS 115 96.568 -1.637 13.420 1.00 0.00 ATOM 907 CB LYS 115 96.265 -2.423 14.703 1.00 0.00 ATOM 908 CG LYS 115 97.093 -3.643 14.913 1.00 0.00 ATOM 909 CD LYS 115 96.556 -4.433 16.126 1.00 0.00 ATOM 910 CE LYS 115 97.512 -5.524 16.565 1.00 0.00 ATOM 911 NZ LYS 115 96.824 -6.462 17.498 1.00 0.00 ATOM 912 O LYS 115 95.256 -3.136 12.122 1.00 0.00 ATOM 913 C LYS 115 96.315 -2.531 12.207 1.00 0.00 ATOM 914 N VAL 116 97.312 -2.633 11.320 1.00 0.00 ATOM 915 CA VAL 116 97.170 -3.430 10.079 1.00 0.00 ATOM 916 CB VAL 116 97.848 -2.760 8.827 1.00 0.00 ATOM 917 CG1 VAL 116 97.498 -3.603 7.569 1.00 0.00 ATOM 918 CG2 VAL 116 97.356 -1.294 8.632 1.00 0.00 ATOM 919 O VAL 116 98.853 -4.956 10.725 1.00 0.00 ATOM 920 C VAL 116 97.733 -4.816 10.311 1.00 0.00 ATOM 921 N VAL 117 96.925 -5.842 10.085 1.00 0.00 ATOM 922 CA VAL 117 97.371 -7.192 10.297 1.00 0.00 ATOM 923 CB VAL 117 96.636 -7.891 11.488 1.00 0.00 ATOM 924 CG1 VAL 117 97.003 -7.192 12.830 1.00 0.00 ATOM 925 CG2 VAL 117 95.138 -7.870 11.290 1.00 0.00 ATOM 926 O VAL 117 96.254 -7.838 8.269 1.00 0.00 ATOM 927 C VAL 117 97.216 -8.004 9.019 1.00 0.00 ATOM 928 N LYS 118 98.209 -8.838 8.766 1.00 0.00 ATOM 929 CA LYS 118 98.100 -9.873 7.748 1.00 0.00 ATOM 930 CB LYS 118 99.440 -10.103 7.061 1.00 0.00 ATOM 931 CG LYS 118 99.249 -10.793 5.727 1.00 0.00 ATOM 932 CD LYS 118 100.547 -10.983 5.041 1.00 0.00 ATOM 933 CE LYS 118 100.449 -12.253 4.238 1.00 0.00 ATOM 934 NZ LYS 118 101.715 -12.528 3.531 1.00 0.00 ATOM 935 O LYS 118 98.225 -11.710 9.291 1.00 0.00 ATOM 936 C LYS 118 97.582 -11.161 8.391 1.00 0.00 ATOM 937 N VAL 119 96.401 -11.600 7.948 1.00 0.00 ATOM 938 CA VAL 119 95.740 -12.815 8.425 1.00 0.00 ATOM 939 CB VAL 119 94.211 -12.564 8.670 1.00 0.00 ATOM 940 CG1 VAL 119 94.040 -11.379 9.607 1.00 0.00 ATOM 941 CG2 VAL 119 93.443 -12.336 7.348 1.00 0.00 ATOM 942 O VAL 119 96.505 -13.702 6.330 1.00 0.00 ATOM 943 C VAL 119 95.994 -13.955 7.415 1.00 0.00 ATOM 944 N PRO 120 95.697 -15.216 7.777 1.00 0.00 ATOM 945 CA PRO 120 95.736 -16.287 6.743 1.00 0.00 ATOM 946 CB PRO 120 95.981 -17.552 7.564 1.00 0.00 ATOM 947 CG PRO 120 95.376 -17.263 8.911 1.00 0.00 ATOM 948 CD PRO 120 95.391 -15.742 9.124 1.00 0.00 ATOM 949 O PRO 120 93.379 -15.999 6.434 1.00 0.00 ATOM 950 C PRO 120 94.435 -16.359 5.918 1.00 0.00 ATOM 951 N GLN 121 94.504 -16.790 4.647 1.00 0.00 ATOM 952 CA GLN 121 93.381 -16.577 3.681 1.00 0.00 ATOM 953 CB GLN 121 93.833 -16.800 2.217 1.00 0.00 ATOM 954 CG GLN 121 93.285 -15.747 1.185 1.00 0.00 ATOM 955 CD GLN 121 91.789 -15.906 0.800 1.00 0.00 ATOM 956 OE1 GLN 121 91.473 -16.496 -0.249 1.00 0.00 ATOM 957 NE2 GLN 121 90.878 -15.359 1.621 1.00 0.00 ATOM 958 O GLN 121 90.994 -17.000 3.565 1.00 0.00 ATOM 959 C GLN 121 92.107 -17.384 3.968 1.00 0.00 ATOM 960 N THR 123 90.875 -17.336 6.753 1.00 0.00 ATOM 961 CA THR 123 90.318 -16.678 7.939 1.00 0.00 ATOM 962 CB THR 123 91.356 -16.457 9.088 1.00 0.00 ATOM 963 CG2 THR 123 92.071 -17.768 9.483 1.00 0.00 ATOM 964 OG1 THR 123 92.322 -15.478 8.707 1.00 0.00 ATOM 965 O THR 123 89.809 -14.738 6.581 1.00 0.00 ATOM 966 C THR 123 89.574 -15.383 7.619 1.00 0.00 ATOM 967 N LEU 124 88.660 -15.034 8.522 1.00 0.00 ATOM 968 CA LEU 124 87.896 -13.829 8.401 1.00 0.00 ATOM 969 CB LEU 124 86.482 -14.128 7.908 1.00 0.00 ATOM 970 CG LEU 124 85.906 -13.148 6.870 1.00 0.00 ATOM 971 CD1 LEU 124 86.745 -13.171 5.594 1.00 0.00 ATOM 972 CD2 LEU 124 84.496 -13.563 6.533 1.00 0.00 ATOM 973 O LEU 124 88.936 -12.405 9.997 1.00 0.00 ATOM 974 C LEU 124 87.905 -13.038 9.710 1.00 0.00 ATOM 975 N LEU 125 86.787 -13.034 10.458 1.00 0.00 ATOM 976 CA LEU 125 86.689 -12.280 11.722 1.00 0.00 ATOM 977 CB LEU 125 85.267 -11.775 11.991 1.00 0.00 ATOM 978 CG LEU 125 84.799 -10.537 11.254 1.00 0.00 ATOM 979 CD1 LEU 125 83.298 -10.313 11.464 1.00 0.00 ATOM 980 CD2 LEU 125 85.640 -9.308 11.661 1.00 0.00 ATOM 981 O LEU 125 87.766 -12.610 13.824 1.00 0.00 ATOM 982 C LEU 125 87.100 -13.112 12.916 1.00 0.00 ATOM 983 N MET 126 86.669 -14.374 12.917 1.00 0.00 ATOM 984 CA MET 126 86.829 -15.253 14.051 1.00 0.00 ATOM 985 CB MET 126 86.122 -16.583 13.814 1.00 0.00 ATOM 986 CG MET 126 84.726 -16.565 14.365 1.00 0.00 ATOM 987 SD MET 126 84.580 -17.188 16.078 1.00 0.00 ATOM 988 CE MET 126 85.743 -16.247 17.087 1.00 0.00 ATOM 989 O MET 126 88.596 -15.443 15.628 1.00 0.00 ATOM 990 C MET 126 88.274 -15.450 14.442 1.00 0.00 ATOM 991 N ASP 127 89.158 -15.576 13.466 1.00 0.00 ATOM 992 CA ASP 127 90.574 -15.722 13.787 1.00 0.00 ATOM 993 CB ASP 127 91.369 -16.292 12.619 1.00 0.00 ATOM 994 CG ASP 127 92.759 -16.748 13.042 1.00 0.00 ATOM 995 OD1 ASP 127 92.882 -17.854 13.616 1.00 0.00 ATOM 996 OD2 ASP 127 93.728 -15.998 12.833 1.00 0.00 ATOM 997 O ASP 127 92.154 -14.460 15.071 1.00 0.00 ATOM 998 C ASP 127 91.232 -14.436 14.256 1.00 0.00 ATOM 999 N ALA 128 90.786 -13.310 13.726 1.00 0.00 ATOM 1000 CA ALA 128 91.352 -12.034 14.155 1.00 0.00 ATOM 1001 CB ALA 128 91.017 -10.943 13.149 1.00 0.00 ATOM 1002 O ALA 128 91.610 -11.079 16.343 1.00 0.00 ATOM 1003 C ALA 128 90.879 -11.670 15.581 1.00 0.00 ATOM 1004 N LEU 129 89.660 -12.052 15.927 1.00 0.00 ATOM 1005 CA LEU 129 89.050 -11.694 17.219 1.00 0.00 ATOM 1006 CB LEU 129 87.613 -11.250 16.989 1.00 0.00 ATOM 1007 CG LEU 129 87.446 -9.974 16.176 1.00 0.00 ATOM 1008 CD1 LEU 129 85.994 -9.604 16.170 1.00 0.00 ATOM 1009 CD2 LEU 129 88.313 -8.871 16.766 1.00 0.00 ATOM 1010 O LEU 129 88.316 -12.740 19.264 1.00 0.00 ATOM 1011 C LEU 129 89.043 -12.824 18.259 1.00 0.00 ATOM 1012 N LYS 130 89.823 -13.882 18.032 1.00 0.00 ATOM 1013 CA LYS 130 89.760 -15.049 18.921 1.00 0.00 ATOM 1014 CB LYS 130 90.442 -16.278 18.285 1.00 0.00 ATOM 1015 CG LYS 130 91.927 -16.073 18.038 1.00 0.00 ATOM 1016 CD LYS 130 92.625 -17.234 17.337 1.00 0.00 ATOM 1017 CE LYS 130 94.109 -16.885 17.209 1.00 0.00 ATOM 1018 NZ LYS 130 94.860 -17.750 16.268 1.00 0.00 ATOM 1019 O LYS 130 91.434 -14.019 20.368 1.00 0.00 ATOM 1020 C LYS 130 90.381 -14.690 20.285 1.00 0.00 ATOM 1021 N GLU 131 89.728 -15.142 21.350 1.00 0.00 ATOM 1022 CA GLU 131 90.058 -14.697 22.715 1.00 0.00 ATOM 1023 CB GLU 131 91.192 -15.565 23.343 1.00 0.00 ATOM 1024 CG GLU 131 90.674 -16.830 24.123 1.00 0.00 ATOM 1025 CD GLU 131 91.767 -17.898 24.411 1.00 0.00 ATOM 1026 OE1 GLU 131 92.960 -17.529 24.652 1.00 0.00 ATOM 1027 OE2 GLU 131 91.428 -19.118 24.406 1.00 0.00 ATOM 1028 O GLU 131 91.257 -12.679 23.461 1.00 0.00 ATOM 1029 C GLU 131 90.279 -13.160 22.841 1.00 0.00 ATOM 1030 N GLU 132 89.375 -12.396 22.212 1.00 0.00 ATOM 1031 CA GLU 132 89.183 -11.000 22.570 1.00 0.00 ATOM 1032 CB GLU 132 88.870 -10.111 21.366 1.00 0.00 ATOM 1033 CG GLU 132 88.400 -8.717 21.744 1.00 0.00 ATOM 1034 CD GLU 132 89.478 -7.876 22.439 1.00 0.00 ATOM 1035 OE1 GLU 132 89.378 -7.615 23.663 1.00 0.00 ATOM 1036 OE2 GLU 132 90.432 -7.463 21.761 1.00 0.00 ATOM 1037 O GLU 132 86.909 -11.422 23.271 1.00 0.00 ATOM 1038 C GLU 132 88.036 -11.000 23.567 1.00 0.00 ATOM 1039 N SER 133 88.330 -10.563 24.776 1.00 0.00 ATOM 1040 CA SER 133 87.337 -10.644 25.840 1.00 0.00 ATOM 1041 CB SER 133 87.671 -11.795 26.798 1.00 0.00 ATOM 1042 OG SER 133 89.001 -11.624 27.282 1.00 0.00 ATOM 1043 O SER 133 86.547 -9.203 27.565 1.00 0.00 ATOM 1044 C SER 133 87.294 -9.322 26.600 1.00 0.00 ATOM 1045 N GLU 134 88.084 -8.338 26.167 1.00 0.00 ATOM 1046 CA GLU 134 88.094 -7.047 26.859 1.00 0.00 ATOM 1047 CB GLU 134 89.511 -6.556 27.046 1.00 0.00 ATOM 1048 CG GLU 134 90.225 -7.429 28.070 1.00 0.00 ATOM 1049 CD GLU 134 91.493 -6.824 28.586 1.00 0.00 ATOM 1050 OE1 GLU 134 91.915 -5.774 28.057 1.00 0.00 ATOM 1051 OE2 GLU 134 92.072 -7.414 29.532 1.00 0.00 ATOM 1052 O GLU 134 86.662 -5.127 27.109 1.00 0.00 ATOM 1053 C GLU 134 87.180 -5.944 26.318 1.00 0.00 ATOM 1054 N ILE 135 86.986 -5.880 24.995 1.00 0.00 ATOM 1055 CA ILE 135 86.065 -4.874 24.460 1.00 0.00 ATOM 1056 CB ILE 135 86.778 -3.604 23.960 1.00 0.00 ATOM 1057 CG1 ILE 135 85.752 -2.409 23.790 1.00 0.00 ATOM 1058 CG2 ILE 135 87.590 -3.935 22.660 1.00 0.00 ATOM 1059 CD1 ILE 135 84.415 -2.234 24.843 1.00 0.00 ATOM 1060 O ILE 135 85.329 -6.512 22.878 1.00 0.00 ATOM 1061 C ILE 135 85.117 -5.412 23.411 1.00 0.00 ATOM 1062 N ILE 136 84.031 -4.661 23.214 1.00 0.00 ATOM 1063 CA ILE 136 83.146 -4.891 22.134 1.00 0.00 ATOM 1064 CB ILE 136 81.647 -5.273 22.553 1.00 0.00 ATOM 1065 CG1 ILE 136 80.526 -4.651 21.706 1.00 0.00 ATOM 1066 CG2 ILE 136 81.391 -5.270 24.131 1.00 0.00 ATOM 1067 CD1 ILE 136 80.829 -3.359 21.154 1.00 0.00 ATOM 1068 O ILE 136 83.636 -2.691 21.217 1.00 0.00 ATOM 1069 C ILE 136 83.444 -3.885 20.986 1.00 0.00 ATOM 1070 N TYR 137 83.625 -4.417 19.789 1.00 0.00 ATOM 1071 CA TYR 137 83.894 -3.576 18.629 1.00 0.00 ATOM 1072 CB TYR 137 84.454 -4.450 17.497 1.00 0.00 ATOM 1073 CG TYR 137 85.896 -4.615 17.619 1.00 0.00 ATOM 1074 CD1 TYR 137 86.443 -5.637 18.394 1.00 0.00 ATOM 1075 CD2 TYR 137 86.761 -3.709 16.998 1.00 0.00 ATOM 1076 CE1 TYR 137 87.839 -5.752 18.523 1.00 0.00 ATOM 1077 CE2 TYR 137 88.121 -3.838 17.091 1.00 0.00 ATOM 1078 CZ TYR 137 88.649 -4.879 17.849 1.00 0.00 ATOM 1079 OH TYR 137 90.013 -4.965 17.974 1.00 0.00 ATOM 1080 O TYR 137 81.509 -3.580 18.382 1.00 0.00 ATOM 1081 C TYR 137 82.566 -2.949 18.279 1.00 0.00 ATOM 1082 N ASP 138 82.605 -1.691 17.892 1.00 0.00 ATOM 1083 CA ASP 138 81.396 -1.042 17.385 1.00 0.00 ATOM 1084 CB ASP 138 81.557 0.468 17.351 1.00 0.00 ATOM 1085 CG ASP 138 81.795 1.038 18.770 1.00 0.00 ATOM 1086 OD1 ASP 138 80.836 1.033 19.561 1.00 0.00 ATOM 1087 OD2 ASP 138 82.916 1.386 19.082 1.00 0.00 ATOM 1088 O ASP 138 79.709 -1.594 15.815 1.00 0.00 ATOM 1089 C ASP 138 80.901 -1.561 16.019 1.00 0.00 ATOM 1090 N PHE 139 81.811 -1.951 15.136 1.00 0.00 ATOM 1091 CA PHE 139 81.403 -2.296 13.732 1.00 0.00 ATOM 1092 CB PHE 139 81.068 -1.002 12.921 1.00 0.00 ATOM 1093 CG PHE 139 82.267 -0.110 12.690 1.00 0.00 ATOM 1094 CD1 PHE 139 83.105 -0.293 11.557 1.00 0.00 ATOM 1095 CD2 PHE 139 82.562 0.926 13.576 1.00 0.00 ATOM 1096 CE1 PHE 139 84.208 0.551 11.334 1.00 0.00 ATOM 1097 CE2 PHE 139 83.665 1.738 13.379 1.00 0.00 ATOM 1098 CZ PHE 139 84.493 1.565 12.266 1.00 0.00 ATOM 1099 O PHE 139 83.588 -3.199 13.448 1.00 0.00 ATOM 1100 C PHE 139 82.446 -3.119 13.027 1.00 0.00 ATOM 1101 N CYS 140 82.037 -3.827 11.973 1.00 0.00 ATOM 1102 CA CYS 140 82.996 -4.163 10.962 1.00 0.00 ATOM 1103 CB CYS 140 83.321 -5.674 10.875 1.00 0.00 ATOM 1104 SG CYS 140 82.008 -6.651 10.125 1.00 0.00 ATOM 1105 O CYS 140 81.233 -3.377 9.483 1.00 0.00 ATOM 1106 C CYS 140 82.413 -3.611 9.627 1.00 0.00 ATOM 1107 N MET 141 83.307 -3.315 8.727 1.00 0.00 ATOM 1108 CA MET 141 82.917 -2.878 7.395 1.00 0.00 ATOM 1109 CB MET 141 83.046 -1.342 7.255 1.00 0.00 ATOM 1110 CG MET 141 84.421 -0.717 7.358 1.00 0.00 ATOM 1111 SD MET 141 84.272 1.095 7.648 1.00 0.00 ATOM 1112 CE MET 141 83.341 1.640 6.177 1.00 0.00 ATOM 1113 O MET 141 84.804 -4.282 6.815 1.00 0.00 ATOM 1114 C MET 141 83.761 -3.718 6.420 1.00 0.00 ATOM 1115 N CYS 142 83.288 -3.832 5.167 1.00 0.00 ATOM 1116 CA CYS 142 84.027 -4.609 4.205 1.00 0.00 ATOM 1117 CB CYS 142 83.724 -6.102 4.399 1.00 0.00 ATOM 1118 SG CYS 142 84.497 -7.181 3.132 1.00 0.00 ATOM 1119 O CYS 142 82.418 -4.047 2.527 1.00 0.00 ATOM 1120 C CYS 142 83.604 -4.180 2.814 1.00 0.00 ATOM 1121 N ASN 143 84.597 -3.881 1.992 1.00 0.00 ATOM 1122 CA ASN 143 84.378 -3.891 0.519 1.00 0.00 ATOM 1123 CB ASN 143 85.070 -2.703 -0.092 1.00 0.00 ATOM 1124 CG ASN 143 84.838 -2.597 -1.620 1.00 0.00 ATOM 1125 ND2 ASN 143 85.656 -1.768 -2.271 1.00 0.00 ATOM 1126 OD1 ASN 143 83.934 -3.232 -2.177 1.00 0.00 ATOM 1127 O ASN 143 86.114 -5.397 -0.100 1.00 0.00 ATOM 1128 C ASN 143 84.939 -5.237 -0.010 1.00 0.00 ATOM 1129 N PRO 144 84.063 -6.230 -0.272 1.00 0.00 ATOM 1130 CA PRO 144 84.477 -7.601 -0.540 1.00 0.00 ATOM 1131 CB PRO 144 83.146 -8.358 -0.654 1.00 0.00 ATOM 1132 CG PRO 144 82.153 -7.342 -0.941 1.00 0.00 ATOM 1133 CD PRO 144 82.624 -6.046 -0.379 1.00 0.00 ATOM 1134 O PRO 144 85.203 -7.012 -2.793 1.00 0.00 ATOM 1135 C PRO 144 85.332 -7.797 -1.848 1.00 0.00 ATOM 1136 N PRO 145 86.229 -8.795 -1.841 1.00 0.00 ATOM 1137 CA PRO 145 86.905 -9.162 -3.092 1.00 0.00 ATOM 1138 CB PRO 145 88.061 -10.050 -2.645 1.00 0.00 ATOM 1139 CG PRO 145 87.539 -10.690 -1.341 1.00 0.00 ATOM 1140 CD PRO 145 86.622 -9.670 -0.708 1.00 0.00 ATOM 1141 O PRO 145 84.911 -10.446 -3.648 1.00 0.00 ATOM 1142 C PRO 145 85.977 -9.932 -4.045 1.00 0.00 ATOM 1143 N PHE 146 86.382 -9.938 -5.313 1.00 0.00 ATOM 1144 CA PHE 146 85.668 -10.647 -6.397 1.00 0.00 ATOM 1145 CB PHE 146 85.509 -9.758 -7.622 1.00 0.00 ATOM 1146 CG PHE 146 84.331 -8.841 -7.552 1.00 0.00 ATOM 1147 CD1 PHE 146 83.361 -8.988 -6.546 1.00 0.00 ATOM 1148 CD2 PHE 146 84.169 -7.845 -8.515 1.00 0.00 ATOM 1149 CE1 PHE 146 82.269 -8.146 -6.481 1.00 0.00 ATOM 1150 CE2 PHE 146 83.099 -6.993 -8.464 1.00 0.00 ATOM 1151 CZ PHE 146 82.125 -7.139 -7.454 1.00 0.00 ATOM 1152 O PHE 146 87.466 -11.647 -7.514 1.00 0.00 ATOM 1153 C PHE 146 86.510 -11.815 -6.768 1.00 0.00 ATOM 1154 N PHE 147 86.200 -12.964 -6.156 1.00 0.00 ATOM 1155 CA PHE 147 86.915 -14.218 -6.343 1.00 0.00 ATOM 1156 CB PHE 147 87.235 -14.925 -5.010 1.00 0.00 ATOM 1157 CG PHE 147 88.325 -14.271 -4.186 1.00 0.00 ATOM 1158 CD1 PHE 147 88.211 -14.214 -2.780 1.00 0.00 ATOM 1159 CD2 PHE 147 89.494 -13.741 -4.788 1.00 0.00 ATOM 1160 CE1 PHE 147 89.252 -13.627 -1.991 1.00 0.00 ATOM 1161 CE2 PHE 147 90.510 -13.144 -4.011 1.00 0.00 ATOM 1162 CZ PHE 147 90.386 -13.088 -2.612 1.00 0.00 ATOM 1163 O PHE 147 86.391 -15.535 -8.266 1.00 0.00 ATOM 1164 C PHE 147 85.993 -15.118 -7.166 1.00 0.00 ATOM 1165 N GLY 173 85.972 -19.409 -18.081 1.00 0.00 ATOM 1166 CA GLY 173 86.769 -18.956 -19.237 1.00 0.00 ATOM 1167 O GLY 173 86.961 -16.580 -18.919 1.00 0.00 ATOM 1168 C GLY 173 86.479 -17.506 -19.596 1.00 0.00 ATOM 1169 N ILE 174 85.679 -17.312 -20.651 1.00 0.00 ATOM 1170 CA ILE 174 85.171 -15.981 -21.053 1.00 0.00 ATOM 1171 CB ILE 174 84.417 -16.008 -22.473 1.00 0.00 ATOM 1172 CG1 ILE 174 82.968 -16.530 -22.366 1.00 0.00 ATOM 1173 CG2 ILE 174 85.202 -16.836 -23.538 1.00 0.00 ATOM 1174 CD1 ILE 174 81.919 -15.728 -23.187 1.00 0.00 ATOM 1175 O ILE 174 84.056 -14.094 -20.010 1.00 0.00 ATOM 1176 C ILE 174 84.273 -15.315 -19.974 1.00 0.00 ATOM 1177 N THR 175 83.776 -16.121 -19.020 1.00 0.00 ATOM 1178 CA THR 175 82.693 -15.707 -18.098 1.00 0.00 ATOM 1179 CB THR 175 81.454 -16.709 -18.082 1.00 0.00 ATOM 1180 CG2 THR 175 81.016 -17.159 -19.494 1.00 0.00 ATOM 1181 OG1 THR 175 81.728 -17.849 -17.248 1.00 0.00 ATOM 1182 O THR 175 82.164 -15.576 -15.768 1.00 0.00 ATOM 1183 C THR 175 83.034 -15.391 -16.620 1.00 0.00 ATOM 1184 N GLU 176 84.236 -14.904 -16.284 1.00 0.00 ATOM 1185 CA GLU 176 84.359 -14.290 -14.925 1.00 0.00 ATOM 1186 CB GLU 176 85.722 -14.376 -14.212 1.00 0.00 ATOM 1187 CG GLU 176 86.941 -14.703 -15.054 1.00 0.00 ATOM 1188 CD GLU 176 86.816 -16.021 -15.773 1.00 0.00 ATOM 1189 OE1 GLU 176 87.780 -16.815 -15.755 1.00 0.00 ATOM 1190 OE2 GLU 176 85.738 -16.261 -16.357 1.00 0.00 ATOM 1191 O GLU 176 84.334 -11.892 -14.790 1.00 0.00 ATOM 1192 C GLU 176 83.688 -12.940 -14.818 1.00 0.00 ATOM 1193 N ILE 177 82.363 -13.039 -14.933 1.00 0.00 ATOM 1194 CA ILE 177 81.355 -12.350 -14.145 1.00 0.00 ATOM 1195 CB ILE 177 80.165 -11.922 -15.043 1.00 0.00 ATOM 1196 CG1 ILE 177 79.483 -13.127 -15.713 1.00 0.00 ATOM 1197 CG2 ILE 177 80.634 -10.924 -16.115 1.00 0.00 ATOM 1198 CD1 ILE 177 78.405 -12.727 -16.726 1.00 0.00 ATOM 1199 O ILE 177 80.026 -13.018 -12.163 1.00 0.00 ATOM 1200 C ILE 177 80.890 -13.337 -12.998 1.00 0.00 ATOM 1201 N MET 178 81.487 -14.533 -13.001 1.00 0.00 ATOM 1202 CA MET 178 81.488 -15.480 -11.884 1.00 0.00 ATOM 1203 CB MET 178 82.248 -16.755 -12.262 1.00 0.00 ATOM 1204 CG MET 178 81.607 -17.577 -13.377 1.00 0.00 ATOM 1205 SD MET 178 80.396 -18.756 -12.771 1.00 0.00 ATOM 1206 CE MET 178 81.497 -19.953 -11.976 1.00 0.00 ATOM 1207 O MET 178 81.756 -15.026 -9.550 1.00 0.00 ATOM 1208 C MET 178 82.183 -14.830 -10.690 1.00 0.00 ATOM 1209 N ALA 179 83.253 -14.073 -10.978 1.00 0.00 ATOM 1210 CA ALA 179 83.983 -13.256 -9.979 1.00 0.00 ATOM 1211 CB ALA 179 85.057 -12.426 -10.653 1.00 0.00 ATOM 1212 O ALA 179 83.038 -12.354 -7.954 1.00 0.00 ATOM 1213 C ALA 179 83.031 -12.347 -9.191 1.00 0.00 ATOM 1214 N GLU 180 82.213 -11.581 -9.923 1.00 0.00 ATOM 1215 CA GLU 180 81.178 -10.723 -9.333 1.00 0.00 ATOM 1216 CB GLU 180 80.418 -9.936 -10.413 1.00 0.00 ATOM 1217 CG GLU 180 81.248 -8.874 -11.115 1.00 0.00 ATOM 1218 CD GLU 180 80.631 -8.449 -12.450 1.00 0.00 ATOM 1219 OE1 GLU 180 79.518 -8.935 -12.795 1.00 0.00 ATOM 1220 OE2 GLU 180 81.273 -7.634 -13.146 1.00 0.00 ATOM 1221 O GLU 180 79.861 -11.063 -7.377 1.00 0.00 ATOM 1222 C GLU 180 80.192 -11.500 -8.477 1.00 0.00 ATOM 1223 N GLY 181 79.730 -12.649 -8.976 1.00 0.00 ATOM 1224 CA GLY 181 78.848 -13.526 -8.203 1.00 0.00 ATOM 1225 O GLY 181 78.681 -14.422 -5.981 1.00 0.00 ATOM 1226 C GLY 181 79.438 -14.085 -6.898 1.00 0.00 ATOM 1227 N GLY 182 80.779 -14.180 -6.824 1.00 0.00 ATOM 1228 CA GLY 182 81.503 -14.691 -5.653 1.00 0.00 ATOM 1229 O GLY 182 81.659 -14.287 -3.271 1.00 0.00 ATOM 1230 C GLY 182 81.328 -13.834 -4.399 1.00 0.00 ATOM 1231 N GLU 183 80.829 -12.605 -4.589 1.00 0.00 ATOM 1232 CA GLU 183 80.627 -11.663 -3.500 1.00 0.00 ATOM 1233 CB GLU 183 80.239 -10.255 -4.006 1.00 0.00 ATOM 1234 CG GLU 183 78.822 -9.768 -3.629 1.00 0.00 ATOM 1235 CD GLU 183 78.445 -8.407 -4.230 1.00 0.00 ATOM 1236 OE1 GLU 183 79.321 -7.538 -4.359 1.00 0.00 ATOM 1237 OE2 GLU 183 77.254 -8.210 -4.558 1.00 0.00 ATOM 1238 O GLU 183 79.755 -12.112 -1.295 1.00 0.00 ATOM 1239 C GLU 183 79.620 -12.269 -2.517 1.00 0.00 ATOM 1240 N LEU 184 78.665 -13.029 -3.054 1.00 0.00 ATOM 1241 CA LEU 184 77.668 -13.704 -2.257 1.00 0.00 ATOM 1242 CB LEU 184 76.689 -14.456 -3.144 1.00 0.00 ATOM 1243 CG LEU 184 75.203 -14.435 -2.757 1.00 0.00 ATOM 1244 CD1 LEU 184 74.920 -15.250 -1.517 1.00 0.00 ATOM 1245 CD2 LEU 184 74.699 -12.988 -2.588 1.00 0.00 ATOM 1246 O LEU 184 77.993 -14.590 -0.038 1.00 0.00 ATOM 1247 C LEU 184 78.303 -14.659 -1.237 1.00 0.00 ATOM 1248 N GLU 185 79.206 -15.516 -1.698 1.00 0.00 ATOM 1249 CA GLU 185 79.829 -16.466 -0.813 1.00 0.00 ATOM 1250 CB GLU 185 80.574 -17.566 -1.569 1.00 0.00 ATOM 1251 CG GLU 185 79.653 -18.625 -2.294 1.00 0.00 ATOM 1252 CD GLU 185 78.593 -19.306 -1.392 1.00 0.00 ATOM 1253 OE1 GLU 185 78.985 -19.951 -0.380 1.00 0.00 ATOM 1254 OE2 GLU 185 77.370 -19.209 -1.703 1.00 0.00 ATOM 1255 O GLU 185 80.803 -16.175 1.348 1.00 0.00 ATOM 1256 C GLU 185 80.742 -15.757 0.191 1.00 0.00 ATOM 1257 N PHE 186 81.426 -14.684 -0.228 1.00 0.00 ATOM 1258 CA PHE 186 82.187 -13.898 0.745 1.00 0.00 ATOM 1259 CB PHE 186 83.034 -12.787 0.098 1.00 0.00 ATOM 1260 CG PHE 186 84.131 -12.272 0.996 1.00 0.00 ATOM 1261 CD1 PHE 186 85.415 -12.857 0.976 1.00 0.00 ATOM 1262 CD2 PHE 186 83.878 -11.225 1.875 1.00 0.00 ATOM 1263 CE1 PHE 186 86.415 -12.382 1.795 1.00 0.00 ATOM 1264 CE2 PHE 186 84.892 -10.725 2.723 1.00 0.00 ATOM 1265 CZ PHE 186 86.138 -11.284 2.679 1.00 0.00 ATOM 1266 O PHE 186 81.613 -13.553 3.053 1.00 0.00 ATOM 1267 C PHE 186 81.297 -13.361 1.890 1.00 0.00 ATOM 1268 N VAL 187 80.191 -12.725 1.561 1.00 0.00 ATOM 1269 CA VAL 187 79.336 -12.122 2.591 1.00 0.00 ATOM 1270 CB VAL 187 78.215 -11.270 1.979 1.00 0.00 ATOM 1271 CG1 VAL 187 77.329 -10.644 3.064 1.00 0.00 ATOM 1272 CG2 VAL 187 78.846 -10.151 1.130 1.00 0.00 ATOM 1273 O VAL 187 78.892 -13.093 4.734 1.00 0.00 ATOM 1274 C VAL 187 78.811 -13.214 3.513 1.00 0.00 ATOM 1275 N LYS 188 78.302 -14.300 2.917 1.00 0.00 ATOM 1276 CA LYS 188 77.907 -15.468 3.709 1.00 0.00 ATOM 1277 CB LYS 188 77.548 -16.659 2.818 1.00 0.00 ATOM 1278 CG LYS 188 76.230 -16.590 2.168 1.00 0.00 ATOM 1279 CD LYS 188 76.182 -17.783 1.202 1.00 0.00 ATOM 1280 CE LYS 188 74.807 -18.404 1.019 1.00 0.00 ATOM 1281 NZ LYS 188 73.735 -17.429 0.687 1.00 0.00 ATOM 1282 O LYS 188 78.519 -16.357 5.791 1.00 0.00 ATOM 1283 C LYS 188 78.933 -15.933 4.745 1.00 0.00 ATOM 1284 N ARG 189 80.226 -15.919 4.413 1.00 0.00 ATOM 1285 CA ARG 189 81.320 -16.160 5.375 1.00 0.00 ATOM 1286 CB ARG 189 82.707 -16.067 4.707 1.00 0.00 ATOM 1287 CG ARG 189 83.197 -17.268 3.873 1.00 0.00 ATOM 1288 CD ARG 189 84.474 -16.931 3.049 1.00 0.00 ATOM 1289 NE ARG 189 85.735 -16.921 3.802 1.00 0.00 ATOM 1290 CZ ARG 189 86.906 -16.467 3.335 1.00 0.00 ATOM 1291 NH1 ARG 189 87.014 -15.959 2.095 1.00 0.00 ATOM 1292 NH2 ARG 189 87.989 -16.502 4.103 1.00 0.00 ATOM 1293 O ARG 189 81.604 -15.553 7.731 1.00 0.00 ATOM 1294 C ARG 189 81.311 -15.166 6.567 1.00 0.00 ATOM 1295 N ILE 190 81.038 -13.896 6.269 1.00 0.00 ATOM 1296 CA ILE 190 80.946 -12.846 7.307 1.00 0.00 ATOM 1297 CB ILE 190 80.782 -11.394 6.702 1.00 0.00 ATOM 1298 CG1 ILE 190 82.028 -10.977 5.891 1.00 0.00 ATOM 1299 CG2 ILE 190 80.522 -10.353 7.816 1.00 0.00 ATOM 1300 CD1 ILE 190 81.872 -9.626 5.157 1.00 0.00 ATOM 1301 O ILE 190 79.818 -13.042 9.424 1.00 0.00 ATOM 1302 C ILE 190 79.748 -13.150 8.184 1.00 0.00 ATOM 1303 N ILE 191 78.635 -13.492 7.539 1.00 0.00 ATOM 1304 CA ILE 191 77.441 -13.918 8.269 1.00 0.00 ATOM 1305 CB ILE 191 76.274 -14.247 7.312 1.00 0.00 ATOM 1306 CG1 ILE 191 75.800 -12.972 6.595 1.00 0.00 ATOM 1307 CG2 ILE 191 75.143 -14.992 8.053 1.00 0.00 ATOM 1308 CD1 ILE 191 74.710 -13.210 5.544 1.00 0.00 ATOM 1309 O ILE 191 77.384 -15.167 10.329 1.00 0.00 ATOM 1310 C ILE 191 77.785 -15.132 9.174 1.00 0.00 ATOM 1311 N HIS 192 78.522 -16.099 8.644 1.00 0.00 ATOM 1312 CA HIS 192 78.935 -17.304 9.408 1.00 0.00 ATOM 1313 CB HIS 192 79.762 -18.246 8.530 1.00 0.00 ATOM 1314 CG HIS 192 80.101 -19.555 9.176 1.00 0.00 ATOM 1315 CD2 HIS 192 79.360 -20.671 9.370 1.00 0.00 ATOM 1316 ND1 HIS 192 81.355 -19.836 9.683 1.00 0.00 ATOM 1317 CE1 HIS 192 81.366 -21.063 10.172 1.00 0.00 ATOM 1318 NE2 HIS 192 80.168 -21.593 9.987 1.00 0.00 ATOM 1319 O HIS 192 79.477 -17.429 11.752 1.00 0.00 ATOM 1320 C HIS 192 79.735 -16.913 10.652 1.00 0.00 ATOM 1321 N ASP 193 80.698 -16.001 10.500 1.00 0.00 ATOM 1322 CA ASP 193 81.502 -15.587 11.650 1.00 0.00 ATOM 1323 CB ASP 193 82.690 -14.762 11.228 1.00 0.00 ATOM 1324 CG ASP 193 83.804 -15.611 10.714 1.00 0.00 ATOM 1325 OD1 ASP 193 83.547 -16.792 10.370 1.00 0.00 ATOM 1326 OD2 ASP 193 84.922 -15.117 10.653 1.00 0.00 ATOM 1327 O ASP 193 80.850 -15.009 13.886 1.00 0.00 ATOM 1328 C ASP 193 80.671 -14.826 12.664 1.00 0.00 ATOM 1329 N SER 194 79.751 -14.004 12.160 1.00 0.00 ATOM 1330 CA SER 194 78.921 -13.186 12.998 1.00 0.00 ATOM 1331 CB SER 194 78.109 -12.181 12.174 1.00 0.00 ATOM 1332 OG SER 194 76.845 -12.655 11.752 1.00 0.00 ATOM 1333 O SER 194 77.781 -13.689 15.025 1.00 0.00 ATOM 1334 C SER 194 78.025 -14.049 13.881 1.00 0.00 ATOM 1335 N LEU 195 77.570 -15.194 13.350 1.00 0.00 ATOM 1336 CA LEU 195 76.696 -16.117 14.087 1.00 0.00 ATOM 1337 CB LEU 195 76.090 -17.205 13.178 1.00 0.00 ATOM 1338 CG LEU 195 74.997 -16.720 12.228 1.00 0.00 ATOM 1339 CD1 LEU 195 74.766 -17.742 11.099 1.00 0.00 ATOM 1340 CD2 LEU 195 73.686 -16.334 12.947 1.00 0.00 ATOM 1341 O LEU 195 76.666 -17.120 16.233 1.00 0.00 ATOM 1342 C LEU 195 77.359 -16.741 15.291 1.00 0.00 ATOM 1343 N GLN 196 78.689 -16.852 15.274 1.00 0.00 ATOM 1344 CA GLN 196 79.408 -17.263 16.481 1.00 0.00 ATOM 1345 CB GLN 196 80.560 -18.194 16.213 1.00 0.00 ATOM 1346 CG GLN 196 81.342 -17.887 15.009 1.00 0.00 ATOM 1347 CD GLN 196 81.735 -19.159 14.275 1.00 0.00 ATOM 1348 OE1 GLN 196 80.900 -20.061 14.076 1.00 0.00 ATOM 1349 NE2 GLN 196 83.012 -19.245 13.872 1.00 0.00 ATOM 1350 O GLN 196 79.872 -16.246 18.581 1.00 0.00 ATOM 1351 C GLN 196 79.883 -16.124 17.346 1.00 0.00 ATOM 1352 N LEU 197 80.281 -15.017 16.727 1.00 0.00 ATOM 1353 CA LEU 197 80.732 -13.865 17.507 1.00 0.00 ATOM 1354 CB LEU 197 81.548 -12.901 16.647 1.00 0.00 ATOM 1355 CG LEU 197 82.904 -13.389 16.208 1.00 0.00 ATOM 1356 CD1 LEU 197 83.375 -12.473 15.092 1.00 0.00 ATOM 1357 CD2 LEU 197 83.897 -13.409 17.344 1.00 0.00 ATOM 1358 O LEU 197 79.822 -12.516 19.242 1.00 0.00 ATOM 1359 C LEU 197 79.601 -13.109 18.192 1.00 0.00 ATOM 1360 N LYS 199 78.422 -13.107 17.575 1.00 0.00 ATOM 1361 CA LYS 199 77.234 -12.425 18.096 1.00 0.00 ATOM 1362 O LYS 199 77.935 -10.150 17.764 1.00 0.00 ATOM 1363 C LYS 199 77.558 -11.011 18.572 1.00 0.00 ATOM 1364 N ARG 200 79.801 -9.645 20.436 1.00 0.00 ATOM 1365 CA ARG 200 81.171 -9.166 20.401 1.00 0.00 ATOM 1366 CB ARG 200 82.135 -10.357 20.123 1.00 0.00 ATOM 1367 CG ARG 200 83.640 -10.051 20.037 1.00 0.00 ATOM 1368 CD ARG 200 84.280 -9.529 21.415 1.00 0.00 ATOM 1369 NE ARG 200 83.926 -10.450 22.500 1.00 0.00 ATOM 1370 CZ ARG 200 83.942 -10.137 23.813 1.00 0.00 ATOM 1371 NH1 ARG 200 84.214 -8.909 24.236 1.00 0.00 ATOM 1372 NH2 ARG 200 83.594 -11.044 24.694 1.00 0.00 ATOM 1373 O ARG 200 82.336 -7.206 19.602 1.00 0.00 ATOM 1374 C ARG 200 81.395 -7.953 19.432 1.00 0.00 ATOM 1375 N LEU 201 80.524 -7.741 18.452 1.00 0.00 ATOM 1376 CA LEU 201 80.562 -6.487 17.697 1.00 0.00 ATOM 1377 CB LEU 201 81.054 -6.639 16.242 1.00 0.00 ATOM 1378 CG LEU 201 82.136 -7.502 15.651 1.00 0.00 ATOM 1379 CD1 LEU 201 82.801 -6.594 14.591 1.00 0.00 ATOM 1380 CD2 LEU 201 83.137 -8.047 16.598 1.00 0.00 ATOM 1381 O LEU 201 78.288 -6.867 17.562 1.00 0.00 ATOM 1382 C LEU 201 79.166 -6.042 17.634 1.00 0.00 ATOM 1383 N ARG 202 78.948 -4.732 17.636 1.00 0.00 ATOM 1384 CA ARG 202 77.591 -4.185 17.639 1.00 0.00 ATOM 1385 CB ARG 202 77.566 -2.786 18.277 1.00 0.00 ATOM 1386 CG ARG 202 77.748 -2.818 19.810 1.00 0.00 ATOM 1387 CD ARG 202 77.966 -1.432 20.434 1.00 0.00 ATOM 1388 NE ARG 202 78.620 -1.538 21.746 1.00 0.00 ATOM 1389 CZ ARG 202 78.008 -1.849 22.886 1.00 0.00 ATOM 1390 NH1 ARG 202 76.699 -2.049 22.918 1.00 0.00 ATOM 1391 NH2 ARG 202 78.721 -1.942 24.001 1.00 0.00 ATOM 1392 O ARG 202 75.658 -4.260 16.196 1.00 0.00 ATOM 1393 C ARG 202 76.892 -4.170 16.266 1.00 0.00 ATOM 1394 N TRP 203 77.677 -4.022 15.194 1.00 0.00 ATOM 1395 CA TRP 203 77.131 -3.944 13.836 1.00 0.00 ATOM 1396 CB TRP 203 76.931 -2.497 13.419 1.00 0.00 ATOM 1397 CG TRP 203 75.650 -1.883 13.911 1.00 0.00 ATOM 1398 CD1 TRP 203 75.519 -0.923 14.907 1.00 0.00 ATOM 1399 CD2 TRP 203 74.320 -2.153 13.443 1.00 0.00 ATOM 1400 CE2 TRP 203 73.440 -1.337 14.199 1.00 0.00 ATOM 1401 CE3 TRP 203 73.779 -2.987 12.432 1.00 0.00 ATOM 1402 NE1 TRP 203 74.201 -0.581 15.054 1.00 0.00 ATOM 1403 CZ2 TRP 203 72.058 -1.322 13.972 1.00 0.00 ATOM 1404 CZ3 TRP 203 72.414 -3.019 12.254 1.00 0.00 ATOM 1405 CH2 TRP 203 71.558 -2.172 13.007 1.00 0.00 ATOM 1406 O TRP 203 79.304 -4.376 12.965 1.00 0.00 ATOM 1407 C TRP 203 78.101 -4.641 12.930 1.00 0.00 ATOM 1408 N TYR 204 77.605 -5.634 12.207 1.00 0.00 ATOM 1409 CA TYR 204 78.425 -6.231 11.141 1.00 0.00 ATOM 1410 CB TYR 204 78.152 -7.738 11.056 1.00 0.00 ATOM 1411 CG TYR 204 78.503 -8.487 12.328 1.00 0.00 ATOM 1412 CD1 TYR 204 79.741 -9.069 12.475 1.00 0.00 ATOM 1413 CD2 TYR 204 77.578 -8.570 13.394 1.00 0.00 ATOM 1414 CE1 TYR 204 80.063 -9.748 13.625 1.00 0.00 ATOM 1415 CE2 TYR 204 77.885 -9.250 14.547 1.00 0.00 ATOM 1416 CZ TYR 204 79.112 -9.814 14.671 1.00 0.00 ATOM 1417 OH TYR 204 79.446 -10.485 15.822 1.00 0.00 ATOM 1418 O TYR 204 76.768 -5.270 9.789 1.00 0.00 ATOM 1419 C TYR 204 77.924 -5.562 9.861 1.00 0.00 ATOM 1420 N SER 205 78.791 -5.326 8.877 1.00 0.00 ATOM 1421 CA SER 205 78.356 -4.738 7.580 1.00 0.00 ATOM 1422 CB SER 205 78.150 -3.204 7.597 1.00 0.00 ATOM 1423 OG SER 205 79.390 -2.508 7.679 1.00 0.00 ATOM 1424 O SER 205 80.396 -5.552 6.619 1.00 0.00 ATOM 1425 C SER 205 79.268 -5.138 6.428 1.00 0.00 ATOM 1426 N CYS 206 78.734 -4.952 5.228 1.00 0.00 ATOM 1427 CA CYS 206 79.487 -5.217 4.015 1.00 0.00 ATOM 1428 CB CYS 206 79.460 -6.742 3.715 1.00 0.00 ATOM 1429 SG CYS 206 80.615 -7.264 2.445 1.00 0.00 ATOM 1430 O CYS 206 77.640 -4.248 2.831 1.00 0.00 ATOM 1431 C CYS 206 78.842 -4.426 2.865 1.00 0.00 ATOM 1432 N MET 207 79.670 -3.914 1.958 1.00 0.00 ATOM 1433 CA MET 207 79.164 -3.246 0.776 1.00 0.00 ATOM 1434 CB MET 207 80.139 -2.167 0.278 1.00 0.00 ATOM 1435 CG MET 207 79.655 -1.551 -1.008 1.00 0.00 ATOM 1436 SD MET 207 80.291 0.081 -1.293 1.00 0.00 ATOM 1437 CE MET 207 81.976 -0.280 -1.705 1.00 0.00 ATOM 1438 O MET 207 79.714 -5.235 -0.507 1.00 0.00 ATOM 1439 C MET 207 78.911 -4.303 -0.317 1.00 0.00 ATOM 1440 N LEU 208 77.798 -4.161 -1.023 1.00 0.00 ATOM 1441 CA LEU 208 77.476 -5.082 -2.110 1.00 0.00 ATOM 1442 CB LEU 208 76.089 -5.671 -1.891 1.00 0.00 ATOM 1443 CG LEU 208 75.822 -6.507 -0.647 1.00 0.00 ATOM 1444 CD1 LEU 208 74.332 -6.810 -0.660 1.00 0.00 ATOM 1445 CD2 LEU 208 76.636 -7.785 -0.585 1.00 0.00 ATOM 1446 O LEU 208 77.075 -3.277 -3.617 1.00 0.00 ATOM 1447 C LEU 208 77.524 -4.391 -3.479 1.00 0.00 ATOM 1448 N GLY 209 78.012 -5.129 -4.470 1.00 0.00 ATOM 1449 CA GLY 209 78.282 -4.644 -5.813 1.00 0.00 ATOM 1450 O GLY 209 77.073 -3.953 -7.727 1.00 0.00 ATOM 1451 C GLY 209 77.107 -4.713 -6.762 1.00 0.00 ATOM 1452 N LYS 210 76.143 -5.605 -6.504 1.00 0.00 ATOM 1453 CA LYS 210 74.844 -5.630 -7.270 1.00 0.00 ATOM 1454 CB LYS 210 74.833 -6.618 -8.450 1.00 0.00 ATOM 1455 CG LYS 210 75.336 -8.018 -8.161 1.00 0.00 ATOM 1456 CD LYS 210 76.858 -8.124 -8.271 1.00 0.00 ATOM 1457 CE LYS 210 77.280 -9.565 -8.489 1.00 0.00 ATOM 1458 NZ LYS 210 77.276 -10.413 -7.247 1.00 0.00 ATOM 1459 O LYS 210 73.662 -6.684 -5.476 1.00 0.00 ATOM 1460 C LYS 210 73.621 -5.863 -6.404 1.00 0.00 ATOM 1461 N CYS 212 71.170 -7.423 -6.677 1.00 0.00 ATOM 1462 CA CYS 212 70.650 -8.782 -6.713 1.00 0.00 ATOM 1463 CB CYS 212 70.610 -9.321 -8.154 1.00 0.00 ATOM 1464 SG CYS 212 72.179 -10.063 -8.771 1.00 0.00 ATOM 1465 O CYS 212 71.100 -10.900 -5.660 1.00 0.00 ATOM 1466 C CYS 212 71.424 -9.719 -5.777 1.00 0.00 ATOM 1467 N SER 213 72.455 -9.198 -5.119 1.00 0.00 ATOM 1468 CA SER 213 73.072 -9.902 -4.011 1.00 0.00 ATOM 1469 CB SER 213 74.463 -9.343 -3.743 1.00 0.00 ATOM 1470 OG SER 213 75.477 -10.132 -4.341 1.00 0.00 ATOM 1471 O SER 213 72.330 -10.638 -1.839 1.00 0.00 ATOM 1472 C SER 213 72.224 -9.793 -2.737 1.00 0.00 ATOM 1473 N LEU 214 71.386 -8.764 -2.672 1.00 0.00 ATOM 1474 CA LEU 214 70.680 -8.392 -1.452 1.00 0.00 ATOM 1475 CB LEU 214 70.071 -6.980 -1.558 1.00 0.00 ATOM 1476 CG LEU 214 70.657 -5.758 -0.825 1.00 0.00 ATOM 1477 CD1 LEU 214 69.850 -4.521 -1.165 1.00 0.00 ATOM 1478 CD2 LEU 214 70.746 -5.914 0.718 1.00 0.00 ATOM 1479 O LEU 214 69.590 -9.705 0.226 1.00 0.00 ATOM 1480 C LEU 214 69.611 -9.366 -0.962 1.00 0.00 ATOM 1481 N ALA 215 68.718 -9.786 -1.852 1.00 0.00 ATOM 1482 CA ALA 215 67.599 -10.653 -1.470 1.00 0.00 ATOM 1483 CB ALA 215 66.604 -10.866 -2.660 1.00 0.00 ATOM 1484 O ALA 215 67.453 -12.365 0.180 1.00 0.00 ATOM 1485 C ALA 215 68.013 -11.991 -0.832 1.00 0.00 ATOM 1486 N PRO 216 68.972 -12.718 -1.428 1.00 0.00 ATOM 1487 CA PRO 216 69.420 -13.949 -0.764 1.00 0.00 ATOM 1488 CB PRO 216 70.392 -14.577 -1.773 1.00 0.00 ATOM 1489 CG PRO 216 70.774 -13.474 -2.698 1.00 0.00 ATOM 1490 CD PRO 216 69.632 -12.515 -2.735 1.00 0.00 ATOM 1491 O PRO 216 70.029 -14.593 1.465 1.00 0.00 ATOM 1492 C PRO 216 70.126 -13.740 0.591 1.00 0.00 ATOM 1493 N LEU 217 70.856 -12.631 0.743 1.00 0.00 ATOM 1494 CA LEU 217 71.571 -12.363 1.980 1.00 0.00 ATOM 1495 CB LEU 217 72.676 -11.303 1.765 1.00 0.00 ATOM 1496 CG LEU 217 73.892 -11.726 0.915 1.00 0.00 ATOM 1497 CD1 LEU 217 74.715 -10.502 0.458 1.00 0.00 ATOM 1498 CD2 LEU 217 74.797 -12.794 1.631 1.00 0.00 ATOM 1499 O LEU 217 70.630 -12.558 4.174 1.00 0.00 ATOM 1500 C LEU 217 70.578 -12.001 3.095 1.00 0.00 ATOM 1501 N LYS 218 69.658 -11.100 2.799 1.00 0.00 ATOM 1502 CA LYS 218 68.507 -10.823 3.658 1.00 0.00 ATOM 1503 CB LYS 218 67.521 -9.920 2.930 1.00 0.00 ATOM 1504 CG LYS 218 67.932 -8.459 2.773 1.00 0.00 ATOM 1505 CD LYS 218 66.657 -7.626 2.600 1.00 0.00 ATOM 1506 CE LYS 218 66.812 -6.576 1.546 1.00 0.00 ATOM 1507 NZ LYS 218 65.562 -6.443 0.716 1.00 0.00 ATOM 1508 O LYS 218 67.452 -12.247 5.273 1.00 0.00 ATOM 1509 C LYS 218 67.748 -12.090 4.101 1.00 0.00 ATOM 1510 N GLU 219 67.418 -12.981 3.159 1.00 0.00 ATOM 1511 CA GLU 219 66.775 -14.237 3.537 1.00 0.00 ATOM 1512 CB GLU 219 66.293 -15.051 2.324 1.00 0.00 ATOM 1513 CG GLU 219 65.416 -16.272 2.696 1.00 0.00 ATOM 1514 CD GLU 219 63.929 -16.093 2.308 1.00 0.00 ATOM 1515 OE1 GLU 219 63.181 -15.419 3.066 1.00 0.00 ATOM 1516 OE2 GLU 219 63.504 -16.637 1.246 1.00 0.00 ATOM 1517 O GLU 219 67.196 -15.788 5.288 1.00 0.00 ATOM 1518 C GLU 219 67.691 -15.102 4.400 1.00 0.00 ATOM 1519 N GLU 220 69.002 -15.099 4.135 1.00 0.00 ATOM 1520 CA GLU 220 69.913 -15.867 4.982 1.00 0.00 ATOM 1521 CB GLU 220 71.318 -15.963 4.402 1.00 0.00 ATOM 1522 CG GLU 220 72.333 -16.378 5.454 1.00 0.00 ATOM 1523 CD GLU 220 73.238 -17.527 5.052 1.00 0.00 ATOM 1524 OE1 GLU 220 72.789 -18.389 4.252 1.00 0.00 ATOM 1525 OE2 GLU 220 74.394 -17.572 5.572 1.00 0.00 ATOM 1526 O GLU 220 69.914 -16.202 7.362 1.00 0.00 ATOM 1527 C GLU 220 69.939 -15.388 6.453 1.00 0.00 ATOM 1528 N LEU 221 69.994 -14.071 6.668 1.00 0.00 ATOM 1529 CA LEU 221 69.843 -13.479 8.018 1.00 0.00 ATOM 1530 CB LEU 221 70.106 -11.965 7.989 1.00 0.00 ATOM 1531 CG LEU 221 71.459 -11.544 7.402 1.00 0.00 ATOM 1532 CD1 LEU 221 71.431 -10.099 6.947 1.00 0.00 ATOM 1533 CD2 LEU 221 72.629 -11.814 8.371 1.00 0.00 ATOM 1534 O LEU 221 68.371 -14.039 9.825 1.00 0.00 ATOM 1535 C LEU 221 68.470 -13.765 8.647 1.00 0.00 ATOM 1536 N ARG 222 67.417 -13.691 7.850 1.00 0.00 ATOM 1537 CA ARG 222 66.077 -13.996 8.356 1.00 0.00 ATOM 1538 CB ARG 222 65.008 -13.783 7.277 1.00 0.00 ATOM 1539 CG ARG 222 63.581 -14.075 7.747 1.00 0.00 ATOM 1540 CD ARG 222 62.578 -14.142 6.590 1.00 0.00 ATOM 1541 NE ARG 222 62.832 -15.282 5.701 1.00 0.00 ATOM 1542 CZ ARG 222 62.185 -16.445 5.750 1.00 0.00 ATOM 1543 NH1 ARG 222 61.218 -16.643 6.638 1.00 0.00 ATOM 1544 NH2 ARG 222 62.506 -17.409 4.900 1.00 0.00 ATOM 1545 O ARG 222 65.405 -15.629 9.995 1.00 0.00 ATOM 1546 C ARG 222 65.999 -15.427 8.927 1.00 0.00 ATOM 1547 N ILE 223 66.614 -16.396 8.235 1.00 0.00 ATOM 1548 CA ILE 223 66.446 -17.804 8.607 1.00 0.00 ATOM 1549 CB ILE 223 66.435 -18.822 7.402 1.00 0.00 ATOM 1550 CG1 ILE 223 67.831 -19.087 6.840 1.00 0.00 ATOM 1551 CG2 ILE 223 65.417 -18.426 6.316 1.00 0.00 ATOM 1552 CD1 ILE 223 67.800 -20.080 5.682 1.00 0.00 ATOM 1553 O ILE 223 67.140 -19.255 10.361 1.00 0.00 ATOM 1554 C ILE 223 67.398 -18.249 9.704 1.00 0.00 ATOM 1555 N GLN 224 68.473 -17.478 9.913 1.00 0.00 ATOM 1556 CA GLN 224 69.376 -17.671 11.064 1.00 0.00 ATOM 1557 CB GLN 224 70.789 -17.188 10.729 1.00 0.00 ATOM 1558 CG GLN 224 71.528 -17.997 9.673 1.00 0.00 ATOM 1559 CD GLN 224 71.773 -19.458 10.069 1.00 0.00 ATOM 1560 OE1 GLN 224 72.309 -20.229 9.276 1.00 0.00 ATOM 1561 NE2 GLN 224 71.391 -19.838 11.290 1.00 0.00 ATOM 1562 O GLN 224 69.454 -17.082 13.400 1.00 0.00 ATOM 1563 C GLN 224 68.864 -16.954 12.334 1.00 0.00 ATOM 1564 N GLY 225 67.784 -16.188 12.195 1.00 0.00 ATOM 1565 CA GLY 225 67.169 -15.489 13.312 1.00 0.00 ATOM 1566 O GLY 225 67.778 -13.852 14.931 1.00 0.00 ATOM 1567 C GLY 225 67.931 -14.268 13.783 1.00 0.00 ATOM 1568 N VAL 226 68.764 -13.692 12.914 1.00 0.00 ATOM 1569 CA VAL 226 69.419 -12.411 13.201 1.00 0.00 ATOM 1570 CB VAL 226 70.395 -12.006 12.055 1.00 0.00 ATOM 1571 CG1 VAL 226 71.008 -10.631 12.305 1.00 0.00 ATOM 1572 CG2 VAL 226 71.481 -13.094 11.891 1.00 0.00 ATOM 1573 O VAL 226 67.503 -11.139 12.548 1.00 0.00 ATOM 1574 C VAL 226 68.342 -11.360 13.426 1.00 0.00 ATOM 1575 N PRO 227 68.316 -10.768 14.638 1.00 0.00 ATOM 1576 CA PRO 227 67.254 -9.889 15.115 1.00 0.00 ATOM 1577 CB PRO 227 67.561 -9.764 16.619 1.00 0.00 ATOM 1578 CG PRO 227 68.955 -10.062 16.753 1.00 0.00 ATOM 1579 CD PRO 227 69.337 -10.997 15.680 1.00 0.00 ATOM 1580 O PRO 227 66.043 -7.973 14.410 1.00 0.00 ATOM 1581 C PRO 227 67.146 -8.514 14.485 1.00 0.00 ATOM 1582 N LYS 228 68.275 -7.949 14.056 1.00 0.00 ATOM 1583 CA LYS 228 68.321 -6.589 13.493 1.00 0.00 ATOM 1584 CB LYS 228 68.989 -5.655 14.502 1.00 0.00 ATOM 1585 CG LYS 228 68.854 -4.175 14.225 1.00 0.00 ATOM 1586 CD LYS 228 68.442 -3.427 15.471 1.00 0.00 ATOM 1587 CE LYS 228 69.468 -3.540 16.592 1.00 0.00 ATOM 1588 NZ LYS 228 69.518 -2.277 17.379 1.00 0.00 ATOM 1589 O LYS 228 70.206 -7.113 12.086 1.00 0.00 ATOM 1590 C LYS 228 69.088 -6.598 12.152 1.00 0.00 ATOM 1591 N VAL 229 68.454 -6.067 11.100 1.00 0.00 ATOM 1592 CA VAL 229 69.011 -6.061 9.728 1.00 0.00 ATOM 1593 CB VAL 229 68.474 -7.238 8.860 1.00 0.00 ATOM 1594 CG1 VAL 229 68.881 -7.095 7.367 1.00 0.00 ATOM 1595 CG2 VAL 229 68.909 -8.607 9.433 1.00 0.00 ATOM 1596 O VAL 229 67.485 -4.309 9.140 1.00 0.00 ATOM 1597 C VAL 229 68.641 -4.741 9.076 1.00 0.00 ATOM 1598 N THR 230 69.630 -4.063 8.497 1.00 0.00 ATOM 1599 CA THR 230 69.320 -2.860 7.732 1.00 0.00 ATOM 1600 CB THR 230 69.407 -1.604 8.582 1.00 0.00 ATOM 1601 CG2 THR 230 70.789 -1.268 8.954 1.00 0.00 ATOM 1602 OG1 THR 230 68.807 -0.517 7.876 1.00 0.00 ATOM 1603 O THR 230 71.111 -3.551 6.276 1.00 0.00 ATOM 1604 C THR 230 70.162 -2.780 6.447 1.00 0.00 ATOM 1605 N TYR 231 69.748 -1.883 5.556 1.00 0.00 ATOM 1606 CA TYR 231 70.433 -1.688 4.277 1.00 0.00 ATOM 1607 CB TYR 231 70.162 -2.861 3.314 1.00 0.00 ATOM 1608 CG TYR 231 68.763 -2.910 2.819 1.00 0.00 ATOM 1609 CD1 TYR 231 68.367 -2.071 1.788 1.00 0.00 ATOM 1610 CD2 TYR 231 67.816 -3.757 3.390 1.00 0.00 ATOM 1611 CE1 TYR 231 67.088 -2.062 1.316 1.00 0.00 ATOM 1612 CE2 TYR 231 66.499 -3.750 2.926 1.00 0.00 ATOM 1613 CZ TYR 231 66.156 -2.905 1.871 1.00 0.00 ATOM 1614 OH TYR 231 64.873 -2.845 1.351 1.00 0.00 ATOM 1615 O TYR 231 69.372 0.480 4.134 1.00 0.00 ATOM 1616 C TYR 231 70.225 -0.274 3.688 1.00 0.00 ATOM 1617 N THR 232 71.068 0.105 2.723 1.00 0.00 ATOM 1618 CA THR 232 71.015 1.464 2.154 1.00 0.00 ATOM 1619 CB THR 232 71.725 2.512 3.053 1.00 0.00 ATOM 1620 CG2 THR 232 73.191 2.289 3.049 1.00 0.00 ATOM 1621 OG1 THR 232 71.458 3.841 2.569 1.00 0.00 ATOM 1622 O THR 232 72.351 0.510 0.437 1.00 0.00 ATOM 1623 C THR 232 71.694 1.478 0.797 1.00 0.00 ATOM 1624 N GLU 233 71.562 2.586 0.075 1.00 0.00 ATOM 1625 CA GLU 233 72.205 2.742 -1.239 1.00 0.00 ATOM 1626 CB GLU 233 71.143 3.112 -2.263 1.00 0.00 ATOM 1627 CG GLU 233 71.635 3.190 -3.710 1.00 0.00 ATOM 1628 CD GLU 233 70.691 3.975 -4.612 1.00 0.00 ATOM 1629 OE1 GLU 233 69.518 4.221 -4.216 1.00 0.00 ATOM 1630 OE2 GLU 233 71.155 4.387 -5.697 1.00 0.00 ATOM 1631 O GLU 233 73.190 4.877 -0.588 1.00 0.00 ATOM 1632 C GLU 233 73.324 3.817 -1.223 1.00 0.00 ATOM 1633 N PHE 234 74.428 3.530 -1.907 1.00 0.00 ATOM 1634 CA PHE 234 75.448 4.511 -2.169 1.00 0.00 ATOM 1635 CB PHE 234 76.836 4.037 -1.730 1.00 0.00 ATOM 1636 CG PHE 234 76.927 3.494 -0.297 1.00 0.00 ATOM 1637 CD1 PHE 234 76.215 4.088 0.762 1.00 0.00 ATOM 1638 CD2 PHE 234 77.795 2.426 -0.019 1.00 0.00 ATOM 1639 CE1 PHE 234 76.334 3.589 2.098 1.00 0.00 ATOM 1640 CE2 PHE 234 77.906 1.894 1.294 1.00 0.00 ATOM 1641 CZ PHE 234 77.182 2.479 2.347 1.00 0.00 ATOM 1642 O PHE 234 75.738 3.832 -4.486 1.00 0.00 ATOM 1643 C PHE 234 75.480 4.748 -3.705 1.00 0.00 ATOM 1644 N CYS 235 75.235 5.979 -4.111 1.00 0.00 ATOM 1645 CA CYS 235 75.218 6.345 -5.520 1.00 0.00 ATOM 1646 CB CYS 235 73.877 6.979 -5.860 1.00 0.00 ATOM 1647 SG CYS 235 73.760 7.404 -7.583 1.00 0.00 ATOM 1648 O CYS 235 76.402 8.384 -5.114 1.00 0.00 ATOM 1649 C CYS 235 76.312 7.363 -5.798 1.00 0.00 ATOM 1650 N GLN 236 77.185 7.043 -6.764 1.00 0.00 ATOM 1651 CA GLN 236 78.158 8.009 -7.254 1.00 0.00 ATOM 1652 CB GLN 236 79.582 7.605 -6.837 1.00 0.00 ATOM 1653 CG GLN 236 79.821 7.763 -5.304 1.00 0.00 ATOM 1654 CD GLN 236 79.507 9.180 -4.806 1.00 0.00 ATOM 1655 OE1 GLN 236 79.667 10.157 -5.550 1.00 0.00 ATOM 1656 NE2 GLN 236 79.047 9.296 -3.555 1.00 0.00 ATOM 1657 O GLN 236 78.603 7.322 -9.485 1.00 0.00 ATOM 1658 C GLN 236 78.003 8.096 -8.768 1.00 0.00 ATOM 1659 N GLY 237 77.158 9.011 -9.229 1.00 0.00 ATOM 1660 CA GLY 237 76.860 9.114 -10.658 1.00 0.00 ATOM 1661 O GLY 237 75.387 7.258 -11.070 1.00 0.00 ATOM 1662 C GLY 237 76.466 7.791 -11.319 1.00 0.00 ATOM 1663 N ARG 238 77.355 7.255 -12.141 1.00 0.00 ATOM 1664 CA ARG 238 77.043 6.086 -12.947 1.00 0.00 ATOM 1665 CB ARG 238 78.095 5.958 -14.071 1.00 0.00 ATOM 1666 CG ARG 238 77.986 4.737 -14.966 1.00 0.00 ATOM 1667 CD ARG 238 78.995 4.781 -16.120 1.00 0.00 ATOM 1668 NE ARG 238 80.378 4.413 -15.773 1.00 0.00 ATOM 1669 CZ ARG 238 81.279 4.018 -16.679 1.00 0.00 ATOM 1670 NH1 ARG 238 80.947 3.933 -17.977 1.00 0.00 ATOM 1671 NH2 ARG 238 82.512 3.713 -16.304 1.00 0.00 ATOM 1672 O ARG 238 76.393 3.795 -12.414 1.00 0.00 ATOM 1673 C ARG 238 77.010 4.827 -12.059 1.00 0.00 ATOM 1674 N THR 239 77.683 4.901 -10.906 1.00 0.00 ATOM 1675 CA THR 239 77.913 3.680 -10.157 1.00 0.00 ATOM 1676 CB THR 239 79.424 3.313 -10.023 1.00 0.00 ATOM 1677 CG2 THR 239 80.260 4.075 -11.018 1.00 0.00 ATOM 1678 OG1 THR 239 79.896 3.596 -8.708 1.00 0.00 ATOM 1679 O THR 239 76.884 4.553 -8.128 1.00 0.00 ATOM 1680 C THR 239 77.092 3.573 -8.857 1.00 0.00 ATOM 1681 N MET 240 76.573 2.374 -8.644 1.00 0.00 ATOM 1682 CA MET 240 75.634 2.123 -7.598 1.00 0.00 ATOM 1683 CB MET 240 74.229 1.961 -8.168 1.00 0.00 ATOM 1684 CG MET 240 73.669 3.328 -8.604 1.00 0.00 ATOM 1685 SD MET 240 71.921 3.239 -8.911 1.00 0.00 ATOM 1686 CE MET 240 71.878 2.770 -10.666 1.00 0.00 ATOM 1687 O MET 240 76.418 -0.128 -7.351 1.00 0.00 ATOM 1688 C MET 240 76.066 0.932 -6.796 1.00 0.00 ATOM 1689 N ARG 241 76.094 1.150 -5.480 1.00 0.00 ATOM 1690 CA ARG 241 76.440 0.136 -4.526 1.00 0.00 ATOM 1691 CB ARG 241 77.791 0.427 -3.887 1.00 0.00 ATOM 1692 CG ARG 241 78.979 0.383 -4.805 1.00 0.00 ATOM 1693 CD ARG 241 79.086 -0.951 -5.544 1.00 0.00 ATOM 1694 NE ARG 241 80.272 -0.921 -6.372 1.00 0.00 ATOM 1695 CZ ARG 241 80.286 -0.713 -7.682 1.00 0.00 ATOM 1696 NH1 ARG 241 79.148 -0.536 -8.359 1.00 0.00 ATOM 1697 NH2 ARG 241 81.452 -0.679 -8.308 1.00 0.00 ATOM 1698 O ARG 241 74.609 1.046 -3.238 1.00 0.00 ATOM 1699 C ARG 241 75.334 0.086 -3.452 1.00 0.00 ATOM 1700 N TRP 242 75.216 -1.069 -2.821 1.00 0.00 ATOM 1701 CA TRP 242 74.274 -1.303 -1.721 1.00 0.00 ATOM 1702 CB TRP 242 73.229 -2.384 -2.108 1.00 0.00 ATOM 1703 CG TRP 242 72.452 -1.825 -3.275 1.00 0.00 ATOM 1704 CD1 TRP 242 71.325 -1.011 -3.225 1.00 0.00 ATOM 1705 CD2 TRP 242 72.856 -1.860 -4.649 1.00 0.00 ATOM 1706 CE2 TRP 242 71.913 -1.097 -5.393 1.00 0.00 ATOM 1707 CE3 TRP 242 73.929 -2.467 -5.328 1.00 0.00 ATOM 1708 NE1 TRP 242 70.992 -0.584 -4.512 1.00 0.00 ATOM 1709 CZ2 TRP 242 72.001 -0.945 -6.794 1.00 0.00 ATOM 1710 CZ3 TRP 242 74.007 -2.330 -6.739 1.00 0.00 ATOM 1711 CH2 TRP 242 73.037 -1.582 -7.450 1.00 0.00 ATOM 1712 O TRP 242 76.329 -2.044 -0.738 1.00 0.00 ATOM 1713 C TRP 242 75.164 -1.678 -0.534 1.00 0.00 ATOM 1714 N ALA 243 74.687 -1.472 0.694 1.00 0.00 ATOM 1715 CA ALA 243 75.409 -2.017 1.839 1.00 0.00 ATOM 1716 CB ALA 243 76.199 -0.954 2.583 1.00 0.00 ATOM 1717 O ALA 243 73.225 -2.158 2.784 1.00 0.00 ATOM 1718 C ALA 243 74.345 -2.628 2.724 1.00 0.00 ATOM 1719 N LEU 244 74.717 -3.704 3.380 1.00 0.00 ATOM 1720 CA LEU 244 73.797 -4.414 4.244 1.00 0.00 ATOM 1721 CB LEU 244 73.716 -5.852 3.710 1.00 0.00 ATOM 1722 CG LEU 244 72.988 -6.947 4.460 1.00 0.00 ATOM 1723 CD1 LEU 244 71.459 -6.653 4.449 1.00 0.00 ATOM 1724 CD2 LEU 244 73.299 -8.286 3.816 1.00 0.00 ATOM 1725 O LEU 244 75.653 -4.613 5.730 1.00 0.00 ATOM 1726 C LEU 244 74.460 -4.425 5.635 1.00 0.00 ATOM 1727 N ALA 245 73.683 -4.302 6.690 1.00 0.00 ATOM 1728 CA ALA 245 74.242 -4.392 8.062 1.00 0.00 ATOM 1729 CB ALA 245 74.540 -3.011 8.624 1.00 0.00 ATOM 1730 O ALA 245 72.055 -5.104 8.734 1.00 0.00 ATOM 1731 C ALA 245 73.267 -5.111 8.981 1.00 0.00 ATOM 1732 N TRP 246 73.815 -5.684 10.058 1.00 0.00 ATOM 1733 CA TRP 246 73.002 -6.516 10.933 1.00 0.00 ATOM 1734 CB TRP 246 72.807 -7.945 10.345 1.00 0.00 ATOM 1735 CG TRP 246 74.052 -8.774 10.157 1.00 0.00 ATOM 1736 CD1 TRP 246 74.509 -9.740 10.999 1.00 0.00 ATOM 1737 CD2 TRP 246 74.971 -8.767 9.019 1.00 0.00 ATOM 1738 CE2 TRP 246 75.956 -9.730 9.287 1.00 0.00 ATOM 1739 CE3 TRP 246 75.049 -8.025 7.810 1.00 0.00 ATOM 1740 NE1 TRP 246 75.654 -10.295 10.500 1.00 0.00 ATOM 1741 CZ2 TRP 246 77.036 -9.987 8.396 1.00 0.00 ATOM 1742 CZ3 TRP 246 76.101 -8.253 6.957 1.00 0.00 ATOM 1743 CH2 TRP 246 77.090 -9.233 7.254 1.00 0.00 ATOM 1744 O TRP 246 74.773 -6.323 12.544 1.00 0.00 ATOM 1745 C TRP 246 73.604 -6.554 12.351 1.00 0.00 ATOM 1746 N SER 247 72.759 -6.883 13.320 1.00 0.00 ATOM 1747 CA SER 247 73.163 -6.881 14.719 1.00 0.00 ATOM 1748 CB SER 247 72.949 -5.492 15.358 1.00 0.00 ATOM 1749 OG SER 247 73.430 -5.474 16.725 1.00 0.00 ATOM 1750 O SER 247 71.213 -8.204 15.209 1.00 0.00 ATOM 1751 C SER 247 72.395 -7.941 15.482 1.00 0.00 ATOM 1752 N PHE 248 73.072 -8.530 16.457 1.00 0.00 ATOM 1753 CA PHE 248 72.433 -9.421 17.432 1.00 0.00 ATOM 1754 CB PHE 248 73.382 -10.568 17.772 1.00 0.00 ATOM 1755 CG PHE 248 73.699 -11.422 16.593 1.00 0.00 ATOM 1756 CD1 PHE 248 72.944 -12.569 16.327 1.00 0.00 ATOM 1757 CD2 PHE 248 74.695 -11.036 15.691 1.00 0.00 ATOM 1758 CE1 PHE 248 73.224 -13.348 15.188 1.00 0.00 ATOM 1759 CE2 PHE 248 74.984 -11.813 14.559 1.00 0.00 ATOM 1760 CZ PHE 248 74.251 -12.952 14.312 1.00 0.00 ATOM 1761 O PHE 248 71.379 -9.382 19.574 1.00 0.00 ATOM 1762 C PHE 248 71.954 -8.726 18.709 1.00 0.00 ATOM 1763 N TYR 249 72.182 -7.418 18.827 1.00 0.00 ATOM 1764 CA TYR 249 71.613 -6.582 19.906 1.00 0.00 ATOM 1765 CB TYR 249 72.378 -5.244 20.016 1.00 0.00 ATOM 1766 CG TYR 249 73.739 -5.402 20.665 1.00 0.00 ATOM 1767 CD1 TYR 249 74.833 -5.860 19.923 1.00 0.00 ATOM 1768 CD2 TYR 249 73.920 -5.157 22.055 1.00 0.00 ATOM 1769 CE1 TYR 249 76.086 -6.059 20.516 1.00 0.00 ATOM 1770 CE2 TYR 249 75.174 -5.348 22.664 1.00 0.00 ATOM 1771 CZ TYR 249 76.244 -5.793 21.887 1.00 0.00 ATOM 1772 OH TYR 249 77.469 -5.997 22.424 1.00 0.00 ATOM 1773 O TYR 249 69.650 -5.972 18.632 1.00 0.00 ATOM 1774 C TYR 249 70.101 -6.335 19.718 1.00 0.00 ATOM 1775 N ASP 250 69.317 -6.544 20.775 1.00 0.00 ATOM 1776 CA ASP 250 67.880 -6.253 20.748 1.00 0.00 ATOM 1777 CB ASP 250 67.092 -7.356 21.475 1.00 0.00 ATOM 1778 CG ASP 250 67.493 -7.476 22.940 1.00 0.00 ATOM 1779 OD1 ASP 250 68.090 -8.511 23.300 1.00 0.00 ATOM 1780 OD2 ASP 250 67.268 -6.510 23.715 1.00 0.00 ATOM 1781 O ASP 250 67.270 -3.905 20.760 1.00 0.00 ATOM 1782 C ASP 250 67.616 -4.896 21.417 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 T0293.undertaker-align.pdb looking for model 1 WARNING: atoms too close: (T0293)P36.C and (T0293)L40.C only 0.000 apart, marking (T0293)L40.C as missing WARNING: atoms too close: (T0293)T37.N and (T0293)R41.N only 0.000 apart, marking (T0293)T37.N as missing WARNING: atoms too close: (T0293)T37.CA and (T0293)R41.CA only 0.000 apart, marking (T0293)T37.CA as missing WARNING: atoms too close: (T0293)I52.C and (T0293)H54.C only 0.000 apart, marking (T0293)H54.C as missing WARNING: atoms too close: (T0293)G53.N and (T0293)Q55.N only 0.000 apart, marking (T0293)G53.N as missing WARNING: atoms too close: (T0293)G53.CA and (T0293)Q55.CA only 0.000 apart, marking (T0293)G53.CA as missing WARNING: atoms too close: (T0293)L83.C and (T0293)N84.C only 0.000 apart, marking (T0293)N84.C as missing WARNING: atoms too close: (T0293)N84.N and (T0293)G85.N only 0.000 apart, marking (T0293)N84.N as missing WARNING: atoms too close: (T0293)N84.CA and (T0293)G85.CA only 0.000 apart, marking (T0293)N84.CA as missing WARNING: atoms too close: (T0293)L124.C and (T0293)A128.C only 0.000 apart, marking (T0293)A128.C as missing WARNING: atoms too close: (T0293)L125.N and (T0293)L129.N only 0.000 apart, marking (T0293)L125.N as missing WARNING: atoms too close: (T0293)L125.CA and (T0293)L129.CA only 0.000 apart, marking (T0293)L125.CA as missing WARNING: atoms too close: (T0293)E134.C and (T0293)I135.C only 0.000 apart, marking (T0293)I135.C as missing WARNING: atoms too close: (T0293)I135.N and (T0293)I136.N only 0.000 apart, marking (T0293)I135.N as missing WARNING: atoms too close: (T0293)I135.CA and (T0293)I136.CA only 0.000 apart, marking (T0293)I135.CA as missing WARNING: atoms too close: (T0293)Q150.C and (T0293)R162.C only 0.000 apart, marking (T0293)R162.C as missing WARNING: atoms too close: (T0293)L151.N and (T0293)R163.N only 0.000 apart, marking (T0293)L151.N as missing WARNING: atoms too close: (T0293)L151.CA and (T0293)R163.CA only 0.000 apart, marking (T0293)L151.CA as missing WARNING: atoms too close: (T0293)D193.C and (T0293)L197.C only 0.000 apart, marking (T0293)L197.C as missing WARNING: atoms too close: (T0293)S194.N and (T0293)G198.N only 0.000 apart, marking (T0293)S194.N as missing WARNING: atoms too close: (T0293)S194.CA and (T0293)G198.CA only 0.000 apart, marking (T0293)S194.CA as missing WARNING: atoms too close: (T0293)K218.C and (T0293)I223.C only 0.000 apart, marking (T0293)I223.C as missing WARNING: atoms too close: (T0293)E219.N and (T0293)Q224.N only 0.000 apart, marking (T0293)E219.N as missing WARNING: atoms too close: (T0293)E219.CA and (T0293)Q224.CA only 0.000 apart, marking (T0293)E219.CA as missing # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # command:# naming current conformation align1 # command:# fraction of real conformation used = 0.784 # GDT_score = -43.243 # GDT_score(maxd=8.000,maxw=2.900)= -42.751 # GDT_score(maxd=8.000,maxw=3.200)= -40.619 # GDT_score(maxd=8.000,maxw=3.500)= -38.410 # GDT_score(maxd=10.000,maxw=3.800)= -41.401 # GDT_score(maxd=10.000,maxw=4.000)= -39.936 # GDT_score(maxd=10.000,maxw=4.200)= -38.500 # GDT_score(maxd=12.000,maxw=4.300)= -41.898 # GDT_score(maxd=12.000,maxw=4.500)= -40.458 # GDT_score(maxd=12.000,maxw=4.700)= -39.071 # GDT_score(maxd=14.000,maxw=5.200)= -39.007 # GDT_score(maxd=14.000,maxw=5.500)= -37.220 # command:# ReadConformPDB reading from PDB file T0293.undertaker-align.pdb looking for model 2 WARNING: atoms too close: (T0293)L31.C and (T0293)P36.C only 0.000 apart, marking (T0293)P36.C as missing WARNING: atoms too close: (T0293)E32.N and (T0293)T37.N only 0.000 apart, marking (T0293)E32.N as missing WARNING: atoms too close: (T0293)E32.CA and (T0293)T37.CA only 0.000 apart, marking (T0293)E32.CA as missing WARNING: atoms too close: (T0293)I52.C and (T0293)H54.C only 0.000 apart, marking (T0293)H54.C as missing WARNING: atoms too close: (T0293)G53.N and (T0293)Q55.N only 0.000 apart, marking (T0293)G53.N as missing WARNING: atoms too close: (T0293)G53.CA and (T0293)Q55.CA only 0.000 apart, marking (T0293)G53.CA as missing WARNING: atoms too close: (T0293)N84.C and (T0293)W86.C only 0.000 apart, marking (T0293)W86.C as missing WARNING: atoms too close: (T0293)G85.N and (T0293)Y87.N only 0.000 apart, marking (T0293)G85.N as missing WARNING: atoms too close: (T0293)G85.CA and (T0293)Y87.CA only 0.000 apart, marking (T0293)G85.CA as missing WARNING: atoms too close: (T0293)P120.C and (T0293)L124.C only 0.000 apart, marking (T0293)L124.C as missing WARNING: atoms too close: (T0293)Q121.N and (T0293)L125.N only 0.000 apart, marking (T0293)Q121.N as missing WARNING: atoms too close: (T0293)Q121.CA and (T0293)L125.CA only 0.000 apart, marking (T0293)Q121.CA as missing WARNING: atoms too close: (T0293)M126.C and (T0293)L129.C only 0.000 apart, marking (T0293)L129.C as missing WARNING: atoms too close: (T0293)D127.N and (T0293)K130.N only 0.000 apart, marking (T0293)D127.N as missing WARNING: atoms too close: (T0293)D127.CA and (T0293)K130.CA only 0.000 apart, marking (T0293)D127.CA as missing WARNING: atoms too close: (T0293)P145.C and (T0293)F146.C only 0.000 apart, marking (T0293)F146.C as missing WARNING: atoms too close: (T0293)F146.N and (T0293)F147.N only 0.000 apart, marking (T0293)F146.N as missing WARNING: atoms too close: (T0293)F146.CA and (T0293)F147.CA only 0.000 apart, marking (T0293)F146.CA as missing WARNING: atoms too close: (T0293)A148.C and (T0293)E180.C only 0.000 apart, marking (T0293)E180.C as missing WARNING: atoms too close: (T0293)N149.N and (T0293)G181.N only 0.000 apart, marking (T0293)N149.N as missing WARNING: atoms too close: (T0293)N149.CA and (T0293)G181.CA only 0.000 apart, marking (T0293)N149.CA as missing WARNING: atoms too close: (T0293)G182.C and (T0293)E183.C only 0.000 apart, marking (T0293)E183.C as missing WARNING: atoms too close: (T0293)E183.N and (T0293)L184.N only 0.000 apart, marking (T0293)E183.N as missing WARNING: atoms too close: (T0293)E183.CA and (T0293)L184.CA only 0.000 apart, marking (T0293)E183.CA as missing WARNING: atoms too close: (T0293)Q224.C and (T0293)G225.C only 0.000 apart, marking (T0293)G225.C as missing WARNING: atoms too close: (T0293)G225.N and (T0293)V226.N only 0.000 apart, marking (T0293)G225.N as missing WARNING: atoms too close: (T0293)G225.CA and (T0293)V226.CA only 0.000 apart, marking (T0293)G225.CA as missing WARNING: atoms too close: (T0293)G237.C and (T0293)M240.C only 0.000 apart, marking (T0293)M240.C as missing WARNING: atoms too close: (T0293)R238.N and (T0293)R241.N only 0.000 apart, marking (T0293)R238.N as missing WARNING: atoms too close: (T0293)R238.CA and (T0293)R241.CA only 0.000 apart, marking (T0293)R238.CA as missing # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # command:# naming current conformation align2 # command:# fraction of real conformation used = 0.793 # GDT_score = -44.369 # GDT_score(maxd=8.000,maxw=2.900)= -44.948 # GDT_score(maxd=8.000,maxw=3.200)= -42.668 # GDT_score(maxd=8.000,maxw=3.500)= -40.364 # GDT_score(maxd=10.000,maxw=3.800)= -42.933 # GDT_score(maxd=10.000,maxw=4.000)= -41.425 # GDT_score(maxd=10.000,maxw=4.200)= -39.996 # GDT_score(maxd=12.000,maxw=4.300)= -43.158 # GDT_score(maxd=12.000,maxw=4.500)= -41.740 # GDT_score(maxd=12.000,maxw=4.700)= -40.369 # GDT_score(maxd=14.000,maxw=5.200)= -40.234 # GDT_score(maxd=14.000,maxw=5.500)= -38.379 # command:# ReadConformPDB reading from PDB file T0293.undertaker-align.pdb looking for model 3 WARNING: atoms too close: (T0293)L83.C and (T0293)N84.C only 0.000 apart, marking (T0293)N84.C as missing WARNING: atoms too close: (T0293)N84.N and (T0293)G85.N only 0.000 apart, marking (T0293)N84.N as missing WARNING: atoms too close: (T0293)N84.CA and (T0293)G85.CA only 0.000 apart, marking (T0293)N84.CA as missing WARNING: atoms too close: (T0293)D112.C and (T0293)L113.C only 0.000 apart, marking (T0293)L113.C as missing WARNING: atoms too close: (T0293)L113.N and (T0293)I114.N only 0.000 apart, marking (T0293)L113.N as missing WARNING: atoms too close: (T0293)L113.CA and (T0293)I114.CA only 0.000 apart, marking (T0293)L113.CA as missing WARNING: atoms too close: (T0293)D127.C and (T0293)S133.C only 0.000 apart, marking (T0293)S133.C as missing WARNING: atoms too close: (T0293)A128.N and (T0293)E134.N only 0.000 apart, marking (T0293)A128.N as missing WARNING: atoms too close: (T0293)A128.CA and (T0293)E134.CA only 0.000 apart, marking (T0293)A128.CA as missing WARNING: atoms too close: (T0293)C142.C and (T0293)N157.C only 0.000 apart, marking (T0293)N157.C as missing WARNING: atoms too close: (T0293)N143.N and (T0293)S158.N only 0.000 apart, marking (T0293)N143.N as missing WARNING: atoms too close: (T0293)N143.CA and (T0293)S158.CA only 0.000 apart, marking (T0293)N143.CA as missing WARNING: atoms too close: (T0293)S167.C and (T0293)G173.C only 0.000 apart, marking (T0293)G173.C as missing WARNING: atoms too close: (T0293)S168.N and (T0293)I174.N only 0.000 apart, marking (T0293)S168.N as missing WARNING: atoms too close: (T0293)S168.CA and (T0293)I174.CA only 0.000 apart, marking (T0293)S168.CA as missing # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # command:# naming current conformation align3 # command:# ReadConformPDB reading from PDB file T0293.undertaker-align.pdb looking for model 4 WARNING: atoms too close: (T0293)G53.C and (T0293)D58.C only 0.000 apart, marking (T0293)D58.C as missing WARNING: atoms too close: (T0293)H54.N and (T0293)K59.N only 0.000 apart, marking (T0293)H54.N as missing WARNING: atoms too close: (T0293)H54.CA and (T0293)K59.CA only 0.000 apart, marking (T0293)H54.CA as missing WARNING: atoms too close: (T0293)L124.C and (T0293)L125.C only 0.000 apart, marking (T0293)L125.C as missing WARNING: atoms too close: (T0293)L125.N and (T0293)M126.N only 0.000 apart, marking (T0293)L125.N as missing WARNING: atoms too close: (T0293)L125.CA and (T0293)M126.CA only 0.000 apart, marking (T0293)L125.CA as missing WARNING: atoms too close: (T0293)D127.C and (T0293)S133.C only 0.000 apart, marking (T0293)S133.C as missing WARNING: atoms too close: (T0293)A128.N and (T0293)E134.N only 0.000 apart, marking (T0293)A128.N as missing WARNING: atoms too close: (T0293)A128.CA and (T0293)E134.CA only 0.000 apart, marking (T0293)A128.CA as missing WARNING: atoms too close: (T0293)C142.C and (T0293)R162.C only 0.000 apart, marking (T0293)R162.C as missing WARNING: atoms too close: (T0293)N143.N and (T0293)R163.N only 0.000 apart, marking (T0293)N143.N as missing WARNING: atoms too close: (T0293)N143.CA and (T0293)R163.CA only 0.000 apart, marking (T0293)N143.CA as missing WARNING: atoms too close: (T0293)S194.C and (T0293)L214.C only 0.000 apart, marking (T0293)L214.C as missing WARNING: atoms too close: (T0293)L195.N and (T0293)A215.N only 0.000 apart, marking (T0293)L195.N as missing WARNING: atoms too close: (T0293)L195.CA and (T0293)A215.CA only 0.000 apart, marking (T0293)L195.CA as missing # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # command:# naming current conformation align4 # command:# ReadConformPDB reading from PDB file T0293.undertaker-align.pdb looking for model 5 WARNING: atoms too close: (T0293)D112.C and (T0293)L113.C only 0.000 apart, marking (T0293)L113.C as missing WARNING: atoms too close: (T0293)L113.N and (T0293)I114.N only 0.000 apart, marking (T0293)L113.N as missing WARNING: atoms too close: (T0293)L113.CA and (T0293)I114.CA only 0.000 apart, marking (T0293)L113.CA as missing WARNING: atoms too close: (T0293)D127.C and (T0293)S133.C only 0.000 apart, marking (T0293)S133.C as missing WARNING: atoms too close: (T0293)A128.N and (T0293)E134.N only 0.000 apart, marking (T0293)A128.N as missing WARNING: atoms too close: (T0293)A128.CA and (T0293)E134.CA only 0.000 apart, marking (T0293)A128.CA as missing WARNING: atoms too close: (T0293)C142.C and (T0293)N157.C only 0.000 apart, marking (T0293)N157.C as missing WARNING: atoms too close: (T0293)N143.N and (T0293)S158.N only 0.000 apart, marking (T0293)N143.N as missing WARNING: atoms too close: (T0293)N143.CA and (T0293)S158.CA only 0.000 apart, marking (T0293)N143.CA as missing WARNING: atoms too close: (T0293)P165.C and (T0293)T171.C only 0.000 apart, marking (T0293)T171.C as missing WARNING: atoms too close: (T0293)P166.N and (T0293)G172.N only 0.000 apart, marking (T0293)P166.N as missing WARNING: atoms too close: (T0293)P166.CA and (T0293)G172.CA only 0.000 apart, marking (T0293)P166.CA as missing # WARNING: incomplete conformation T0293 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 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ../model2.ts-submitted looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ../model3.ts-submitted looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ../model4.ts-submitted looking for model 1 # Found a chain break before 248 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ../model5.ts-submitted looking for model 1 # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # ReadConformPDB reading from PDB file T0293.try1-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 236 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try1-opt1.pdb.gz looking for model 1 # Found a chain break before 236 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try1-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 195 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try1-opt2.pdb.gz looking for model 1 # Found a chain break before 239 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try1-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 239 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try10-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try10-opt1.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try10-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 249 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try10-opt2.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try10-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try11-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try11-opt1.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try11-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 249 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try11-opt2.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try11-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try12-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try12-opt1.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try12-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 249 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try12-opt2.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try12-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try13-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 239 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try13-opt1.pdb.gz looking for model 1 # Found a chain break before 239 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try13-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 236 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try13-opt2.pdb.gz looking for model 1 # Found a chain break before 246 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try13-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 246 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try14-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try14-opt1.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try14-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 249 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try14-opt2.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try14-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try15-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 247 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try15-opt1.pdb.gz looking for model 1 # Found a chain break before 247 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try15-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 232 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try15-opt2.pdb.gz looking for model 1 # Found a chain break before 247 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try15-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 247 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try16-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try16-opt1.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try16-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 228 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try16-opt2.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try16-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try17-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try17-opt1.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try17-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 249 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try17-opt2.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try17-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try2-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 241 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try2-opt1.pdb.gz looking for model 1 # Found a chain break before 241 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try2-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 243 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try2-opt2.pdb.gz looking for model 1 # Found a chain break before 241 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try2-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 241 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try3-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 218 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try3-opt1.pdb.gz looking for model 1 # Found a chain break before 218 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try3-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 184 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try3-opt2.pdb.gz looking for model 1 # Found a chain break before 238 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try3-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 238 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try4-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try4-opt1.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try4-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try4-opt2.pdb.gz looking for model 1 # Found a chain break before 248 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try4-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 248 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try5-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 248 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try5-opt1.pdb.gz looking for model 1 # Found a chain break before 248 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try5-opt2.pdb.gz looking for model 1 # Found a chain break before 248 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try5-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 248 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try6-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 241 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try6-opt1.pdb.gz looking for model 1 # Found a chain break before 241 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try6-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try6-opt2.pdb.gz looking for model 1 # Found a chain break before 248 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try6-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 248 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try7-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 241 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try7-opt1.pdb.gz looking for model 1 # Found a chain break before 241 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try7-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 249 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try7-opt2.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try7-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try8-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try8-opt1.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try8-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 249 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try8-opt2.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try8-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try9-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 242 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try9-opt1.pdb.gz looking for model 1 # Found a chain break before 242 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try9-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 249 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try9-opt2.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0293.try9-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file chimera-try5-align2.pdb.gz looking for model 1 # Found a chain break before 248 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file chimera-try5-server.pdb.gz looking for model 1 # Found a chain break before 248 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file chimera1.pdb.gz looking for model 1 # Found a chain break before 241 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file fromTry4.proto.pdb.gz looking for model 1 # Found a chain break before 248 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file lineup230and245take1.2rotateNterminusAndMove.renum.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file lineup230and245take1.9rotateNtermSlide33-37helix.renum.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file shift232over1.1FromTry8.renum.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file shift232over1.2FromTry8.renum.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file shift232over1.2andMoveH33-37.renum.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file shift232over1FromTry8.renum.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file shift232over2FromTry8.renum.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file servers/3D-JIGSAW_POPULUS_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_POPULUS_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_263000257.pdb -s /var/tmp/to_scwrl_263000257.seq -o /var/tmp/from_scwrl_263000257.pdb > /var/tmp/scwrl_263000257.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_263000257.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 T0293 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_POPULUS_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_2106456958.pdb -s /var/tmp/to_scwrl_2106456958.seq -o /var/tmp/from_scwrl_2106456958.pdb > /var/tmp/scwrl_2106456958.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2106456958.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 T0293 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_POPULUS_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_189731952.pdb -s /var/tmp/to_scwrl_189731952.seq -o /var/tmp/from_scwrl_189731952.pdb > /var/tmp/scwrl_189731952.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_189731952.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 T0293 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_POPULUS_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1432929855.pdb -s /var/tmp/to_scwrl_1432929855.seq -o /var/tmp/from_scwrl_1432929855.pdb > /var/tmp/scwrl_1432929855.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1432929855.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 T0293 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_POPULUS_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1889270356.pdb -s /var/tmp/to_scwrl_1889270356.seq -o /var/tmp/from_scwrl_1889270356.pdb > /var/tmp/scwrl_1889270356.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1889270356.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 T0293 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_RECOM_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1620217292.pdb -s /var/tmp/to_scwrl_1620217292.seq -o /var/tmp/from_scwrl_1620217292.pdb > /var/tmp/scwrl_1620217292.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1620217292.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 T0293 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_RECOM_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1343478126.pdb -s /var/tmp/to_scwrl_1343478126.seq -o /var/tmp/from_scwrl_1343478126.pdb > /var/tmp/scwrl_1343478126.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1343478126.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 T0293 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_RECOM_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1633011488.pdb -s /var/tmp/to_scwrl_1633011488.seq -o /var/tmp/from_scwrl_1633011488.pdb > /var/tmp/scwrl_1633011488.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1633011488.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 T0293 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_RECOM_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_767838781.pdb -s /var/tmp/to_scwrl_767838781.seq -o /var/tmp/from_scwrl_767838781.pdb > /var/tmp/scwrl_767838781.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_767838781.pdb # conformation set from SCWRL output # naming current conformation 3D-JIGSAW_RECOM_TS4-scwrl # ReadConformPDB reading from PDB file servers/3D-JIGSAW_RECOM_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_RECOM_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1916413783.pdb -s /var/tmp/to_scwrl_1916413783.seq -o /var/tmp/from_scwrl_1916413783.pdb > /var/tmp/scwrl_1916413783.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1916413783.pdb # conformation set from SCWRL output # naming current conformation 3D-JIGSAW_RECOM_TS5-scwrl # ReadConformPDB reading from PDB file servers/3D-JIGSAW_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_62552299.pdb -s /var/tmp/to_scwrl_62552299.seq -o /var/tmp/from_scwrl_62552299.pdb > /var/tmp/scwrl_62552299.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_62552299.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 # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_369844445.pdb -s /var/tmp/to_scwrl_369844445.seq -o /var/tmp/from_scwrl_369844445.pdb > /var/tmp/scwrl_369844445.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_369844445.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 # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1641604180.pdb -s /var/tmp/to_scwrl_1641604180.seq -o /var/tmp/from_scwrl_1641604180.pdb > /var/tmp/scwrl_1641604180.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1641604180.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 T0293 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1990276052.pdb -s /var/tmp/to_scwrl_1990276052.seq -o /var/tmp/from_scwrl_1990276052.pdb > /var/tmp/scwrl_1990276052.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1990276052.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 # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_77074456.pdb -s /var/tmp/to_scwrl_77074456.seq -o /var/tmp/from_scwrl_77074456.pdb > /var/tmp/scwrl_77074456.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_77074456.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 183 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_933809922.pdb -s /var/tmp/to_scwrl_933809922.seq -o /var/tmp/from_scwrl_933809922.pdb > /var/tmp/scwrl_933809922.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_933809922.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 183 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1592022096.pdb -s /var/tmp/to_scwrl_1592022096.seq -o /var/tmp/from_scwrl_1592022096.pdb > /var/tmp/scwrl_1592022096.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1592022096.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 233 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_954375793.pdb -s /var/tmp/to_scwrl_954375793.seq -o /var/tmp/from_scwrl_954375793.pdb > /var/tmp/scwrl_954375793.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_954375793.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 213 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1830454575.pdb -s /var/tmp/to_scwrl_1830454575.seq -o /var/tmp/from_scwrl_1830454575.pdb > /var/tmp/scwrl_1830454575.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1830454575.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 225 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_2088448538.pdb -s /var/tmp/to_scwrl_2088448538.seq -o /var/tmp/from_scwrl_2088448538.pdb > /var/tmp/scwrl_2088448538.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2088448538.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 246 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_972384562.pdb -s /var/tmp/to_scwrl_972384562.seq -o /var/tmp/from_scwrl_972384562.pdb > /var/tmp/scwrl_972384562.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_972384562.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 215 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_903718735.pdb -s /var/tmp/to_scwrl_903718735.seq -o /var/tmp/from_scwrl_903718735.pdb > /var/tmp/scwrl_903718735.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_903718735.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 246 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_65119634.pdb -s /var/tmp/to_scwrl_65119634.seq -o /var/tmp/from_scwrl_65119634.pdb > /var/tmp/scwrl_65119634.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_65119634.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 249 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1280327597.pdb -s /var/tmp/to_scwrl_1280327597.seq -o /var/tmp/from_scwrl_1280327597.pdb > /var/tmp/scwrl_1280327597.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1280327597.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 247 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1061865881.pdb -s /var/tmp/to_scwrl_1061865881.seq -o /var/tmp/from_scwrl_1061865881.pdb > /var/tmp/scwrl_1061865881.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1061865881.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 239 # copying to AlignedFragments data structure # naming current conformation BayesHH_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_874273208.pdb -s /var/tmp/to_scwrl_874273208.seq -o /var/tmp/from_scwrl_874273208.pdb > /var/tmp/scwrl_874273208.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_874273208.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 249 # copying to AlignedFragments data structure # naming current conformation Bilab-ENABLE_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1889899995.pdb -s /var/tmp/to_scwrl_1889899995.seq -o /var/tmp/from_scwrl_1889899995.pdb > /var/tmp/scwrl_1889899995.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1889899995.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 # Found a chain break before 249 # copying to AlignedFragments data structure # naming current conformation Bilab-ENABLE_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_706636242.pdb -s /var/tmp/to_scwrl_706636242.seq -o /var/tmp/from_scwrl_706636242.pdb > /var/tmp/scwrl_706636242.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_706636242.pdb # conformation set from SCWRL output # naming current conformation Bilab-ENABLE_TS2-scwrl # ReadConformPDB reading from PDB file servers/Bilab-ENABLE_TS3.pdb.gz looking for model 1 # Found a chain break before 249 # copying to AlignedFragments data structure # naming current conformation Bilab-ENABLE_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_536019528.pdb -s /var/tmp/to_scwrl_536019528.seq -o /var/tmp/from_scwrl_536019528.pdb > /var/tmp/scwrl_536019528.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_536019528.pdb # conformation set from SCWRL output # naming current conformation Bilab-ENABLE_TS3-scwrl # ReadConformPDB reading from PDB file servers/Bilab-ENABLE_TS4.pdb.gz looking for model 1 # Found a chain break before 249 # copying to AlignedFragments data structure # naming current conformation Bilab-ENABLE_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_807826760.pdb -s /var/tmp/to_scwrl_807826760.seq -o /var/tmp/from_scwrl_807826760.pdb > /var/tmp/scwrl_807826760.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_807826760.pdb # conformation set from SCWRL output # naming current conformation Bilab-ENABLE_TS4-scwrl # ReadConformPDB reading from PDB file servers/Bilab-ENABLE_TS5.pdb.gz looking for model 1 # Found a chain break before 249 # copying to AlignedFragments data structure # naming current conformation Bilab-ENABLE_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_610218340.pdb -s /var/tmp/to_scwrl_610218340.seq -o /var/tmp/from_scwrl_610218340.pdb > /var/tmp/scwrl_610218340.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_610218340.pdb # conformation set from SCWRL output # naming current conformation Bilab-ENABLE_TS5-scwrl # ReadConformPDB reading from PDB file servers/CIRCLE_TS1.pdb.gz looking for model 1 # Found a chain break before 249 # copying to AlignedFragments data structure # naming current conformation CIRCLE_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_799019785.pdb -s /var/tmp/to_scwrl_799019785.seq -o /var/tmp/from_scwrl_799019785.pdb > /var/tmp/scwrl_799019785.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_799019785.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 T0293 can't currently be optimized by undertaker # naming current conformation CIRCLE_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_766800071.pdb -s /var/tmp/to_scwrl_766800071.seq -o /var/tmp/from_scwrl_766800071.pdb > /var/tmp/scwrl_766800071.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_766800071.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 T0293 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation CIRCLE_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_799950292.pdb -s /var/tmp/to_scwrl_799950292.seq -o /var/tmp/from_scwrl_799950292.pdb > /var/tmp/scwrl_799950292.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_799950292.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 T0293 can't currently be optimized by undertaker # naming current conformation CIRCLE_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_84465993.pdb -s /var/tmp/to_scwrl_84465993.seq -o /var/tmp/from_scwrl_84465993.pdb > /var/tmp/scwrl_84465993.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_84465993.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 # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # naming current conformation CIRCLE_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_508586780.pdb -s /var/tmp/to_scwrl_508586780.seq -o /var/tmp/from_scwrl_508586780.pdb > /var/tmp/scwrl_508586780.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_508586780.pdb # conformation set from SCWRL output # naming current conformation CIRCLE_TS5-scwrl # ReadConformPDB reading from PDB file servers/CaspIta-FOX_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # naming current conformation CaspIta-FOX_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_272683937.pdb -s /var/tmp/to_scwrl_272683937.seq -o /var/tmp/from_scwrl_272683937.pdb > /var/tmp/scwrl_272683937.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_272683937.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: atoms too close: (T0293)A179.C and (T0293)E180.N only 0.000 apart, marking (T0293)E180.N as missing WARNING: atoms too close: (T0293)E180.N and (T0293)E180.CA only 0.000 apart, marking (T0293)E180.CA as missing WARNING: atoms too close: (T0293)A179.C and (T0293)E180.CA only 0.000 apart, marking (T0293)E180.CA as missing WARNING: atoms too close: (T0293)E180.CA and (T0293)E180.CB only 0.000 apart, marking (T0293)E180.CB as missing WARNING: atoms too close: (T0293)E180.N and (T0293)E180.CB only 0.000 apart, marking (T0293)E180.CB as missing WARNING: atoms too close: (T0293)A179.C and (T0293)E180.CB only 0.000 apart, marking (T0293)E180.CB as missing WARNING: atoms too close: (T0293)E180.CB and (T0293)E180.CG only 0.000 apart, marking (T0293)E180.CG as missing WARNING: atoms too close: (T0293)E180.CA and (T0293)E180.CG only 0.000 apart, marking (T0293)E180.CG as missing WARNING: atoms too close: (T0293)E180.N and (T0293)E180.CG only 0.000 apart, marking (T0293)E180.CG as missing WARNING: atoms too close: (T0293)A179.C and (T0293)E180.CG only 0.000 apart, marking (T0293)E180.CG as missing WARNING: atoms too close: (T0293)E180.CG and (T0293)E180.CD only 0.000 apart, marking (T0293)E180.CD as missing WARNING: atoms too close: (T0293)E180.CB and (T0293)E180.CD only 0.000 apart, marking (T0293)E180.CD as missing WARNING: atoms too close: (T0293)E180.CA and (T0293)E180.CD only 0.000 apart, marking (T0293)E180.CD as missing WARNING: atoms too close: (T0293)E180.N and (T0293)E180.CD only 0.000 apart, marking (T0293)E180.CD as missing WARNING: atoms too close: (T0293)A179.C and (T0293)E180.CD only 0.000 apart, marking (T0293)E180.CD as missing WARNING: atoms too close: (T0293)E180.CD and (T0293)E180.OE1 only 0.000 apart, marking (T0293)E180.OE1 as missing WARNING: atoms too close: (T0293)E180.CG and (T0293)E180.OE1 only 0.000 apart, marking (T0293)E180.OE1 as missing WARNING: atoms too close: (T0293)E180.CB and (T0293)E180.OE1 only 0.000 apart, marking (T0293)E180.OE1 as missing WARNING: atoms too close: (T0293)E180.CA and (T0293)E180.OE1 only 0.000 apart, marking (T0293)E180.OE1 as missing WARNING: atoms too close: (T0293)E180.N and (T0293)E180.OE1 only 0.000 apart, marking (T0293)E180.OE1 as missing WARNING: atoms too close: (T0293)A179.C and (T0293)E180.OE1 only 0.000 apart, marking (T0293)E180.OE1 as missing WARNING: atoms too close: (T0293)E180.OE1 and (T0293)E180.OE2 only 0.000 apart, marking (T0293)E180.OE2 as missing WARNING: atoms too close: (T0293)E180.CD and (T0293)E180.OE2 only 0.000 apart, marking (T0293)E180.OE2 as missing WARNING: atoms too close: (T0293)E180.CG and (T0293)E180.OE2 only 0.000 apart, marking (T0293)E180.OE2 as missing WARNING: atoms too close: (T0293)E180.CB and (T0293)E180.OE2 only 0.000 apart, marking (T0293)E180.OE2 as missing WARNING: atoms too close: (T0293)E180.CA and (T0293)E180.OE2 only 0.000 apart, marking (T0293)E180.OE2 as missing WARNING: atoms too close: (T0293)E180.N and (T0293)E180.OE2 only 0.000 apart, marking (T0293)E180.OE2 as missing WARNING: atoms too close: (T0293)A179.C and (T0293)E180.OE2 only 0.000 apart, marking (T0293)E180.OE2 as missing WARNING: atoms too close: (T0293)E180.OE2 and (T0293)E180.O only 0.000 apart, marking (T0293)E180.O as missing WARNING: atoms too close: (T0293)E180.OE1 and (T0293)E180.O only 0.000 apart, marking (T0293)E180.O as missing WARNING: atoms too close: (T0293)E180.CD and (T0293)E180.O only 0.000 apart, marking (T0293)E180.O as missing WARNING: atoms too close: (T0293)E180.CG and (T0293)E180.O only 0.000 apart, marking (T0293)E180.O as missing WARNING: atoms too close: (T0293)E180.CB and (T0293)E180.O only 0.000 apart, marking (T0293)E180.O as missing WARNING: atoms too close: (T0293)E180.CA and (T0293)E180.O only 0.000 apart, marking (T0293)E180.O as missing WARNING: atoms too close: (T0293)E180.N and (T0293)E180.O only 0.000 apart, marking (T0293)E180.O as missing WARNING: atoms too close: (T0293)A179.C and (T0293)E180.O only 0.000 apart, marking (T0293)E180.O as missing WARNING: atoms too close: (T0293)E180.O and (T0293)E180.C only 0.000 apart, marking (T0293)E180.C as missing WARNING: atoms too close: (T0293)E180.OE2 and (T0293)E180.C only 0.000 apart, marking (T0293)E180.C as missing WARNING: atoms too close: (T0293)E180.OE1 and (T0293)E180.C only 0.000 apart, marking (T0293)E180.C as missing WARNING: atoms too close: (T0293)E180.CD and (T0293)E180.C only 0.000 apart, marking (T0293)E180.C as missing WARNING: atoms too close: (T0293)E180.CG and (T0293)E180.C only 0.000 apart, marking (T0293)E180.C as missing WARNING: atoms too close: (T0293)E180.CB and (T0293)E180.C only 0.000 apart, marking (T0293)E180.C as missing WARNING: atoms too close: (T0293)E180.CA and (T0293)E180.C only 0.000 apart, marking (T0293)E180.C as missing WARNING: atoms too close: (T0293)E180.N and (T0293)E180.C only 0.000 apart, marking (T0293)E180.C as missing WARNING: atoms too close: (T0293)A179.C and (T0293)E180.C only 0.000 apart, marking (T0293)E180.C as missing # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # naming current conformation CaspIta-FOX_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1427944120.pdb -s /var/tmp/to_scwrl_1427944120.seq -o /var/tmp/from_scwrl_1427944120.pdb > /var/tmp/scwrl_1427944120.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1427944120.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 T0293 can't currently be optimized by undertaker # naming current conformation CaspIta-FOX_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_2141598269.pdb -s /var/tmp/to_scwrl_2141598269.seq -o /var/tmp/from_scwrl_2141598269.pdb > /var/tmp/scwrl_2141598269.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2141598269.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 # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # naming current conformation CaspIta-FOX_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1040522718.pdb -s /var/tmp/to_scwrl_1040522718.seq -o /var/tmp/from_scwrl_1040522718.pdb > /var/tmp/scwrl_1040522718.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1040522718.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 T0293 can't currently be optimized by undertaker # naming current conformation CaspIta-FOX_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1196874256.pdb -s /var/tmp/to_scwrl_1196874256.seq -o /var/tmp/from_scwrl_1196874256.pdb > /var/tmp/scwrl_1196874256.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1196874256.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 T0293 can't currently be optimized by undertaker # naming current conformation Distill_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_56666921.pdb -s /var/tmp/to_scwrl_56666921.seq -o /var/tmp/from_scwrl_56666921.pdb > /var/tmp/scwrl_56666921.log Error: Couldn't open file /var/tmp/from_scwrl_56666921.pdb or /var/tmp/from_scwrl_56666921.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_56666921_b.pdb or decoys//var/tmp/from_scwrl_56666921_b.pdb.gz for input Trying /var/tmp/from_scwrl_56666921_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_56666921_b.pdb or /var/tmp/from_scwrl_56666921_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_56666921_a.pdb or decoys//var/tmp/from_scwrl_56666921_a.pdb.gz for input Trying /var/tmp/from_scwrl_56666921_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_56666921_a.pdb or /var/tmp/from_scwrl_56666921_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_56666921.pdb or /var/tmp/from_scwrl_56666921_b.pdb or /var/tmp/from_scwrl_56666921_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 T0293 can't currently be optimized by undertaker # naming current conformation Distill_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1410367162.pdb -s /var/tmp/to_scwrl_1410367162.seq -o /var/tmp/from_scwrl_1410367162.pdb > /var/tmp/scwrl_1410367162.log Error: Couldn't open file /var/tmp/from_scwrl_1410367162.pdb or /var/tmp/from_scwrl_1410367162.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1410367162_b.pdb or decoys//var/tmp/from_scwrl_1410367162_b.pdb.gz for input Trying /var/tmp/from_scwrl_1410367162_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1410367162_b.pdb or /var/tmp/from_scwrl_1410367162_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1410367162_a.pdb or decoys//var/tmp/from_scwrl_1410367162_a.pdb.gz for input Trying /var/tmp/from_scwrl_1410367162_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1410367162_a.pdb or /var/tmp/from_scwrl_1410367162_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1410367162.pdb or /var/tmp/from_scwrl_1410367162_b.pdb or /var/tmp/from_scwrl_1410367162_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 T0293 can't currently be optimized by undertaker # naming current conformation Distill_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_690994790.pdb -s /var/tmp/to_scwrl_690994790.seq -o /var/tmp/from_scwrl_690994790.pdb > /var/tmp/scwrl_690994790.log Error: Couldn't open file /var/tmp/from_scwrl_690994790.pdb or /var/tmp/from_scwrl_690994790.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_690994790_b.pdb or decoys//var/tmp/from_scwrl_690994790_b.pdb.gz for input Trying /var/tmp/from_scwrl_690994790_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_690994790_b.pdb or /var/tmp/from_scwrl_690994790_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_690994790_a.pdb or decoys//var/tmp/from_scwrl_690994790_a.pdb.gz for input Trying /var/tmp/from_scwrl_690994790_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_690994790_a.pdb or /var/tmp/from_scwrl_690994790_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_690994790.pdb or /var/tmp/from_scwrl_690994790_b.pdb or /var/tmp/from_scwrl_690994790_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 T0293 can't currently be optimized by undertaker # naming current conformation Distill_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_2046942974.pdb -s /var/tmp/to_scwrl_2046942974.seq -o /var/tmp/from_scwrl_2046942974.pdb > /var/tmp/scwrl_2046942974.log Error: Couldn't open file /var/tmp/from_scwrl_2046942974.pdb or /var/tmp/from_scwrl_2046942974.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2046942974_b.pdb or decoys//var/tmp/from_scwrl_2046942974_b.pdb.gz for input Trying /var/tmp/from_scwrl_2046942974_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_2046942974_b.pdb or /var/tmp/from_scwrl_2046942974_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2046942974_a.pdb or decoys//var/tmp/from_scwrl_2046942974_a.pdb.gz for input Trying /var/tmp/from_scwrl_2046942974_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_2046942974_a.pdb or /var/tmp/from_scwrl_2046942974_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_2046942974.pdb or /var/tmp/from_scwrl_2046942974_b.pdb or /var/tmp/from_scwrl_2046942974_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 T0293 can't currently be optimized by undertaker # naming current conformation Distill_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1487441618.pdb -s /var/tmp/to_scwrl_1487441618.seq -o /var/tmp/from_scwrl_1487441618.pdb > /var/tmp/scwrl_1487441618.log Error: Couldn't open file /var/tmp/from_scwrl_1487441618.pdb or /var/tmp/from_scwrl_1487441618.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1487441618_b.pdb or decoys//var/tmp/from_scwrl_1487441618_b.pdb.gz for input Trying /var/tmp/from_scwrl_1487441618_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1487441618_b.pdb or /var/tmp/from_scwrl_1487441618_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1487441618_a.pdb or decoys//var/tmp/from_scwrl_1487441618_a.pdb.gz for input Trying /var/tmp/from_scwrl_1487441618_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1487441618_a.pdb or /var/tmp/from_scwrl_1487441618_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1487441618.pdb or /var/tmp/from_scwrl_1487441618_b.pdb or /var/tmp/from_scwrl_1487441618_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 # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation FAMSD_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1624804711.pdb -s /var/tmp/to_scwrl_1624804711.seq -o /var/tmp/from_scwrl_1624804711.pdb > /var/tmp/scwrl_1624804711.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1624804711.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 T0293 can't currently be optimized by undertaker # naming current conformation FAMSD_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1491481423.pdb -s /var/tmp/to_scwrl_1491481423.seq -o /var/tmp/from_scwrl_1491481423.pdb > /var/tmp/scwrl_1491481423.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1491481423.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 # Found a chain break before 249 # copying to AlignedFragments data structure # naming current conformation FAMSD_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_294333765.pdb -s /var/tmp/to_scwrl_294333765.seq -o /var/tmp/from_scwrl_294333765.pdb > /var/tmp/scwrl_294333765.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_294333765.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 T0293 can't currently be optimized by undertaker # naming current conformation FAMSD_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1307775639.pdb -s /var/tmp/to_scwrl_1307775639.seq -o /var/tmp/from_scwrl_1307775639.pdb > /var/tmp/scwrl_1307775639.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1307775639.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 T0293 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation FAMSD_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1432446314.pdb -s /var/tmp/to_scwrl_1432446314.seq -o /var/tmp/from_scwrl_1432446314.pdb > /var/tmp/scwrl_1432446314.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1432446314.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 249 # copying to AlignedFragments data structure # naming current conformation FAMS_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1266718326.pdb -s /var/tmp/to_scwrl_1266718326.seq -o /var/tmp/from_scwrl_1266718326.pdb > /var/tmp/scwrl_1266718326.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1266718326.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 # Found a chain break before 243 # copying to AlignedFragments data structure # naming current conformation FAMS_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_64010727.pdb -s /var/tmp/to_scwrl_64010727.seq -o /var/tmp/from_scwrl_64010727.pdb > /var/tmp/scwrl_64010727.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_64010727.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 T0293 can't currently be optimized by undertaker # naming current conformation FAMS_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1497565949.pdb -s /var/tmp/to_scwrl_1497565949.seq -o /var/tmp/from_scwrl_1497565949.pdb > /var/tmp/scwrl_1497565949.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1497565949.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 # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # naming current conformation FAMS_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_399562277.pdb -s /var/tmp/to_scwrl_399562277.seq -o /var/tmp/from_scwrl_399562277.pdb > /var/tmp/scwrl_399562277.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_399562277.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 249 # copying to AlignedFragments data structure # naming current conformation FAMS_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1125876608.pdb -s /var/tmp/to_scwrl_1125876608.seq -o /var/tmp/from_scwrl_1125876608.pdb > /var/tmp/scwrl_1125876608.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1125876608.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 183 # copying to AlignedFragments data structure # naming current conformation FOLDpro_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_224355510.pdb -s /var/tmp/to_scwrl_224355510.seq -o /var/tmp/from_scwrl_224355510.pdb > /var/tmp/scwrl_224355510.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_224355510.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 209 # copying to AlignedFragments data structure # naming current conformation FOLDpro_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_141978625.pdb -s /var/tmp/to_scwrl_141978625.seq -o /var/tmp/from_scwrl_141978625.pdb > /var/tmp/scwrl_141978625.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_141978625.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 249 # copying to AlignedFragments data structure # naming current conformation FOLDpro_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1832512850.pdb -s /var/tmp/to_scwrl_1832512850.seq -o /var/tmp/from_scwrl_1832512850.pdb > /var/tmp/scwrl_1832512850.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1832512850.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 # Found a chain break before 193 # copying to AlignedFragments data structure # naming current conformation FOLDpro_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_760375038.pdb -s /var/tmp/to_scwrl_760375038.seq -o /var/tmp/from_scwrl_760375038.pdb > /var/tmp/scwrl_760375038.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_760375038.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 244 # copying to AlignedFragments data structure # naming current conformation FOLDpro_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_949805385.pdb -s /var/tmp/to_scwrl_949805385.seq -o /var/tmp/from_scwrl_949805385.pdb > /var/tmp/scwrl_949805385.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_949805385.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 T0293 can't currently be optimized by undertaker # naming current conformation FORTE1_AL1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_295247544.pdb -s /var/tmp/to_scwrl_295247544.seq -o /var/tmp/from_scwrl_295247544.pdb > /var/tmp/scwrl_295247544.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_295247544.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 T0293 can't currently be optimized by undertaker # naming current conformation FORTE1_AL2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1559394822.pdb -s /var/tmp/to_scwrl_1559394822.seq -o /var/tmp/from_scwrl_1559394822.pdb > /var/tmp/scwrl_1559394822.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1559394822.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 T0293 can't currently be optimized by undertaker # naming current conformation FORTE1_AL3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1716605455.pdb -s /var/tmp/to_scwrl_1716605455.seq -o /var/tmp/from_scwrl_1716605455.pdb > /var/tmp/scwrl_1716605455.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1716605455.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 T0293 can't currently be optimized by undertaker # naming current conformation FORTE1_AL4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1095197835.pdb -s /var/tmp/to_scwrl_1095197835.seq -o /var/tmp/from_scwrl_1095197835.pdb > /var/tmp/scwrl_1095197835.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1095197835.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 T0293 can't currently be optimized by undertaker # naming current conformation FORTE1_AL5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1643860815.pdb -s /var/tmp/to_scwrl_1643860815.seq -o /var/tmp/from_scwrl_1643860815.pdb > /var/tmp/scwrl_1643860815.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1643860815.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 T0293 can't currently be optimized by undertaker # naming current conformation FORTE2_AL1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_77708589.pdb -s /var/tmp/to_scwrl_77708589.seq -o /var/tmp/from_scwrl_77708589.pdb > /var/tmp/scwrl_77708589.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_77708589.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 T0293 can't currently be optimized by undertaker # naming current conformation FORTE2_AL2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1367881773.pdb -s /var/tmp/to_scwrl_1367881773.seq -o /var/tmp/from_scwrl_1367881773.pdb > /var/tmp/scwrl_1367881773.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1367881773.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 T0293 can't currently be optimized by undertaker # naming current conformation FORTE2_AL3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_924321289.pdb -s /var/tmp/to_scwrl_924321289.seq -o /var/tmp/from_scwrl_924321289.pdb > /var/tmp/scwrl_924321289.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_924321289.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 T0293 can't currently be optimized by undertaker # naming current conformation FORTE2_AL4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_71823211.pdb -s /var/tmp/to_scwrl_71823211.seq -o /var/tmp/from_scwrl_71823211.pdb > /var/tmp/scwrl_71823211.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_71823211.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 T0293 can't currently be optimized by undertaker # naming current conformation FORTE2_AL5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_260920844.pdb -s /var/tmp/to_scwrl_260920844.seq -o /var/tmp/from_scwrl_260920844.pdb > /var/tmp/scwrl_260920844.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_260920844.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 246 # copying to AlignedFragments data structure # naming current conformation FPSOLVER-SERVER_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_2121195545.pdb -s /var/tmp/to_scwrl_2121195545.seq -o /var/tmp/from_scwrl_2121195545.pdb > /var/tmp/scwrl_2121195545.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2121195545.pdb # conformation set from SCWRL output # naming current conformation FPSOLVER-SERVER_TS1-scwrl # ReadConformPDB reading from PDB file servers/FUGMOD_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # naming current conformation FUGMOD_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_128490132.pdb -s /var/tmp/to_scwrl_128490132.seq -o /var/tmp/from_scwrl_128490132.pdb > /var/tmp/scwrl_128490132.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_128490132.pdb # conformation set from SCWRL output # naming current conformation FUGMOD_TS1-scwrl # ReadConformPDB reading from PDB file servers/FUGMOD_TS2.pdb.gz looking for model 1 # Found a chain break before 220 # copying to AlignedFragments data structure # naming current conformation FUGMOD_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1671288007.pdb -s /var/tmp/to_scwrl_1671288007.seq -o /var/tmp/from_scwrl_1671288007.pdb > /var/tmp/scwrl_1671288007.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1671288007.pdb # conformation set from SCWRL output # naming current conformation FUGMOD_TS2-scwrl # ReadConformPDB reading from PDB file servers/FUGMOD_TS3.pdb.gz looking for model 1 # Found a chain break before 136 # copying to AlignedFragments data structure # naming current conformation FUGMOD_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_664706688.pdb -s /var/tmp/to_scwrl_664706688.seq -o /var/tmp/from_scwrl_664706688.pdb > /var/tmp/scwrl_664706688.log sh: line 1: 13287 Killed scwrl3 -i /var/tmp/to_scwrl_664706688.pdb -s /var/tmp/to_scwrl_664706688.seq -o /var/tmp/from_scwrl_664706688.pdb >/var/tmp/scwrl_664706688.log Error: Couldn't open file /var/tmp/from_scwrl_664706688.pdb or /var/tmp/from_scwrl_664706688.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_664706688_b.pdb or decoys//var/tmp/from_scwrl_664706688_b.pdb.gz for input Trying /var/tmp/from_scwrl_664706688_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_664706688_b.pdb or /var/tmp/from_scwrl_664706688_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_664706688_a.pdb or decoys//var/tmp/from_scwrl_664706688_a.pdb.gz for input Trying /var/tmp/from_scwrl_664706688_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_664706688_a.pdb or /var/tmp/from_scwrl_664706688_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_664706688.pdb or /var/tmp/from_scwrl_664706688_b.pdb or /var/tmp/from_scwrl_664706688_a.pdb Error: no new SCWRL conformation added # naming current conformation FUGMOD_TS3-scwrl # ReadConformPDB reading from PDB file servers/FUGMOD_TS4.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # naming current conformation FUGMOD_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_27949459.pdb -s /var/tmp/to_scwrl_27949459.seq -o /var/tmp/from_scwrl_27949459.pdb > /var/tmp/scwrl_27949459.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_27949459.pdb # conformation set from SCWRL output # naming current conformation FUGMOD_TS4-scwrl # ReadConformPDB reading from PDB file servers/FUGMOD_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # naming current conformation FUGMOD_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1011245979.pdb -s /var/tmp/to_scwrl_1011245979.seq -o /var/tmp/from_scwrl_1011245979.pdb > /var/tmp/scwrl_1011245979.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1011245979.pdb # conformation set from SCWRL output # naming current conformation FUGMOD_TS5-scwrl # ReadConformPDB reading from PDB file servers/FUGUE_AL1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # naming current conformation FUGUE_AL1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_142027752.pdb -s /var/tmp/to_scwrl_142027752.seq -o /var/tmp/from_scwrl_142027752.pdb > /var/tmp/scwrl_142027752.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_142027752.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 T0293 can't currently be optimized by undertaker # naming current conformation FUGUE_AL2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1519430882.pdb -s /var/tmp/to_scwrl_1519430882.seq -o /var/tmp/from_scwrl_1519430882.pdb > /var/tmp/scwrl_1519430882.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1519430882.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 T0293 can't currently be optimized by undertaker # naming current conformation FUGUE_AL3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1305579743.pdb -s /var/tmp/to_scwrl_1305579743.seq -o /var/tmp/from_scwrl_1305579743.pdb > /var/tmp/scwrl_1305579743.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1305579743.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 T0293 can't currently be optimized by undertaker # naming current conformation FUGUE_AL4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1449803391.pdb -s /var/tmp/to_scwrl_1449803391.seq -o /var/tmp/from_scwrl_1449803391.pdb > /var/tmp/scwrl_1449803391.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1449803391.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 T0293 can't currently be optimized by undertaker # naming current conformation FUGUE_AL5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_804393551.pdb -s /var/tmp/to_scwrl_804393551.seq -o /var/tmp/from_scwrl_804393551.pdb > /var/tmp/scwrl_804393551.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_804393551.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 # Found a chain break before 249 # copying to AlignedFragments data structure # naming current conformation FUNCTION_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_424814423.pdb -s /var/tmp/to_scwrl_424814423.seq -o /var/tmp/from_scwrl_424814423.pdb > /var/tmp/scwrl_424814423.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_424814423.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 # Found a chain break before 249 # copying to AlignedFragments data structure # naming current conformation FUNCTION_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1513814119.pdb -s /var/tmp/to_scwrl_1513814119.seq -o /var/tmp/from_scwrl_1513814119.pdb > /var/tmp/scwrl_1513814119.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1513814119.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 243 # copying to AlignedFragments data structure # naming current conformation FUNCTION_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_154475853.pdb -s /var/tmp/to_scwrl_154475853.seq -o /var/tmp/from_scwrl_154475853.pdb > /var/tmp/scwrl_154475853.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_154475853.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 249 # copying to AlignedFragments data structure # naming current conformation FUNCTION_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_824376700.pdb -s /var/tmp/to_scwrl_824376700.seq -o /var/tmp/from_scwrl_824376700.pdb > /var/tmp/scwrl_824376700.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_824376700.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 235 # copying to AlignedFragments data structure # naming current conformation FUNCTION_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_492207081.pdb -s /var/tmp/to_scwrl_492207081.seq -o /var/tmp/from_scwrl_492207081.pdb > /var/tmp/scwrl_492207081.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_492207081.pdb # conformation set from SCWRL output # naming current conformation FUNCTION_TS5-scwrl # ReadConformPDB reading from PDB file servers/GeneSilicoMetaServer_TS1.pdb.gz looking for model 1 # Found a chain break before 87 # copying to AlignedFragments data structure # naming current conformation GeneSilicoMetaServer_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_378831363.pdb -s /var/tmp/to_scwrl_378831363.seq -o /var/tmp/from_scwrl_378831363.pdb > /var/tmp/scwrl_378831363.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_378831363.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 # Found a chain break before 187 # copying to AlignedFragments data structure # naming current conformation GeneSilicoMetaServer_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_966355325.pdb -s /var/tmp/to_scwrl_966355325.seq -o /var/tmp/from_scwrl_966355325.pdb > /var/tmp/scwrl_966355325.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_966355325.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 # Found a chain break before 244 # copying to AlignedFragments data structure # naming current conformation GeneSilicoMetaServer_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_177236284.pdb -s /var/tmp/to_scwrl_177236284.seq -o /var/tmp/from_scwrl_177236284.pdb > /var/tmp/scwrl_177236284.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_177236284.pdb # conformation set from SCWRL output # naming current conformation GeneSilicoMetaServer_TS3-scwrl # ReadConformPDB reading from PDB file servers/GeneSilicoMetaServer_TS5.pdb.gz looking for model 1 # Found a chain break before 240 # copying to AlignedFragments data structure # naming current conformation GeneSilicoMetaServer_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1139206400.pdb -s /var/tmp/to_scwrl_1139206400.seq -o /var/tmp/from_scwrl_1139206400.pdb > /var/tmp/scwrl_1139206400.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1139206400.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 225 ; scwrl3 -i /var/tmp/to_scwrl_1916160709.pdb -s /var/tmp/to_scwrl_1916160709.seq -o /var/tmp/from_scwrl_1916160709.pdb > /var/tmp/scwrl_1916160709.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1916160709.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 177 # copying to AlignedFragments data structure # naming current conformation HHpred2_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_472483828.pdb -s /var/tmp/to_scwrl_472483828.seq -o /var/tmp/from_scwrl_472483828.pdb > /var/tmp/scwrl_472483828.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_472483828.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 85 # copying to AlignedFragments data structure # naming current conformation HHpred3_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_551117576.pdb -s /var/tmp/to_scwrl_551117576.seq -o /var/tmp/from_scwrl_551117576.pdb > /var/tmp/scwrl_551117576.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_551117576.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 T0293 can't currently be optimized by undertaker # naming current conformation Huber-Torda-Server_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1485282518.pdb -s /var/tmp/to_scwrl_1485282518.seq -o /var/tmp/from_scwrl_1485282518.pdb > /var/tmp/scwrl_1485282518.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1485282518.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 T0293 can't currently be optimized by undertaker # naming current conformation Huber-Torda-Server_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1567681664.pdb -s /var/tmp/to_scwrl_1567681664.seq -o /var/tmp/from_scwrl_1567681664.pdb > /var/tmp/scwrl_1567681664.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1567681664.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 T0293 can't currently be optimized by undertaker # naming current conformation Huber-Torda-Server_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_47494744.pdb -s /var/tmp/to_scwrl_47494744.seq -o /var/tmp/from_scwrl_47494744.pdb > /var/tmp/scwrl_47494744.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_47494744.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 T0293 can't currently be optimized by undertaker # naming current conformation Huber-Torda-Server_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1562991107.pdb -s /var/tmp/to_scwrl_1562991107.seq -o /var/tmp/from_scwrl_1562991107.pdb > /var/tmp/scwrl_1562991107.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1562991107.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 T0293 can't currently be optimized by undertaker # naming current conformation Huber-Torda-Server_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_788079791.pdb -s /var/tmp/to_scwrl_788079791.seq -o /var/tmp/from_scwrl_788079791.pdb > /var/tmp/scwrl_788079791.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_788079791.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 T0293 can't currently be optimized by undertaker # naming current conformation LOOPP_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_971816034.pdb -s /var/tmp/to_scwrl_971816034.seq -o /var/tmp/from_scwrl_971816034.pdb > /var/tmp/scwrl_971816034.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_971816034.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 T0293 can't currently be optimized by undertaker # naming current conformation LOOPP_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1634814318.pdb -s /var/tmp/to_scwrl_1634814318.seq -o /var/tmp/from_scwrl_1634814318.pdb > /var/tmp/scwrl_1634814318.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1634814318.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 T0293 can't currently be optimized by undertaker # naming current conformation LOOPP_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1049000635.pdb -s /var/tmp/to_scwrl_1049000635.seq -o /var/tmp/from_scwrl_1049000635.pdb > /var/tmp/scwrl_1049000635.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1049000635.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 T0293 can't currently be optimized by undertaker # naming current conformation LOOPP_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_945527932.pdb -s /var/tmp/to_scwrl_945527932.seq -o /var/tmp/from_scwrl_945527932.pdb > /var/tmp/scwrl_945527932.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_945527932.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 T0293 can't currently be optimized by undertaker # naming current conformation LOOPP_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1763304450.pdb -s /var/tmp/to_scwrl_1763304450.seq -o /var/tmp/from_scwrl_1763304450.pdb > /var/tmp/scwrl_1763304450.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1763304450.pdb # conformation set from SCWRL output # naming current conformation LOOPP_TS5-scwrl # ReadConformPDB reading from PDB file servers/Ma-OPUS-server_TS1.pdb.gz looking for model 1 # Found a chain break before 245 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_572804995.pdb -s /var/tmp/to_scwrl_572804995.seq -o /var/tmp/from_scwrl_572804995.pdb > /var/tmp/scwrl_572804995.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_572804995.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 244 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1610234620.pdb -s /var/tmp/to_scwrl_1610234620.seq -o /var/tmp/from_scwrl_1610234620.pdb > /var/tmp/scwrl_1610234620.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1610234620.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 178 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1791253910.pdb -s /var/tmp/to_scwrl_1791253910.seq -o /var/tmp/from_scwrl_1791253910.pdb > /var/tmp/scwrl_1791253910.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1791253910.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 203 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1584050974.pdb -s /var/tmp/to_scwrl_1584050974.seq -o /var/tmp/from_scwrl_1584050974.pdb > /var/tmp/scwrl_1584050974.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1584050974.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 240 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1752262372.pdb -s /var/tmp/to_scwrl_1752262372.seq -o /var/tmp/from_scwrl_1752262372.pdb > /var/tmp/scwrl_1752262372.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1752262372.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 243 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1163201145.pdb -s /var/tmp/to_scwrl_1163201145.seq -o /var/tmp/from_scwrl_1163201145.pdb > /var/tmp/scwrl_1163201145.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1163201145.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 248 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_742147071.pdb -s /var/tmp/to_scwrl_742147071.seq -o /var/tmp/from_scwrl_742147071.pdb > /var/tmp/scwrl_742147071.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_742147071.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 246 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1054582118.pdb -s /var/tmp/to_scwrl_1054582118.seq -o /var/tmp/from_scwrl_1054582118.pdb > /var/tmp/scwrl_1054582118.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1054582118.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 249 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1967594696.pdb -s /var/tmp/to_scwrl_1967594696.seq -o /var/tmp/from_scwrl_1967594696.pdb > /var/tmp/scwrl_1967594696.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1967594696.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 248 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1166961494.pdb -s /var/tmp/to_scwrl_1166961494.seq -o /var/tmp/from_scwrl_1166961494.pdb > /var/tmp/scwrl_1166961494.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1166961494.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 # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # naming current conformation NN_PUT_lab_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_420912590.pdb -s /var/tmp/to_scwrl_420912590.seq -o /var/tmp/from_scwrl_420912590.pdb > /var/tmp/scwrl_420912590.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_420912590.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 247 # copying to AlignedFragments data structure # naming current conformation POMYSL_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_2122070549.pdb -s /var/tmp/to_scwrl_2122070549.seq -o /var/tmp/from_scwrl_2122070549.pdb > /var/tmp/scwrl_2122070549.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2122070549.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 # Found a chain break before 247 # copying to AlignedFragments data structure # naming current conformation POMYSL_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1991338194.pdb -s /var/tmp/to_scwrl_1991338194.seq -o /var/tmp/from_scwrl_1991338194.pdb > /var/tmp/scwrl_1991338194.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1991338194.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 244 # copying to AlignedFragments data structure # naming current conformation POMYSL_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_913119671.pdb -s /var/tmp/to_scwrl_913119671.seq -o /var/tmp/from_scwrl_913119671.pdb > /var/tmp/scwrl_913119671.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_913119671.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 248 # copying to AlignedFragments data structure # naming current conformation POMYSL_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_353418265.pdb -s /var/tmp/to_scwrl_353418265.seq -o /var/tmp/from_scwrl_353418265.pdb > /var/tmp/scwrl_353418265.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_353418265.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 # Found a chain break before 243 # copying to AlignedFragments data structure # naming current conformation POMYSL_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_810209873.pdb -s /var/tmp/to_scwrl_810209873.seq -o /var/tmp/from_scwrl_810209873.pdb > /var/tmp/scwrl_810209873.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_810209873.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 225 ; scwrl3 -i /var/tmp/to_scwrl_1090355954.pdb -s /var/tmp/to_scwrl_1090355954.seq -o /var/tmp/from_scwrl_1090355954.pdb > /var/tmp/scwrl_1090355954.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1090355954.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 225 ; scwrl3 -i /var/tmp/to_scwrl_1492624665.pdb -s /var/tmp/to_scwrl_1492624665.seq -o /var/tmp/from_scwrl_1492624665.pdb > /var/tmp/scwrl_1492624665.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1492624665.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 225 ; scwrl3 -i /var/tmp/to_scwrl_578886935.pdb -s /var/tmp/to_scwrl_578886935.seq -o /var/tmp/from_scwrl_578886935.pdb > /var/tmp/scwrl_578886935.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_578886935.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 225 ; scwrl3 -i /var/tmp/to_scwrl_1562839783.pdb -s /var/tmp/to_scwrl_1562839783.seq -o /var/tmp/from_scwrl_1562839783.pdb > /var/tmp/scwrl_1562839783.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1562839783.pdb # conformation set from SCWRL output # naming current conformation PROTINFO-AB_TS4-scwrl # ReadConformPDB reading from PDB file servers/PROTINFO_TS1.pdb.gz looking for model 1 # Found a chain break before 226 # copying to AlignedFragments data structure # naming current conformation PROTINFO_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_2043742241.pdb -s /var/tmp/to_scwrl_2043742241.seq -o /var/tmp/from_scwrl_2043742241.pdb > /var/tmp/scwrl_2043742241.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2043742241.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 # Found a chain break before 226 # copying to AlignedFragments data structure # naming current conformation PROTINFO_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_2064169453.pdb -s /var/tmp/to_scwrl_2064169453.seq -o /var/tmp/from_scwrl_2064169453.pdb > /var/tmp/scwrl_2064169453.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2064169453.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 # Found a chain break before 232 # copying to AlignedFragments data structure # naming current conformation PROTINFO_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_983037801.pdb -s /var/tmp/to_scwrl_983037801.seq -o /var/tmp/from_scwrl_983037801.pdb > /var/tmp/scwrl_983037801.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_983037801.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 # Found a chain break before 226 # copying to AlignedFragments data structure # naming current conformation PROTINFO_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_2091236986.pdb -s /var/tmp/to_scwrl_2091236986.seq -o /var/tmp/from_scwrl_2091236986.pdb > /var/tmp/scwrl_2091236986.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2091236986.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 # Found a chain break before 235 # copying to AlignedFragments data structure # naming current conformation PROTINFO_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1479676913.pdb -s /var/tmp/to_scwrl_1479676913.seq -o /var/tmp/from_scwrl_1479676913.pdb > /var/tmp/scwrl_1479676913.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1479676913.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 T0293 can't currently be optimized by undertaker # naming current conformation Pcons6_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1771117591.pdb -s /var/tmp/to_scwrl_1771117591.seq -o /var/tmp/from_scwrl_1771117591.pdb > /var/tmp/scwrl_1771117591.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1771117591.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 T0293 can't currently be optimized by undertaker # naming current conformation Pcons6_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_915569373.pdb -s /var/tmp/to_scwrl_915569373.seq -o /var/tmp/from_scwrl_915569373.pdb > /var/tmp/scwrl_915569373.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_915569373.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 T0293 can't currently be optimized by undertaker # naming current conformation Pcons6_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_967007585.pdb -s /var/tmp/to_scwrl_967007585.seq -o /var/tmp/from_scwrl_967007585.pdb > /var/tmp/scwrl_967007585.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_967007585.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 T0293 can't currently be optimized by undertaker # naming current conformation Pcons6_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_672634579.pdb -s /var/tmp/to_scwrl_672634579.seq -o /var/tmp/from_scwrl_672634579.pdb > /var/tmp/scwrl_672634579.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_672634579.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 T0293 can't currently be optimized by undertaker # naming current conformation Pcons6_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1861097304.pdb -s /var/tmp/to_scwrl_1861097304.seq -o /var/tmp/from_scwrl_1861097304.pdb > /var/tmp/scwrl_1861097304.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1861097304.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 T0293 can't currently be optimized by undertaker # naming current conformation Phyre-1_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_582828389.pdb -s /var/tmp/to_scwrl_582828389.seq -o /var/tmp/from_scwrl_582828389.pdb > /var/tmp/scwrl_582828389.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_582828389.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 T0293 can't currently be optimized by undertaker # naming current conformation Phyre-2_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1245439574.pdb -s /var/tmp/to_scwrl_1245439574.seq -o /var/tmp/from_scwrl_1245439574.pdb > /var/tmp/scwrl_1245439574.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1245439574.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 T0293 can't currently be optimized by undertaker # naming current conformation Phyre-2_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1323848277.pdb -s /var/tmp/to_scwrl_1323848277.seq -o /var/tmp/from_scwrl_1323848277.pdb > /var/tmp/scwrl_1323848277.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1323848277.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 T0293 can't currently be optimized by undertaker # naming current conformation Phyre-2_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_226598652.pdb -s /var/tmp/to_scwrl_226598652.seq -o /var/tmp/from_scwrl_226598652.pdb > /var/tmp/scwrl_226598652.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_226598652.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 T0293 can't currently be optimized by undertaker # naming current conformation Phyre-2_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_682006902.pdb -s /var/tmp/to_scwrl_682006902.seq -o /var/tmp/from_scwrl_682006902.pdb > /var/tmp/scwrl_682006902.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_682006902.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 T0293 can't currently be optimized by undertaker # naming current conformation Phyre-2_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_928627004.pdb -s /var/tmp/to_scwrl_928627004.seq -o /var/tmp/from_scwrl_928627004.pdb > /var/tmp/scwrl_928627004.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_928627004.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 212 # copying to AlignedFragments data structure # naming current conformation Pmodeller6_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1389799797.pdb -s /var/tmp/to_scwrl_1389799797.seq -o /var/tmp/from_scwrl_1389799797.pdb > /var/tmp/scwrl_1389799797.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1389799797.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 # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # naming current conformation Pmodeller6_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1424153972.pdb -s /var/tmp/to_scwrl_1424153972.seq -o /var/tmp/from_scwrl_1424153972.pdb > /var/tmp/scwrl_1424153972.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1424153972.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 # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # naming current conformation Pmodeller6_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1983209121.pdb -s /var/tmp/to_scwrl_1983209121.seq -o /var/tmp/from_scwrl_1983209121.pdb > /var/tmp/scwrl_1983209121.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1983209121.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 T0293 can't currently be optimized by undertaker # naming current conformation Pmodeller6_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1209910847.pdb -s /var/tmp/to_scwrl_1209910847.seq -o /var/tmp/from_scwrl_1209910847.pdb > /var/tmp/scwrl_1209910847.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1209910847.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 T0293 can't currently be optimized by undertaker # naming current conformation Pmodeller6_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_443631820.pdb -s /var/tmp/to_scwrl_443631820.seq -o /var/tmp/from_scwrl_443631820.pdb > /var/tmp/scwrl_443631820.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_443631820.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 237 # copying to AlignedFragments data structure # naming current conformation RAPTOR-ACE_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_256638064.pdb -s /var/tmp/to_scwrl_256638064.seq -o /var/tmp/from_scwrl_256638064.pdb > /var/tmp/scwrl_256638064.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_256638064.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 175 # copying to AlignedFragments data structure # naming current conformation RAPTOR-ACE_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1184497749.pdb -s /var/tmp/to_scwrl_1184497749.seq -o /var/tmp/from_scwrl_1184497749.pdb > /var/tmp/scwrl_1184497749.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1184497749.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 # Found a chain break before 241 # copying to AlignedFragments data structure # naming current conformation RAPTOR-ACE_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_287486368.pdb -s /var/tmp/to_scwrl_287486368.seq -o /var/tmp/from_scwrl_287486368.pdb > /var/tmp/scwrl_287486368.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_287486368.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 198 # copying to AlignedFragments data structure # naming current conformation RAPTOR-ACE_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1169757734.pdb -s /var/tmp/to_scwrl_1169757734.seq -o /var/tmp/from_scwrl_1169757734.pdb > /var/tmp/scwrl_1169757734.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1169757734.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 # Found a chain break before 236 # copying to AlignedFragments data structure # naming current conformation RAPTOR-ACE_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1537916015.pdb -s /var/tmp/to_scwrl_1537916015.seq -o /var/tmp/from_scwrl_1537916015.pdb > /var/tmp/scwrl_1537916015.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1537916015.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 227 # copying to AlignedFragments data structure # naming current conformation RAPTORESS_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1097696240.pdb -s /var/tmp/to_scwrl_1097696240.seq -o /var/tmp/from_scwrl_1097696240.pdb > /var/tmp/scwrl_1097696240.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1097696240.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 # Found a chain break before 143 # copying to AlignedFragments data structure # naming current conformation RAPTORESS_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_112630042.pdb -s /var/tmp/to_scwrl_112630042.seq -o /var/tmp/from_scwrl_112630042.pdb > /var/tmp/scwrl_112630042.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_112630042.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 185 # copying to AlignedFragments data structure # naming current conformation RAPTORESS_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_883057034.pdb -s /var/tmp/to_scwrl_883057034.seq -o /var/tmp/from_scwrl_883057034.pdb > /var/tmp/scwrl_883057034.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_883057034.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 182 # copying to AlignedFragments data structure # naming current conformation RAPTORESS_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1676583175.pdb -s /var/tmp/to_scwrl_1676583175.seq -o /var/tmp/from_scwrl_1676583175.pdb > /var/tmp/scwrl_1676583175.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1676583175.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 # Found a chain break before 239 # copying to AlignedFragments data structure # naming current conformation RAPTORESS_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1675469825.pdb -s /var/tmp/to_scwrl_1675469825.seq -o /var/tmp/from_scwrl_1675469825.pdb > /var/tmp/scwrl_1675469825.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1675469825.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 198 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_779315629.pdb -s /var/tmp/to_scwrl_779315629.seq -o /var/tmp/from_scwrl_779315629.pdb > /var/tmp/scwrl_779315629.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_779315629.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 198 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1593268982.pdb -s /var/tmp/to_scwrl_1593268982.seq -o /var/tmp/from_scwrl_1593268982.pdb > /var/tmp/scwrl_1593268982.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1593268982.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 245 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_511023979.pdb -s /var/tmp/to_scwrl_511023979.seq -o /var/tmp/from_scwrl_511023979.pdb > /var/tmp/scwrl_511023979.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_511023979.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 68 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_723068968.pdb -s /var/tmp/to_scwrl_723068968.seq -o /var/tmp/from_scwrl_723068968.pdb > /var/tmp/scwrl_723068968.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_723068968.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 195 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_925462249.pdb -s /var/tmp/to_scwrl_925462249.seq -o /var/tmp/from_scwrl_925462249.pdb > /var/tmp/scwrl_925462249.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_925462249.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 212 # copying to AlignedFragments data structure # naming current conformation ROBETTA_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_134657923.pdb -s /var/tmp/to_scwrl_134657923.seq -o /var/tmp/from_scwrl_134657923.pdb > /var/tmp/scwrl_134657923.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_134657923.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 239 # copying to AlignedFragments data structure # naming current conformation ROBETTA_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1638638340.pdb -s /var/tmp/to_scwrl_1638638340.seq -o /var/tmp/from_scwrl_1638638340.pdb > /var/tmp/scwrl_1638638340.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1638638340.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 233 # copying to AlignedFragments data structure # naming current conformation ROBETTA_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1892469834.pdb -s /var/tmp/to_scwrl_1892469834.seq -o /var/tmp/from_scwrl_1892469834.pdb > /var/tmp/scwrl_1892469834.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1892469834.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 212 # copying to AlignedFragments data structure # naming current conformation ROBETTA_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_807292503.pdb -s /var/tmp/to_scwrl_807292503.seq -o /var/tmp/from_scwrl_807292503.pdb > /var/tmp/scwrl_807292503.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_807292503.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 230 # copying to AlignedFragments data structure # naming current conformation ROBETTA_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1352251997.pdb -s /var/tmp/to_scwrl_1352251997.seq -o /var/tmp/from_scwrl_1352251997.pdb > /var/tmp/scwrl_1352251997.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1352251997.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 239 # copying to AlignedFragments data structure # naming current conformation ROKKY_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_327814576.pdb -s /var/tmp/to_scwrl_327814576.seq -o /var/tmp/from_scwrl_327814576.pdb > /var/tmp/scwrl_327814576.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_327814576.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 148 # copying to AlignedFragments data structure # naming current conformation ROKKY_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_2052732077.pdb -s /var/tmp/to_scwrl_2052732077.seq -o /var/tmp/from_scwrl_2052732077.pdb > /var/tmp/scwrl_2052732077.log sh: line 1: 14252 Killed scwrl3 -i /var/tmp/to_scwrl_2052732077.pdb -s /var/tmp/to_scwrl_2052732077.seq -o /var/tmp/from_scwrl_2052732077.pdb >/var/tmp/scwrl_2052732077.log Error: Couldn't open file /var/tmp/from_scwrl_2052732077.pdb or /var/tmp/from_scwrl_2052732077.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2052732077_b.pdb or decoys//var/tmp/from_scwrl_2052732077_b.pdb.gz for input Trying /var/tmp/from_scwrl_2052732077_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_2052732077_b.pdb or /var/tmp/from_scwrl_2052732077_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2052732077_a.pdb or decoys//var/tmp/from_scwrl_2052732077_a.pdb.gz for input Trying /var/tmp/from_scwrl_2052732077_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_2052732077_a.pdb or /var/tmp/from_scwrl_2052732077_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_2052732077.pdb or /var/tmp/from_scwrl_2052732077_b.pdb or /var/tmp/from_scwrl_2052732077_a.pdb Error: no new SCWRL conformation added # 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 246 # copying to AlignedFragments data structure # naming current conformation ROKKY_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_528616629.pdb -s /var/tmp/to_scwrl_528616629.seq -o /var/tmp/from_scwrl_528616629.pdb > /var/tmp/scwrl_528616629.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_528616629.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 245 # copying to AlignedFragments data structure # naming current conformation ROKKY_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_554413228.pdb -s /var/tmp/to_scwrl_554413228.seq -o /var/tmp/from_scwrl_554413228.pdb > /var/tmp/scwrl_554413228.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_554413228.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 244 # copying to AlignedFragments data structure # naming current conformation ROKKY_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_587255332.pdb -s /var/tmp/to_scwrl_587255332.seq -o /var/tmp/from_scwrl_587255332.pdb > /var/tmp/scwrl_587255332.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_587255332.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 T0293 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1457243632.pdb -s /var/tmp/to_scwrl_1457243632.seq -o /var/tmp/from_scwrl_1457243632.pdb > /var/tmp/scwrl_1457243632.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1457243632.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 T0293 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1944213025.pdb -s /var/tmp/to_scwrl_1944213025.seq -o /var/tmp/from_scwrl_1944213025.pdb > /var/tmp/scwrl_1944213025.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1944213025.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 T0293 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_2011409304.pdb -s /var/tmp/to_scwrl_2011409304.seq -o /var/tmp/from_scwrl_2011409304.pdb > /var/tmp/scwrl_2011409304.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2011409304.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 T0293 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1292969106.pdb -s /var/tmp/to_scwrl_1292969106.seq -o /var/tmp/from_scwrl_1292969106.pdb > /var/tmp/scwrl_1292969106.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1292969106.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 T0293 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1006640226.pdb -s /var/tmp/to_scwrl_1006640226.seq -o /var/tmp/from_scwrl_1006640226.pdb > /var/tmp/scwrl_1006640226.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1006640226.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 T0293 can't currently be optimized by undertaker # naming current conformation SAM-T99_AL1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_307557478.pdb -s /var/tmp/to_scwrl_307557478.seq -o /var/tmp/from_scwrl_307557478.pdb > /var/tmp/scwrl_307557478.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_307557478.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 T0293 can't currently be optimized by undertaker # naming current conformation SAM-T99_AL2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1549607170.pdb -s /var/tmp/to_scwrl_1549607170.seq -o /var/tmp/from_scwrl_1549607170.pdb > /var/tmp/scwrl_1549607170.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1549607170.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 T0293 can't currently be optimized by undertaker # naming current conformation SAM-T99_AL3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_43654329.pdb -s /var/tmp/to_scwrl_43654329.seq -o /var/tmp/from_scwrl_43654329.pdb > /var/tmp/scwrl_43654329.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_43654329.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 T0293 can't currently be optimized by undertaker # naming current conformation SAM-T99_AL4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_595043846.pdb -s /var/tmp/to_scwrl_595043846.seq -o /var/tmp/from_scwrl_595043846.pdb > /var/tmp/scwrl_595043846.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_595043846.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 T0293 can't currently be optimized by undertaker # naming current conformation SAM-T99_AL5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_571881258.pdb -s /var/tmp/to_scwrl_571881258.seq -o /var/tmp/from_scwrl_571881258.pdb > /var/tmp/scwrl_571881258.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_571881258.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 242 # copying to AlignedFragments data structure # naming current conformation SAM_T06_server_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1581570344.pdb -s /var/tmp/to_scwrl_1581570344.seq -o /var/tmp/from_scwrl_1581570344.pdb > /var/tmp/scwrl_1581570344.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1581570344.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 T0293 can't currently be optimized by undertaker # naming current conformation SAM_T06_server_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1692740086.pdb -s /var/tmp/to_scwrl_1692740086.seq -o /var/tmp/from_scwrl_1692740086.pdb > /var/tmp/scwrl_1692740086.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1692740086.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 T0293 can't currently be optimized by undertaker # naming current conformation SAM_T06_server_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_684511300.pdb -s /var/tmp/to_scwrl_684511300.seq -o /var/tmp/from_scwrl_684511300.pdb > /var/tmp/scwrl_684511300.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_684511300.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 T0293 can't currently be optimized by undertaker # naming current conformation SAM_T06_server_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_317143731.pdb -s /var/tmp/to_scwrl_317143731.seq -o /var/tmp/from_scwrl_317143731.pdb > /var/tmp/scwrl_317143731.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_317143731.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 T0293 can't currently be optimized by undertaker # naming current conformation SAM_T06_server_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1221839614.pdb -s /var/tmp/to_scwrl_1221839614.seq -o /var/tmp/from_scwrl_1221839614.pdb > /var/tmp/scwrl_1221839614.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1221839614.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 198 # copying to AlignedFragments data structure # naming current conformation SP3_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_212497479.pdb -s /var/tmp/to_scwrl_212497479.seq -o /var/tmp/from_scwrl_212497479.pdb > /var/tmp/scwrl_212497479.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_212497479.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 121 # copying to AlignedFragments data structure # naming current conformation SP3_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1096459359.pdb -s /var/tmp/to_scwrl_1096459359.seq -o /var/tmp/from_scwrl_1096459359.pdb > /var/tmp/scwrl_1096459359.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1096459359.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 209 # copying to AlignedFragments data structure # naming current conformation SP3_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_667624950.pdb -s /var/tmp/to_scwrl_667624950.seq -o /var/tmp/from_scwrl_667624950.pdb > /var/tmp/scwrl_667624950.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_667624950.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 249 # copying to AlignedFragments data structure # naming current conformation SP3_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_723521458.pdb -s /var/tmp/to_scwrl_723521458.seq -o /var/tmp/from_scwrl_723521458.pdb > /var/tmp/scwrl_723521458.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_723521458.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 # Found a chain break before 204 # copying to AlignedFragments data structure # naming current conformation SP3_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1819528327.pdb -s /var/tmp/to_scwrl_1819528327.seq -o /var/tmp/from_scwrl_1819528327.pdb > /var/tmp/scwrl_1819528327.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1819528327.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 198 # copying to AlignedFragments data structure # naming current conformation SP4_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1593087199.pdb -s /var/tmp/to_scwrl_1593087199.seq -o /var/tmp/from_scwrl_1593087199.pdb > /var/tmp/scwrl_1593087199.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1593087199.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 195 # copying to AlignedFragments data structure # naming current conformation SP4_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_858179382.pdb -s /var/tmp/to_scwrl_858179382.seq -o /var/tmp/from_scwrl_858179382.pdb > /var/tmp/scwrl_858179382.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_858179382.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 239 # copying to AlignedFragments data structure # naming current conformation SP4_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1310683020.pdb -s /var/tmp/to_scwrl_1310683020.seq -o /var/tmp/from_scwrl_1310683020.pdb > /var/tmp/scwrl_1310683020.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1310683020.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 247 # copying to AlignedFragments data structure # naming current conformation SP4_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1338073386.pdb -s /var/tmp/to_scwrl_1338073386.seq -o /var/tmp/from_scwrl_1338073386.pdb > /var/tmp/scwrl_1338073386.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1338073386.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 225 ; scwrl3 -i /var/tmp/to_scwrl_1665471884.pdb -s /var/tmp/to_scwrl_1665471884.seq -o /var/tmp/from_scwrl_1665471884.pdb > /var/tmp/scwrl_1665471884.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1665471884.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 233 # copying to AlignedFragments data structure # naming current conformation SPARKS2_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_515451372.pdb -s /var/tmp/to_scwrl_515451372.seq -o /var/tmp/from_scwrl_515451372.pdb > /var/tmp/scwrl_515451372.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_515451372.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 222 # copying to AlignedFragments data structure # naming current conformation SPARKS2_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1665887962.pdb -s /var/tmp/to_scwrl_1665887962.seq -o /var/tmp/from_scwrl_1665887962.pdb > /var/tmp/scwrl_1665887962.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1665887962.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 # Found a chain break before 90 # copying to AlignedFragments data structure # naming current conformation SPARKS2_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1570720314.pdb -s /var/tmp/to_scwrl_1570720314.seq -o /var/tmp/from_scwrl_1570720314.pdb > /var/tmp/scwrl_1570720314.log sh: line 1: 14428 Killed scwrl3 -i /var/tmp/to_scwrl_1570720314.pdb -s /var/tmp/to_scwrl_1570720314.seq -o /var/tmp/from_scwrl_1570720314.pdb >/var/tmp/scwrl_1570720314.log Error: Couldn't open file /var/tmp/from_scwrl_1570720314.pdb or /var/tmp/from_scwrl_1570720314.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1570720314_b.pdb or decoys//var/tmp/from_scwrl_1570720314_b.pdb.gz for input Trying /var/tmp/from_scwrl_1570720314_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1570720314_b.pdb or /var/tmp/from_scwrl_1570720314_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1570720314_a.pdb or decoys//var/tmp/from_scwrl_1570720314_a.pdb.gz for input Trying /var/tmp/from_scwrl_1570720314_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1570720314_a.pdb or /var/tmp/from_scwrl_1570720314_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1570720314.pdb or /var/tmp/from_scwrl_1570720314_b.pdb or /var/tmp/from_scwrl_1570720314_a.pdb Error: no new SCWRL conformation added # 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 194 # copying to AlignedFragments data structure # naming current conformation SPARKS2_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1044068001.pdb -s /var/tmp/to_scwrl_1044068001.seq -o /var/tmp/from_scwrl_1044068001.pdb > /var/tmp/scwrl_1044068001.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1044068001.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 # Found a chain break before 92 # copying to AlignedFragments data structure # naming current conformation SPARKS2_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_72817543.pdb -s /var/tmp/to_scwrl_72817543.seq -o /var/tmp/from_scwrl_72817543.pdb > /var/tmp/scwrl_72817543.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_72817543.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 T0293 can't currently be optimized by undertaker # naming current conformation UNI-EID_bnmx_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_10491999.pdb -s /var/tmp/to_scwrl_10491999.seq -o /var/tmp/from_scwrl_10491999.pdb > /var/tmp/scwrl_10491999.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_10491999.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 T0293 can't currently be optimized by undertaker # naming current conformation UNI-EID_bnmx_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_353827986.pdb -s /var/tmp/to_scwrl_353827986.seq -o /var/tmp/from_scwrl_353827986.pdb > /var/tmp/scwrl_353827986.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_353827986.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 T0293 can't currently be optimized by undertaker # naming current conformation UNI-EID_bnmx_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_2017030568.pdb -s /var/tmp/to_scwrl_2017030568.seq -o /var/tmp/from_scwrl_2017030568.pdb > /var/tmp/scwrl_2017030568.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2017030568.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 T0293 can't currently be optimized by undertaker # naming current conformation UNI-EID_bnmx_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_2021901303.pdb -s /var/tmp/to_scwrl_2021901303.seq -o /var/tmp/from_scwrl_2021901303.pdb > /var/tmp/scwrl_2021901303.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2021901303.pdb # conformation set from SCWRL output # naming current conformation UNI-EID_bnmx_TS4-scwrl # ReadConformPDB reading from PDB file servers/UNI-EID_bnmx_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # naming current conformation UNI-EID_bnmx_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1646797092.pdb -s /var/tmp/to_scwrl_1646797092.seq -o /var/tmp/from_scwrl_1646797092.pdb > /var/tmp/scwrl_1646797092.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1646797092.pdb # conformation set from SCWRL output # naming current conformation UNI-EID_bnmx_TS5-scwrl # ReadConformPDB reading from PDB file servers/UNI-EID_expm_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # naming current conformation UNI-EID_expm_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_876187148.pdb -s /var/tmp/to_scwrl_876187148.seq -o /var/tmp/from_scwrl_876187148.pdb > /var/tmp/scwrl_876187148.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_876187148.pdb # conformation set from SCWRL output # 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 T0293 can't currently be optimized by undertaker # naming current conformation UNI-EID_sfst_AL1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_181975134.pdb -s /var/tmp/to_scwrl_181975134.seq -o /var/tmp/from_scwrl_181975134.pdb > /var/tmp/scwrl_181975134.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_181975134.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 T0293 can't currently be optimized by undertaker # naming current conformation UNI-EID_sfst_AL2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1048920616.pdb -s /var/tmp/to_scwrl_1048920616.seq -o /var/tmp/from_scwrl_1048920616.pdb > /var/tmp/scwrl_1048920616.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1048920616.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 T0293 can't currently be optimized by undertaker # naming current conformation UNI-EID_sfst_AL3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_919841477.pdb -s /var/tmp/to_scwrl_919841477.seq -o /var/tmp/from_scwrl_919841477.pdb > /var/tmp/scwrl_919841477.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_919841477.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 T0293 can't currently be optimized by undertaker # naming current conformation UNI-EID_sfst_AL4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_777018980.pdb -s /var/tmp/to_scwrl_777018980.seq -o /var/tmp/from_scwrl_777018980.pdb > /var/tmp/scwrl_777018980.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_777018980.pdb # conformation set from SCWRL output # naming current conformation UNI-EID_sfst_AL4-scwrl # ReadConformPDB reading from PDB file servers/UNI-EID_sfst_AL5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # naming current conformation UNI-EID_sfst_AL5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1620801873.pdb -s /var/tmp/to_scwrl_1620801873.seq -o /var/tmp/from_scwrl_1620801873.pdb > /var/tmp/scwrl_1620801873.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1620801873.pdb # conformation set from SCWRL output # naming current conformation UNI-EID_sfst_AL5-scwrl # ReadConformPDB reading from PDB file servers/Zhang-Server_TS1.pdb.gz looking for model 1 # Found a chain break before 211 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_353928174.pdb -s /var/tmp/to_scwrl_353928174.seq -o /var/tmp/from_scwrl_353928174.pdb > /var/tmp/scwrl_353928174.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_353928174.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 227 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_322275419.pdb -s /var/tmp/to_scwrl_322275419.seq -o /var/tmp/from_scwrl_322275419.pdb > /var/tmp/scwrl_322275419.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_322275419.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 240 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_157829526.pdb -s /var/tmp/to_scwrl_157829526.seq -o /var/tmp/from_scwrl_157829526.pdb > /var/tmp/scwrl_157829526.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_157829526.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 240 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_671071905.pdb -s /var/tmp/to_scwrl_671071905.seq -o /var/tmp/from_scwrl_671071905.pdb > /var/tmp/scwrl_671071905.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_671071905.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 238 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1544115034.pdb -s /var/tmp/to_scwrl_1544115034.seq -o /var/tmp/from_scwrl_1544115034.pdb > /var/tmp/scwrl_1544115034.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1544115034.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 # Found a chain break before 249 # copying to AlignedFragments data structure # naming current conformation beautshot_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_370327005.pdb -s /var/tmp/to_scwrl_370327005.seq -o /var/tmp/from_scwrl_370327005.pdb > /var/tmp/scwrl_370327005.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_370327005.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 T0293 can't currently be optimized by undertaker # naming current conformation beautshotbase_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1767531265.pdb -s /var/tmp/to_scwrl_1767531265.seq -o /var/tmp/from_scwrl_1767531265.pdb > /var/tmp/scwrl_1767531265.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1767531265.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 T0293 can't currently be optimized by undertaker # naming current conformation forecast-s_AL1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_64256337.pdb -s /var/tmp/to_scwrl_64256337.seq -o /var/tmp/from_scwrl_64256337.pdb > /var/tmp/scwrl_64256337.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_64256337.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 T0293 can't currently be optimized by undertaker # naming current conformation forecast-s_AL2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1093848463.pdb -s /var/tmp/to_scwrl_1093848463.seq -o /var/tmp/from_scwrl_1093848463.pdb > /var/tmp/scwrl_1093848463.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1093848463.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 T0293 can't currently be optimized by undertaker # naming current conformation forecast-s_AL3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1439575945.pdb -s /var/tmp/to_scwrl_1439575945.seq -o /var/tmp/from_scwrl_1439575945.pdb > /var/tmp/scwrl_1439575945.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1439575945.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 T0293 can't currently be optimized by undertaker # naming current conformation forecast-s_AL4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1657343536.pdb -s /var/tmp/to_scwrl_1657343536.seq -o /var/tmp/from_scwrl_1657343536.pdb > /var/tmp/scwrl_1657343536.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1657343536.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 T0293 can't currently be optimized by undertaker # naming current conformation forecast-s_AL5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1952027845.pdb -s /var/tmp/to_scwrl_1952027845.seq -o /var/tmp/from_scwrl_1952027845.pdb > /var/tmp/scwrl_1952027845.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1952027845.pdb # conformation set from SCWRL output # naming current conformation forecast-s_AL5-scwrl # ReadConformPDB reading from PDB file servers/gtg_AL1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # naming current conformation gtg_AL1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_602775320.pdb -s /var/tmp/to_scwrl_602775320.seq -o /var/tmp/from_scwrl_602775320.pdb > /var/tmp/scwrl_602775320.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_602775320.pdb # conformation set from SCWRL output # naming current conformation gtg_AL1-scwrl # ReadConformPDB reading from PDB file servers/gtg_AL2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # naming current conformation gtg_AL2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_847933276.pdb -s /var/tmp/to_scwrl_847933276.seq -o /var/tmp/from_scwrl_847933276.pdb > /var/tmp/scwrl_847933276.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_847933276.pdb # conformation set from SCWRL output # naming current conformation gtg_AL2-scwrl # ReadConformPDB reading from PDB file servers/gtg_AL3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # naming current conformation gtg_AL3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1470016082.pdb -s /var/tmp/to_scwrl_1470016082.seq -o /var/tmp/from_scwrl_1470016082.pdb > /var/tmp/scwrl_1470016082.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1470016082.pdb # conformation set from SCWRL output # naming current conformation gtg_AL3-scwrl # ReadConformPDB reading from PDB file servers/gtg_AL4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # naming current conformation gtg_AL4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1118226691.pdb -s /var/tmp/to_scwrl_1118226691.seq -o /var/tmp/from_scwrl_1118226691.pdb > /var/tmp/scwrl_1118226691.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1118226691.pdb # conformation set from SCWRL output # naming current conformation gtg_AL4-scwrl # ReadConformPDB reading from PDB file servers/gtg_AL5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # naming current conformation gtg_AL5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_366337591.pdb -s /var/tmp/to_scwrl_366337591.seq -o /var/tmp/from_scwrl_366337591.pdb > /var/tmp/scwrl_366337591.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_366337591.pdb # conformation set from SCWRL output # naming current conformation gtg_AL5-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv.2_TS1.pdb.gz looking for model 1 # Found a chain break before 198 # copying to AlignedFragments data structure # naming current conformation karypis.srv.2_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_893252750.pdb -s /var/tmp/to_scwrl_893252750.seq -o /var/tmp/from_scwrl_893252750.pdb > /var/tmp/scwrl_893252750.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_893252750.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 240 # copying to AlignedFragments data structure # naming current conformation karypis.srv.2_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_14811045.pdb -s /var/tmp/to_scwrl_14811045.seq -o /var/tmp/from_scwrl_14811045.pdb > /var/tmp/scwrl_14811045.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_14811045.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 # Found a chain break before 204 # copying to AlignedFragments data structure # naming current conformation karypis.srv.2_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_439155134.pdb -s /var/tmp/to_scwrl_439155134.seq -o /var/tmp/from_scwrl_439155134.pdb > /var/tmp/scwrl_439155134.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_439155134.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 245 # copying to AlignedFragments data structure # naming current conformation karypis.srv.2_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_903744749.pdb -s /var/tmp/to_scwrl_903744749.seq -o /var/tmp/from_scwrl_903744749.pdb > /var/tmp/scwrl_903744749.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_903744749.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 190 # copying to AlignedFragments data structure # naming current conformation karypis.srv.2_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_368639031.pdb -s /var/tmp/to_scwrl_368639031.seq -o /var/tmp/from_scwrl_368639031.pdb > /var/tmp/scwrl_368639031.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_368639031.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 249 # copying to AlignedFragments data structure # naming current conformation karypis.srv.4_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_308702056.pdb -s /var/tmp/to_scwrl_308702056.seq -o /var/tmp/from_scwrl_308702056.pdb > /var/tmp/scwrl_308702056.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_308702056.pdb # conformation set from SCWRL output # naming current conformation karypis.srv.4_TS1-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0293 can't currently be optimized by undertaker # naming current conformation karypis.srv_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_778162405.pdb -s /var/tmp/to_scwrl_778162405.seq -o /var/tmp/from_scwrl_778162405.pdb > /var/tmp/scwrl_778162405.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_778162405.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 T0293 can't currently be optimized by undertaker # naming current conformation karypis.srv_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_2015436123.pdb -s /var/tmp/to_scwrl_2015436123.seq -o /var/tmp/from_scwrl_2015436123.pdb > /var/tmp/scwrl_2015436123.log sh: line 1: 15044 Killed scwrl3 -i /var/tmp/to_scwrl_2015436123.pdb -s /var/tmp/to_scwrl_2015436123.seq -o /var/tmp/from_scwrl_2015436123.pdb >/var/tmp/scwrl_2015436123.log Error: Couldn't open file /var/tmp/from_scwrl_2015436123.pdb or /var/tmp/from_scwrl_2015436123.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2015436123_b.pdb or decoys//var/tmp/from_scwrl_2015436123_b.pdb.gz for input Trying /var/tmp/from_scwrl_2015436123_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_2015436123_b.pdb or /var/tmp/from_scwrl_2015436123_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2015436123_a.pdb or decoys//var/tmp/from_scwrl_2015436123_a.pdb.gz for input Trying /var/tmp/from_scwrl_2015436123_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_2015436123_a.pdb or /var/tmp/from_scwrl_2015436123_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_2015436123.pdb or /var/tmp/from_scwrl_2015436123_b.pdb or /var/tmp/from_scwrl_2015436123_a.pdb Error: no new SCWRL conformation added # 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 T0293 can't currently be optimized by undertaker # naming current conformation karypis.srv_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1184889203.pdb -s /var/tmp/to_scwrl_1184889203.seq -o /var/tmp/from_scwrl_1184889203.pdb > /var/tmp/scwrl_1184889203.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1184889203.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 T0293 can't currently be optimized by undertaker # naming current conformation karypis.srv_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_960137540.pdb -s /var/tmp/to_scwrl_960137540.seq -o /var/tmp/from_scwrl_960137540.pdb > /var/tmp/scwrl_960137540.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_960137540.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 # Found a chain break before 236 # copying to AlignedFragments data structure # naming current conformation karypis.srv_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_916873092.pdb -s /var/tmp/to_scwrl_916873092.seq -o /var/tmp/from_scwrl_916873092.pdb > /var/tmp/scwrl_916873092.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_916873092.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 # Found a chain break before 244 # copying to AlignedFragments data structure # naming current conformation keasar-server_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_2104730680.pdb -s /var/tmp/to_scwrl_2104730680.seq -o /var/tmp/from_scwrl_2104730680.pdb > /var/tmp/scwrl_2104730680.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2104730680.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 # Found a chain break before 239 # copying to AlignedFragments data structure # naming current conformation keasar-server_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1737156519.pdb -s /var/tmp/to_scwrl_1737156519.seq -o /var/tmp/from_scwrl_1737156519.pdb > /var/tmp/scwrl_1737156519.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1737156519.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 # Found a chain break before 242 # copying to AlignedFragments data structure # naming current conformation keasar-server_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_390191318.pdb -s /var/tmp/to_scwrl_390191318.seq -o /var/tmp/from_scwrl_390191318.pdb > /var/tmp/scwrl_390191318.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_390191318.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 # Found a chain break before 243 # copying to AlignedFragments data structure # naming current conformation keasar-server_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_311175207.pdb -s /var/tmp/to_scwrl_311175207.seq -o /var/tmp/from_scwrl_311175207.pdb > /var/tmp/scwrl_311175207.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_311175207.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 # Found a chain break before 245 # copying to AlignedFragments data structure # naming current conformation keasar-server_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_2059431939.pdb -s /var/tmp/to_scwrl_2059431939.seq -o /var/tmp/from_scwrl_2059431939.pdb > /var/tmp/scwrl_2059431939.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2059431939.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 T0293 can't currently be optimized by undertaker # naming current conformation mGen-3D_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_548020844.pdb -s /var/tmp/to_scwrl_548020844.seq -o /var/tmp/from_scwrl_548020844.pdb > /var/tmp/scwrl_548020844.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_548020844.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 T0293 can't currently be optimized by undertaker # naming current conformation nFOLD_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_982247112.pdb -s /var/tmp/to_scwrl_982247112.seq -o /var/tmp/from_scwrl_982247112.pdb > /var/tmp/scwrl_982247112.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_982247112.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 T0293 can't currently be optimized by undertaker # naming current conformation nFOLD_TS2 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1456063326.pdb -s /var/tmp/to_scwrl_1456063326.seq -o /var/tmp/from_scwrl_1456063326.pdb > /var/tmp/scwrl_1456063326.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1456063326.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 T0293 can't currently be optimized by undertaker # naming current conformation nFOLD_TS3 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_918347850.pdb -s /var/tmp/to_scwrl_918347850.seq -o /var/tmp/from_scwrl_918347850.pdb > /var/tmp/scwrl_918347850.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_918347850.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 T0293 can't currently be optimized by undertaker # naming current conformation nFOLD_TS4 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_602294730.pdb -s /var/tmp/to_scwrl_602294730.seq -o /var/tmp/from_scwrl_602294730.pdb > /var/tmp/scwrl_602294730.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_602294730.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: incomplete conformation T0293 can't currently be optimized by undertaker # naming current conformation nFOLD_TS5 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_1520319663.pdb -s /var/tmp/to_scwrl_1520319663.seq -o /var/tmp/from_scwrl_1520319663.pdb > /var/tmp/scwrl_1520319663.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1520319663.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 T0293 can't currently be optimized by undertaker # naming current conformation shub_TS1 # request to SCWRL produces command: ulimit -t 225 ; scwrl3 -i /var/tmp/to_scwrl_2012196313.pdb -s /var/tmp/to_scwrl_2012196313.seq -o /var/tmp/from_scwrl_2012196313.pdb > /var/tmp/scwrl_2012196313.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2012196313.pdb # conformation set from SCWRL output # naming current conformation shub_TS1-scwrl # command:CPU_time= 71.606 sec, elapsed time= 1714.646 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 101.647 real_cost = 89.939 shub_TS1 costs 101.640 real_cost = 94.310 nFOLD_TS5-scwrl costs 85.567 real_cost = 264.429 nFOLD_TS5 costs 85.620 real_cost = 359.894 nFOLD_TS4-scwrl costs 89.746 real_cost = 248.734 nFOLD_TS4 costs 89.779 real_cost = 358.706 nFOLD_TS3-scwrl costs 94.514 real_cost = 177.341 nFOLD_TS3 costs 94.636 real_cost = 257.158 nFOLD_TS2-scwrl costs 101.828 real_cost = 273.849 nFOLD_TS2 costs 101.943 real_cost = 385.157 nFOLD_TS1-scwrl costs 87.105 real_cost = 156.710 nFOLD_TS1 costs 87.085 real_cost = 242.429 mGen-3D_TS1-scwrl costs 85.544 real_cost = 149.180 mGen-3D_TS1 costs 85.602 real_cost = 236.059 keasar-server_TS5-scwrl costs 106.196 real_cost = 84.543 keasar-server_TS5 costs 106.196 real_cost = 77.809 keasar-server_TS4-scwrl costs 109.941 real_cost = 89.558 keasar-server_TS4 costs 109.941 real_cost = 86.417 keasar-server_TS3-scwrl costs 93.616 real_cost = 74.573 keasar-server_TS3 costs 93.616 real_cost = 71.510 keasar-server_TS2-scwrl costs 100.657 real_cost = 85.837 keasar-server_TS2 costs 100.657 real_cost = 89.439 keasar-server_TS1-scwrl costs 105.411 real_cost = 68.450 keasar-server_TS1 costs 105.411 real_cost = 63.178 karypis.srv_TS5-scwrl costs 83.079 real_cost = 145.891 karypis.srv_TS5 costs 83.079 real_cost = 145.110 karypis.srv_TS4-scwrl costs 82.996 real_cost = 185.908 karypis.srv_TS4 costs 82.993 real_cost = 184.378 karypis.srv_TS3-scwrl costs 75.998 real_cost = 140.611 karypis.srv_TS3 costs 76.004 real_cost = 138.833 karypis.srv_TS2-scwrl costs 86.070 real_cost = 78.034 karypis.srv_TS1-scwrl costs 79.816 real_cost = 58.154 karypis.srv_TS1 costs 79.822 real_cost = 53.562 karypis.srv.4_TS1-scwrl costs 141.458 real_cost = 345.272 karypis.srv.4_TS1 costs 141.458 real_cost = 345.271 karypis.srv.2_TS5-scwrl costs 88.016 real_cost = 88.566 karypis.srv.2_TS5 costs 88.016 real_cost = 88.566 karypis.srv.2_TS4-scwrl costs 78.908 real_cost = 52.645 karypis.srv.2_TS4 costs 78.908 real_cost = 52.501 karypis.srv.2_TS3-scwrl costs 82.995 real_cost = 159.212 karypis.srv.2_TS3 costs 82.995 real_cost = 159.207 karypis.srv.2_TS2-scwrl costs 80.732 real_cost = 88.004 karypis.srv.2_TS2 costs 80.732 real_cost = 88.476 karypis.srv.2_TS1-scwrl costs 74.764 real_cost = 64.297 karypis.srv.2_TS1 costs 74.764 real_cost = 65.150 gtg_AL5-scwrl costs 122.754 real_cost = 387.178 gtg_AL5 costs 122.789 real_cost = 469.252 gtg_AL4-scwrl costs 119.892 real_cost = 400.698 gtg_AL4 costs 119.881 real_cost = 477.760 gtg_AL3-scwrl costs 96.520 real_cost = 313.094 gtg_AL3 costs 96.574 real_cost = 404.197 gtg_AL2-scwrl costs 116.788 real_cost = 329.340 gtg_AL2 costs 116.794 real_cost = 439.377 gtg_AL1-scwrl costs 101.240 real_cost = 317.562 gtg_AL1 costs 101.292 real_cost = 366.851 forecast-s_AL5-scwrl costs 102.919 real_cost = 284.283 forecast-s_AL5 costs 103.007 real_cost = 396.857 forecast-s_AL4-scwrl costs 85.602 real_cost = 229.396 forecast-s_AL4 costs 85.852 real_cost = 329.287 forecast-s_AL3-scwrl costs 95.446 real_cost = 257.065 forecast-s_AL3 costs 95.637 real_cost = 358.021 forecast-s_AL2-scwrl costs 104.054 real_cost = 369.719 forecast-s_AL2 costs 104.252 real_cost = 446.102 forecast-s_AL1-scwrl costs 92.258 real_cost = 164.327 forecast-s_AL1 costs 92.367 real_cost = 287.656 beautshotbase_TS1-scwrl costs 80.416 real_cost = 69.768 beautshotbase_TS1 costs 80.399 real_cost = 64.487 beautshot_TS1-scwrl costs 92.204 real_cost = 78.460 beautshot_TS1 costs 92.204 real_cost = 76.726 Zhang-Server_TS5-scwrl costs 77.019 real_cost = 41.701 Zhang-Server_TS5 costs 77.019 real_cost = 43.793 Zhang-Server_TS4-scwrl costs 75.039 real_cost = 27.346 Zhang-Server_TS4 costs 75.039 real_cost = 34.271 Zhang-Server_TS3-scwrl costs 75.039 real_cost = 27.346 Zhang-Server_TS3 costs 75.039 real_cost = 34.271 Zhang-Server_TS2-scwrl costs 64.244 real_cost = 23.643 Zhang-Server_TS2 costs 64.244 real_cost = 31.508 Zhang-Server_TS1-scwrl costs 68.996 real_cost = 8.754 Zhang-Server_TS1 costs 68.996 real_cost = 9.653 UNI-EID_sfst_AL5-scwrl costs 84.748 real_cost = 378.040 UNI-EID_sfst_AL5 costs 84.750 real_cost = 428.346 UNI-EID_sfst_AL4-scwrl costs 82.522 real_cost = 321.990 UNI-EID_sfst_AL4 costs 82.472 real_cost = 381.435 UNI-EID_sfst_AL3-scwrl costs 82.941 real_cost = 204.106 UNI-EID_sfst_AL3 costs 82.978 real_cost = 288.266 UNI-EID_sfst_AL2-scwrl costs 81.993 real_cost = 253.707 UNI-EID_sfst_AL2 costs 82.111 real_cost = 330.371 UNI-EID_sfst_AL1-scwrl costs 81.042 real_cost = 170.976 UNI-EID_sfst_AL1 costs 81.196 real_cost = 265.526 UNI-EID_expm_TS1-scwrl costs 111.294 real_cost = 109.464 UNI-EID_expm_TS1 costs 111.364 real_cost = 213.403 UNI-EID_bnmx_TS5-scwrl costs 90.569 real_cost = 293.423 UNI-EID_bnmx_TS5 costs 90.371 real_cost = 407.986 UNI-EID_bnmx_TS4-scwrl costs 93.275 real_cost = 332.748 UNI-EID_bnmx_TS4 costs 93.138 real_cost = 426.958 UNI-EID_bnmx_TS3-scwrl costs 86.116 real_cost = 227.001 UNI-EID_bnmx_TS3 costs 86.144 real_cost = 332.432 UNI-EID_bnmx_TS2-scwrl costs 81.135 real_cost = 190.090 UNI-EID_bnmx_TS2 costs 81.291 real_cost = 302.638 UNI-EID_bnmx_TS1-scwrl costs 75.443 real_cost = 155.174 UNI-EID_bnmx_TS1 costs 75.485 real_cost = 258.382 SPARKS2_TS5-scwrl costs 93.491 real_cost = 157.482 SPARKS2_TS5 costs 93.491 real_cost = 158.596 SPARKS2_TS4-scwrl costs 79.975 real_cost = 158.515 SPARKS2_TS4 costs 79.975 real_cost = 166.010 SPARKS2_TS3-scwrl costs 75.931 real_cost = 115.883 SPARKS2_TS2-scwrl costs 79.601 real_cost = 47.042 SPARKS2_TS2 costs 79.601 real_cost = 53.401 SPARKS2_TS1-scwrl costs 67.412 real_cost = 53.504 SPARKS2_TS1 costs 67.412 real_cost = 49.317 SP4_TS5-scwrl costs 82.157 real_cost = 177.925 SP4_TS5 costs 82.157 real_cost = 183.276 SP4_TS4-scwrl costs 136.591 real_cost = 292.586 SP4_TS4 costs 136.591 real_cost = 293.392 SP4_TS3-scwrl costs 80.838 real_cost = 132.879 SP4_TS3 costs 80.838 real_cost = 128.723 SP4_TS2-scwrl costs 74.635 real_cost = 40.719 SP4_TS2 costs 74.635 real_cost = 38.299 SP4_TS1-scwrl costs 77.599 real_cost = 62.111 SP4_TS1 costs 77.599 real_cost = 71.401 SP3_TS5-scwrl costs 80.822 real_cost = 203.029 SP3_TS5 costs 80.822 real_cost = 200.357 SP3_TS4-scwrl costs 117.351 real_cost = 269.529 SP3_TS4 costs 117.351 real_cost = 270.757 SP3_TS3-scwrl costs 82.937 real_cost = 130.034 SP3_TS3 costs 82.937 real_cost = 129.058 SP3_TS2-scwrl costs 82.553 real_cost = 33.397 SP3_TS2 costs 82.553 real_cost = 40.056 SP3_TS1-scwrl costs 74.521 real_cost = 68.712 SP3_TS1 costs 74.521 real_cost = 76.799 SAM_T06_server_TS5-scwrl costs 82.784 real_cost = 295.422 SAM_T06_server_TS5 costs 82.908 real_cost = 256.049 SAM_T06_server_TS4-scwrl costs 80.246 real_cost = 227.296 SAM_T06_server_TS4 costs 80.280 real_cost = 198.714 SAM_T06_server_TS3-scwrl costs 84.246 real_cost = 243.391 SAM_T06_server_TS3 costs 84.290 real_cost = 190.596 SAM_T06_server_TS2-scwrl costs 102.017 real_cost = 322.516 SAM_T06_server_TS2 costs 101.946 real_cost = 227.163 SAM_T06_server_TS1-scwrl costs 71.521 real_cost = 103.456 SAM_T06_server_TS1 costs 71.521 real_cost = 104.977 SAM-T99_AL5-scwrl costs 87.800 real_cost = 236.893 SAM-T99_AL5 costs 87.884 real_cost = 349.584 SAM-T99_AL4-scwrl costs 82.207 real_cost = 229.147 SAM-T99_AL4 costs 82.308 real_cost = 338.295 SAM-T99_AL3-scwrl costs 83.862 real_cost = 232.830 SAM-T99_AL3 costs 83.957 real_cost = 344.441 SAM-T99_AL2-scwrl costs 82.109 real_cost = 163.753 SAM-T99_AL2 costs 82.169 real_cost = 284.141 SAM-T99_AL1-scwrl costs 82.482 real_cost = 182.809 SAM-T99_AL1 costs 82.511 real_cost = 303.592 SAM-T02_AL5-scwrl costs 89.761 real_cost = 198.809 SAM-T02_AL5 costs 89.735 real_cost = 314.231 SAM-T02_AL4-scwrl costs 92.975 real_cost = 180.679 SAM-T02_AL4 costs 92.946 real_cost = 301.919 SAM-T02_AL3-scwrl costs 80.068 real_cost = 146.090 SAM-T02_AL3 costs 80.122 real_cost = 277.061 SAM-T02_AL2-scwrl costs 77.050 real_cost = 163.677 SAM-T02_AL2 costs 77.046 real_cost = 285.231 SAM-T02_AL1-scwrl costs 89.276 real_cost = 182.493 SAM-T02_AL1 costs 89.218 real_cost = 298.649 ROKKY_TS5-scwrl costs 86.965 real_cost = 102.747 ROKKY_TS5 costs 86.965 real_cost = 106.980 ROKKY_TS4-scwrl costs 84.925 real_cost = 90.961 ROKKY_TS4 costs 84.925 real_cost = 94.741 ROKKY_TS3-scwrl costs 80.774 real_cost = 88.655 ROKKY_TS3 costs 80.774 real_cost = 94.193 ROKKY_TS2-scwrl costs 68.160 real_cost = 64.047 ROKKY_TS1-scwrl costs 74.260 real_cost = 77.539 ROKKY_TS1 costs 74.260 real_cost = 85.113 ROBETTA_TS5-scwrl costs 60.298 real_cost = 28.413 ROBETTA_TS5 costs 60.298 real_cost = 27.244 ROBETTA_TS4-scwrl costs 63.969 real_cost = 56.502 ROBETTA_TS4 costs 63.969 real_cost = 52.979 ROBETTA_TS3-scwrl costs 67.773 real_cost = 60.521 ROBETTA_TS3 costs 67.773 real_cost = 57.285 ROBETTA_TS2-scwrl costs 69.288 real_cost = 113.646 ROBETTA_TS2 costs 69.288 real_cost = 119.160 ROBETTA_TS1-scwrl costs 65.274 real_cost = 73.732 ROBETTA_TS1 costs 65.274 real_cost = 77.718 RAPTOR_TS5-scwrl costs 79.510 real_cost = 158.376 RAPTOR_TS5 costs 79.510 real_cost = 167.067 RAPTOR_TS4-scwrl costs 80.420 real_cost = 115.895 RAPTOR_TS4 costs 80.420 real_cost = 118.627 RAPTOR_TS3-scwrl costs 88.088 real_cost = 133.768 RAPTOR_TS3 costs 88.088 real_cost = 129.514 RAPTOR_TS2-scwrl costs 81.910 real_cost = 39.070 RAPTOR_TS2 costs 81.910 real_cost = 44.522 RAPTOR_TS1-scwrl costs 77.237 real_cost = 44.293 RAPTOR_TS1 costs 77.237 real_cost = 42.007 RAPTORESS_TS5-scwrl costs 125.459 real_cost = 277.307 RAPTORESS_TS5 costs 125.459 real_cost = 287.705 RAPTORESS_TS4-scwrl costs 89.706 real_cost = 148.329 RAPTORESS_TS4 costs 89.706 real_cost = 156.369 RAPTORESS_TS3-scwrl costs 70.747 real_cost = 105.374 RAPTORESS_TS3 costs 70.747 real_cost = 109.185 RAPTORESS_TS2-scwrl costs 94.052 real_cost = 141.827 RAPTORESS_TS2 costs 94.052 real_cost = 135.419 RAPTORESS_TS1-scwrl costs 96.153 real_cost = 81.740 RAPTORESS_TS1 costs 96.153 real_cost = 94.495 RAPTOR-ACE_TS5-scwrl costs 81.602 real_cost = 85.692 RAPTOR-ACE_TS5 costs 81.602 real_cost = 89.437 RAPTOR-ACE_TS4-scwrl costs 74.521 real_cost = 68.712 RAPTOR-ACE_TS4 costs 74.521 real_cost = 76.799 RAPTOR-ACE_TS3-scwrl costs 84.051 real_cost = 26.100 RAPTOR-ACE_TS3 costs 84.051 real_cost = 36.159 RAPTOR-ACE_TS2-scwrl costs 74.901 real_cost = 64.314 RAPTOR-ACE_TS2 costs 74.901 real_cost = 79.146 RAPTOR-ACE_TS1-scwrl costs 83.031 real_cost = 77.159 RAPTOR-ACE_TS1 costs 83.031 real_cost = 83.306 Pmodeller6_TS5-scwrl costs 63.455 real_cost = 24.706 Pmodeller6_TS5 costs 63.498 real_cost = 24.184 Pmodeller6_TS4-scwrl costs 62.709 real_cost = 22.383 Pmodeller6_TS4 costs 62.710 real_cost = 19.881 Pmodeller6_TS3-scwrl costs 70.509 real_cost = 71.174 Pmodeller6_TS3 costs 70.561 real_cost = 68.537 Pmodeller6_TS2-scwrl costs 56.934 real_cost = 57.434 Pmodeller6_TS2 costs 56.921 real_cost = 59.077 Pmodeller6_TS1-scwrl costs 63.969 real_cost = 56.502 Pmodeller6_TS1 costs 63.969 real_cost = 52.979 Phyre-2_TS5-scwrl costs 88.077 real_cost = 176.050 Phyre-2_TS5 costs 87.999 real_cost = 168.007 Phyre-2_TS4-scwrl costs 90.863 real_cost = 228.188 Phyre-2_TS4 costs 90.856 real_cost = 224.266 Phyre-2_TS3-scwrl costs 90.024 real_cost = 212.234 Phyre-2_TS3 costs 90.023 real_cost = 207.716 Phyre-2_TS2-scwrl costs 88.489 real_cost = 207.971 Phyre-2_TS2 costs 88.500 real_cost = 205.714 Phyre-2_TS1-scwrl costs 92.088 real_cost = 211.538 Phyre-2_TS1 costs 92.136 real_cost = 204.062 Phyre-1_TS1-scwrl costs 85.611 real_cost = 275.971 Phyre-1_TS1 costs 85.619 real_cost = 261.099 Pcons6_TS5-scwrl costs 58.627 real_cost = 60.847 Pcons6_TS5 costs 58.617 real_cost = 57.450 Pcons6_TS4-scwrl costs 66.119 real_cost = 47.476 Pcons6_TS4 costs 66.115 real_cost = 45.033 Pcons6_TS3-scwrl costs 59.339 real_cost = 30.494 Pcons6_TS3 costs 59.337 real_cost = 25.697 Pcons6_TS2-scwrl costs 56.864 real_cost = 28.586 Pcons6_TS2 costs 56.859 real_cost = 24.816 Pcons6_TS1-scwrl costs 60.234 real_cost = 30.735 Pcons6_TS1 costs 60.230 real_cost = 26.867 PROTINFO_TS5-scwrl costs 97.724 real_cost = 173.418 PROTINFO_TS5 costs 97.724 real_cost = 178.125 PROTINFO_TS4-scwrl costs 80.710 real_cost = 78.837 PROTINFO_TS4 costs 80.710 real_cost = 79.152 PROTINFO_TS3-scwrl costs 93.327 real_cost = 66.670 PROTINFO_TS3 costs 93.327 real_cost = 67.041 PROTINFO_TS2-scwrl costs 79.555 real_cost = 56.053 PROTINFO_TS2 costs 79.555 real_cost = 57.055 PROTINFO_TS1-scwrl costs 73.861 real_cost = 78.282 PROTINFO_TS1 costs 73.861 real_cost = 79.064 PROTINFO-AB_TS4-scwrl costs 94.255 real_cost = 102.682 PROTINFO-AB_TS4 costs 94.255 real_cost = 103.776 PROTINFO-AB_TS3-scwrl costs 92.555 real_cost = 99.017 PROTINFO-AB_TS3 costs 92.555 real_cost = 97.866 PROTINFO-AB_TS2-scwrl costs 90.223 real_cost = 105.227 PROTINFO-AB_TS2 costs 90.223 real_cost = 107.494 PROTINFO-AB_TS1-scwrl costs 94.024 real_cost = 99.965 PROTINFO-AB_TS1 costs 94.024 real_cost = 103.904 POMYSL_TS5-scwrl costs 145.742 real_cost = 320.038 POMYSL_TS5 costs 145.742 real_cost = 323.973 POMYSL_TS4-scwrl costs 138.920 real_cost = 337.876 POMYSL_TS4 costs 138.920 real_cost = 340.031 POMYSL_TS3-scwrl costs 132.286 real_cost = 313.077 POMYSL_TS3 costs 132.286 real_cost = 314.147 POMYSL_TS2-scwrl costs 132.062 real_cost = 328.923 POMYSL_TS2 costs 132.062 real_cost = 327.646 POMYSL_TS1-scwrl costs 144.277 real_cost = 325.238 POMYSL_TS1 costs 144.277 real_cost = 326.817 NN_PUT_lab_TS1-scwrl costs 68.339 real_cost = 131.155 NN_PUT_lab_TS1 costs 68.334 real_cost = 136.798 MetaTasser_TS5-scwrl costs 94.729 real_cost = 82.659 MetaTasser_TS5 costs 94.729 real_cost = 83.021 MetaTasser_TS4-scwrl costs 86.138 real_cost = 49.658 MetaTasser_TS4 costs 86.138 real_cost = 56.034 MetaTasser_TS3-scwrl costs 105.656 real_cost = 63.677 MetaTasser_TS3 costs 105.656 real_cost = 67.295 MetaTasser_TS2-scwrl costs 89.295 real_cost = 77.296 MetaTasser_TS2 costs 89.295 real_cost = 85.535 MetaTasser_TS1-scwrl costs 99.840 real_cost = 86.212 MetaTasser_TS1 costs 99.840 real_cost = 84.267 Ma-OPUS-server_TS5-scwrl costs 74.933 real_cost = 107.865 Ma-OPUS-server_TS5 costs 74.933 real_cost = 113.007 Ma-OPUS-server_TS4-scwrl costs 92.325 real_cost = 133.681 Ma-OPUS-server_TS4 costs 92.325 real_cost = 134.751 Ma-OPUS-server_TS3-scwrl costs 76.431 real_cost = 62.956 Ma-OPUS-server_TS3 costs 76.431 real_cost = 66.185 Ma-OPUS-server_TS2-scwrl costs 86.203 real_cost = 110.957 Ma-OPUS-server_TS2 costs 86.203 real_cost = 125.592 Ma-OPUS-server_TS1-scwrl costs 77.384 real_cost = 67.077 Ma-OPUS-server_TS1 costs 77.384 real_cost = 76.026 LOOPP_TS5-scwrl costs 67.228 real_cost = 47.060 LOOPP_TS5 costs 67.239 real_cost = 48.308 LOOPP_TS4-scwrl costs 73.742 real_cost = 92.405 LOOPP_TS4 costs 73.737 real_cost = 104.189 LOOPP_TS3-scwrl costs 74.504 real_cost = 50.137 LOOPP_TS3 costs 74.511 real_cost = 48.845 LOOPP_TS2-scwrl costs 70.607 real_cost = 88.405 LOOPP_TS2 costs 70.604 real_cost = 90.476 LOOPP_TS1-scwrl costs 68.806 real_cost = 54.739 LOOPP_TS1 costs 68.801 real_cost = 57.940 Huber-Torda-Server_TS5-scwrl costs 113.958 real_cost = 511.838 Huber-Torda-Server_TS5 costs 113.943 real_cost = 558.079 Huber-Torda-Server_TS4-scwrl costs 117.744 real_cost = 480.143 Huber-Torda-Server_TS4 costs 117.791 real_cost = 537.532 Huber-Torda-Server_TS3-scwrl costs 117.445 real_cost = 513.637 Huber-Torda-Server_TS3 costs 117.373 real_cost = 578.604 Huber-Torda-Server_TS2-scwrl costs 111.805 real_cost = 553.574 Huber-Torda-Server_TS2 costs 111.792 real_cost = 598.776 Huber-Torda-Server_TS1-scwrl costs 113.060 real_cost = 473.976 Huber-Torda-Server_TS1 costs 113.038 real_cost = 527.468 HHpred3_TS1-scwrl costs 69.232 real_cost = 28.330 HHpred3_TS1 costs 69.232 real_cost = 32.206 HHpred2_TS1-scwrl costs 64.631 real_cost = 29.015 HHpred2_TS1 costs 64.631 real_cost = 33.145 HHpred1_TS1-scwrl costs 69.803 real_cost = 25.326 HHpred1_TS1 costs 69.803 real_cost = 27.352 GeneSilicoMetaServer_TS5-scwrl costs 73.585 real_cost = 44.708 GeneSilicoMetaServer_TS5 costs 73.585 real_cost = 48.523 GeneSilicoMetaServer_TS3-scwrl costs 78.853 real_cost = 57.136 GeneSilicoMetaServer_TS3 costs 78.853 real_cost = 68.118 GeneSilicoMetaServer_TS2-scwrl costs 86.184 real_cost = 95.184 GeneSilicoMetaServer_TS2 costs 86.184 real_cost = 98.975 GeneSilicoMetaServer_TS1-scwrl costs 76.802 real_cost = 76.264 GeneSilicoMetaServer_TS1 costs 76.802 real_cost = 85.557 FUNCTION_TS5-scwrl costs 97.864 real_cost = 162.788 FUNCTION_TS5 costs 97.864 real_cost = 173.443 FUNCTION_TS4-scwrl costs 110.102 real_cost = 205.863 FUNCTION_TS4 costs 110.102 real_cost = 202.416 FUNCTION_TS3-scwrl costs 99.413 real_cost = 47.249 FUNCTION_TS3 costs 99.413 real_cost = 55.019 FUNCTION_TS2-scwrl costs 92.105 real_cost = 97.067 FUNCTION_TS2 costs 92.105 real_cost = 97.069 FUNCTION_TS1-scwrl costs 89.061 real_cost = 47.124 FUNCTION_TS1 costs 89.061 real_cost = 53.385 FUGUE_AL5-scwrl costs 86.248 real_cost = 308.605 FUGUE_AL5 costs 86.260 real_cost = 405.892 FUGUE_AL4-scwrl costs 90.428 real_cost = 271.274 FUGUE_AL4 costs 90.430 real_cost = 419.140 FUGUE_AL3-scwrl costs 86.599 real_cost = 172.203 FUGUE_AL3 costs 86.864 real_cost = 292.489 FUGUE_AL2-scwrl costs 85.717 real_cost = 282.348 FUGUE_AL2 costs 85.827 real_cost = 398.076 FUGUE_AL1-scwrl costs 84.805 real_cost = 143.103 FUGUE_AL1 costs 84.925 real_cost = 274.558 FUGMOD_TS5-scwrl costs 97.770 real_cost = 217.569 FUGMOD_TS5 costs 97.760 real_cost = 218.820 FUGMOD_TS4-scwrl costs 86.202 real_cost = 215.859 FUGMOD_TS4 costs 86.202 real_cost = 217.783 FUGMOD_TS3-scwrl costs 85.750 real_cost = 78.490 FUGMOD_TS2-scwrl costs 81.295 real_cost = 154.281 FUGMOD_TS2 costs 81.295 real_cost = 159.489 FUGMOD_TS1-scwrl costs 73.438 real_cost = 80.942 FUGMOD_TS1 costs 73.451 real_cost = 88.358 FPSOLVER-SERVER_TS1-scwrl costs 106.003 real_cost = 310.439 FPSOLVER-SERVER_TS1 costs 106.003 real_cost = 314.899 FORTE2_AL5-scwrl costs 89.793 real_cost = 263.504 FORTE2_AL5 costs 89.788 real_cost = 398.097 FORTE2_AL4-scwrl costs 83.949 real_cost = 210.301 FORTE2_AL4 costs 83.933 real_cost = 348.250 FORTE2_AL3-scwrl costs 92.139 real_cost = 296.543 FORTE2_AL3 costs 92.095 real_cost = 451.664 FORTE2_AL2-scwrl costs 95.075 real_cost = 324.609 FORTE2_AL2 costs 95.030 real_cost = 454.692 FORTE2_AL1-scwrl costs 89.716 real_cost = 293.958 FORTE2_AL1 costs 89.646 real_cost = 448.593 FORTE1_AL5-scwrl costs 90.176 real_cost = 281.641 FORTE1_AL5 costs 90.134 real_cost = 439.772 FORTE1_AL4-scwrl costs 93.206 real_cost = 304.490 FORTE1_AL4 costs 93.178 real_cost = 456.596 FORTE1_AL3-scwrl costs 89.793 real_cost = 263.504 FORTE1_AL3 costs 89.788 real_cost = 398.097 FORTE1_AL2-scwrl costs 94.094 real_cost = 306.434 FORTE1_AL2 costs 94.028 real_cost = 445.834 FORTE1_AL1-scwrl costs 92.075 real_cost = 265.202 FORTE1_AL1 costs 92.116 real_cost = 425.028 FOLDpro_TS5-scwrl costs 97.152 real_cost = 236.066 FOLDpro_TS5 costs 97.152 real_cost = 237.488 FOLDpro_TS4-scwrl costs 85.725 real_cost = 224.311 FOLDpro_TS4 costs 85.725 real_cost = 227.350 FOLDpro_TS3-scwrl costs 92.530 real_cost = 202.520 FOLDpro_TS3 costs 92.530 real_cost = 212.859 FOLDpro_TS2-scwrl costs 96.197 real_cost = 219.070 FOLDpro_TS2 costs 96.197 real_cost = 224.993 FOLDpro_TS1-scwrl costs 91.111 real_cost = 176.149 FOLDpro_TS1 costs 91.111 real_cost = 184.909 FAMS_TS5-scwrl costs 85.216 real_cost = 48.235 FAMS_TS5 costs 85.216 real_cost = 51.815 FAMS_TS4-scwrl costs 79.686 real_cost = 54.732 FAMS_TS4 costs 79.645 real_cost = 62.853 FAMS_TS3-scwrl costs 79.686 real_cost = 54.732 FAMS_TS3 costs 79.645 real_cost = 62.853 FAMS_TS2-scwrl costs 99.413 real_cost = 47.249 FAMS_TS2 costs 99.413 real_cost = 55.019 FAMS_TS1-scwrl costs 89.061 real_cost = 47.124 FAMS_TS1 costs 89.061 real_cost = 53.385 FAMSD_TS5-scwrl costs 77.240 real_cost = 48.244 FAMSD_TS5 costs 77.240 real_cost = 57.564 FAMSD_TS4-scwrl costs 79.686 real_cost = 54.732 FAMSD_TS4 costs 79.645 real_cost = 62.853 FAMSD_TS3-scwrl costs 85.114 real_cost = 68.619 FAMSD_TS3 costs 85.114 real_cost = 76.543 FAMSD_TS2-scwrl costs 89.084 real_cost = 124.813 FAMSD_TS2 costs 89.004 real_cost = 123.347 FAMSD_TS1-scwrl costs 77.798 real_cost = 33.721 FAMSD_TS1 costs 77.798 real_cost = 34.064 Distill_TS5-scwrl costs 233.166 real_cost = 538.247 Distill_TS4-scwrl costs 234.283 real_cost = 558.069 Distill_TS3-scwrl costs 234.367 real_cost = 543.836 Distill_TS2-scwrl costs 233.440 real_cost = 522.114 Distill_TS1-scwrl costs 233.012 real_cost = 534.244 CaspIta-FOX_TS5-scwrl costs 96.208 real_cost = 330.748 CaspIta-FOX_TS5 costs 96.219 real_cost = 322.980 CaspIta-FOX_TS4-scwrl costs 74.633 real_cost = 195.547 CaspIta-FOX_TS4 costs 74.687 real_cost = 186.123 CaspIta-FOX_TS3-scwrl costs 79.885 real_cost = 163.854 CaspIta-FOX_TS3 costs 79.867 real_cost = 154.281 CaspIta-FOX_TS2-scwrl costs 76.851 real_cost = 33.774 CaspIta-FOX_TS2 costs 76.803 real_cost = 27.981 CaspIta-FOX_TS1-scwrl costs 78.592 real_cost = 134.131 CaspIta-FOX_TS1 costs 78.666 real_cost = 127.828 CIRCLE_TS5-scwrl costs 85.205 real_cost = 90.425 CIRCLE_TS5 costs 85.222 real_cost = 90.871 CIRCLE_TS4-scwrl costs 81.334 real_cost = 83.831 CIRCLE_TS4 costs 81.336 real_cost = 88.449 CIRCLE_TS3-scwrl costs 81.786 real_cost = 37.446 CIRCLE_TS3 costs 81.786 real_cost = 41.955 CIRCLE_TS2-scwrl costs 79.686 real_cost = 54.732 CIRCLE_TS2 costs 79.645 real_cost = 62.853 CIRCLE_TS1-scwrl costs 85.216 real_cost = 48.235 CIRCLE_TS1 costs 85.216 real_cost = 51.815 Bilab-ENABLE_TS5-scwrl costs 77.416 real_cost = 99.643 Bilab-ENABLE_TS5 costs 77.416 real_cost = 99.613 Bilab-ENABLE_TS4-scwrl costs 76.679 real_cost = 135.813 Bilab-ENABLE_TS4 costs 76.679 real_cost = 135.810 Bilab-ENABLE_TS3-scwrl costs 76.295 real_cost = 77.804 Bilab-ENABLE_TS3 costs 76.295 real_cost = 77.829 Bilab-ENABLE_TS2-scwrl costs 76.716 real_cost = 99.776 Bilab-ENABLE_TS2 costs 76.716 real_cost = 99.764 Bilab-ENABLE_TS1-scwrl costs 76.895 real_cost = 102.538 Bilab-ENABLE_TS1 costs 76.895 real_cost = 103.366 BayesHH_TS1-scwrl costs 72.353 real_cost = 32.950 BayesHH_TS1 costs 72.353 real_cost = 29.843 ABIpro_TS5-scwrl costs 71.535 real_cost = 248.281 ABIpro_TS5 costs 71.535 real_cost = 247.745 ABIpro_TS4-scwrl costs 82.948 real_cost = 259.349 ABIpro_TS4 costs 82.948 real_cost = 259.154 ABIpro_TS3-scwrl costs 93.955 real_cost = 278.668 ABIpro_TS3 costs 93.955 real_cost = 278.669 ABIpro_TS2-scwrl costs 64.417 real_cost = 238.247 ABIpro_TS2 costs 64.417 real_cost = 238.249 ABIpro_TS1-scwrl costs 82.213 real_cost = 272.887 ABIpro_TS1 costs 82.213 real_cost = 272.898 3Dpro_TS5-scwrl costs 100.542 real_cost = 255.556 3Dpro_TS5 costs 100.542 real_cost = 256.201 3Dpro_TS4-scwrl costs 91.310 real_cost = 234.544 3Dpro_TS4 costs 91.310 real_cost = 237.233 3Dpro_TS3-scwrl costs 108.273 real_cost = 224.693 3Dpro_TS3 costs 108.273 real_cost = 234.226 3Dpro_TS2-scwrl costs 92.617 real_cost = 167.226 3Dpro_TS2 costs 92.617 real_cost = 174.525 3Dpro_TS1-scwrl costs 91.111 real_cost = 176.149 3Dpro_TS1 costs 91.111 real_cost = 184.909 3D-JIGSAW_TS5-scwrl costs 107.621 real_cost = 153.176 3D-JIGSAW_TS5 costs 107.668 real_cost = 159.212 3D-JIGSAW_TS4-scwrl costs 94.322 real_cost = 153.979 3D-JIGSAW_TS4 costs 94.261 real_cost = 156.947 3D-JIGSAW_TS3-scwrl costs 102.147 real_cost = 155.049 3D-JIGSAW_TS3 costs 102.144 real_cost = 163.274 3D-JIGSAW_TS2-scwrl costs 110.363 real_cost = 183.815 3D-JIGSAW_TS2 costs 110.360 real_cost = 189.138 3D-JIGSAW_TS1-scwrl costs 120.257 real_cost = 141.687 3D-JIGSAW_TS1 costs 120.258 real_cost = 143.029 3D-JIGSAW_RECOM_TS5-scwrl costs 85.243 real_cost = 93.736 3D-JIGSAW_RECOM_TS5 costs 85.244 real_cost = 96.223 3D-JIGSAW_RECOM_TS4-scwrl costs 117.230 real_cost = 311.381 3D-JIGSAW_RECOM_TS4 costs 117.272 real_cost = 310.507 3D-JIGSAW_RECOM_TS3-scwrl costs 118.338 real_cost = 307.615 3D-JIGSAW_RECOM_TS3 costs 118.385 real_cost = 307.036 3D-JIGSAW_RECOM_TS2-scwrl costs 116.756 real_cost = 320.943 3D-JIGSAW_RECOM_TS2 costs 116.798 real_cost = 315.654 3D-JIGSAW_RECOM_TS1-scwrl costs 114.630 real_cost = 327.355 3D-JIGSAW_RECOM_TS1 costs 114.672 real_cost = 324.067 3D-JIGSAW_POPULUS_TS5-scwrl costs 93.258 real_cost = 166.283 3D-JIGSAW_POPULUS_TS5 costs 93.197 real_cost = 163.394 3D-JIGSAW_POPULUS_TS4-scwrl costs 97.871 real_cost = 179.483 3D-JIGSAW_POPULUS_TS4 costs 97.918 real_cost = 176.052 3D-JIGSAW_POPULUS_TS3-scwrl costs 95.864 real_cost = 153.609 3D-JIGSAW_POPULUS_TS3 costs 95.911 real_cost = 150.840 3D-JIGSAW_POPULUS_TS2-scwrl costs 93.443 real_cost = 176.283 3D-JIGSAW_POPULUS_TS2 costs 93.491 real_cost = 173.759 3D-JIGSAW_POPULUS_TS1-scwrl costs 95.766 real_cost = 160.542 3D-JIGSAW_POPULUS_TS1 costs 95.705 real_cost = 157.379 shift232over2FromTry8.renum.pdb.gz costs 78.167 real_cost = 130.301 shift232over1FromTry8.renum.pdb.gz costs 77.179 real_cost = 127.478 shift232over1.2andMoveH33-37.renum.pdb.gz costs 79.694 real_cost = 131.783 shift232over1.2FromTry8.renum.pdb.gz costs 77.949 real_cost = 127.886 shift232over1.1FromTry8.renum.pdb.gz costs 76.825 real_cost = 128.420 lineup230and245take1.9rotateNtermSlide33-37helix.renum.pdb.gz costs 76.707 real_cost = 126.451 lineup230and245take1.2rotateNterminusAndMove.renum.pdb.gz costs 76.876 real_cost = 125.755 fromTry4.proto.pdb.gz costs 78.218 real_cost = 127.991 chimera1.pdb.gz costs 90.894 real_cost = 232.921 chimera-try5-server.pdb.gz costs 79.059 real_cost = 127.257 chimera-try5-align2.pdb.gz costs 80.734 real_cost = 128.314 T0293.try9-opt2.repack-nonPC.pdb.gz costs 73.234 real_cost = 130.776 T0293.try9-opt2.pdb.gz costs 73.234 real_cost = 130.049 T0293.try9-opt2.gromacs0.pdb.gz costs 60.532 real_cost = 132.630 T0293.try9-opt1.pdb.gz costs 74.041 real_cost = 132.953 T0293.try9-opt1-scwrl.pdb.gz costs 74.041 real_cost = 130.305 T0293.try8-opt2.repack-nonPC.pdb.gz costs 77.141 real_cost = 125.534 T0293.try8-opt2.pdb.gz costs 77.141 real_cost = 126.730 T0293.try8-opt2.gromacs0.pdb.gz costs 60.644 real_cost = 128.157 T0293.try8-opt1.pdb.gz costs 76.581 real_cost = 124.287 T0293.try8-opt1-scwrl.pdb.gz costs 76.581 real_cost = 123.262 T0293.try7-opt2.repack-nonPC.pdb.gz costs 76.777 real_cost = 125.666 T0293.try7-opt2.pdb.gz costs 76.777 real_cost = 125.638 T0293.try7-opt2.gromacs0.pdb.gz costs 59.906 real_cost = 126.493 T0293.try7-opt1.pdb.gz costs 78.759 real_cost = 127.551 T0293.try7-opt1-scwrl.pdb.gz costs 78.759 real_cost = 127.048 T0293.try6-opt2.repack-nonPC.pdb.gz costs 80.337 real_cost = 124.144 T0293.try6-opt2.pdb.gz costs 80.337 real_cost = 127.286 T0293.try6-opt2.gromacs0.pdb.gz costs 63.223 real_cost = 129.038 T0293.try6-opt1.pdb.gz costs 78.123 real_cost = 125.213 T0293.try6-opt1-scwrl.pdb.gz costs 78.123 real_cost = 123.969 T0293.try5-opt2.repack-nonPC.pdb.gz costs 79.890 real_cost = 131.078 T0293.try5-opt2.pdb.gz costs 79.890 real_cost = 130.447 T0293.try5-opt1.pdb.gz costs 76.930 real_cost = 129.328 T0293.try5-opt1-scwrl.pdb.gz costs 76.930 real_cost = 128.016 T0293.try4-opt2.repack-nonPC.pdb.gz costs 72.936 real_cost = 119.408 T0293.try4-opt2.pdb.gz costs 72.936 real_cost = 115.850 T0293.try4-opt2.gromacs0.pdb.gz costs 61.190 real_cost = 117.868 T0293.try4-opt1.pdb.gz costs 65.923 real_cost = 116.417 T0293.try4-opt1-scwrl.pdb.gz costs 65.923 real_cost = 115.533 T0293.try3-opt2.repack-nonPC.pdb.gz costs 92.309 real_cost = 189.195 T0293.try3-opt2.pdb.gz costs 92.309 real_cost = 187.140 T0293.try3-opt2.gromacs0.pdb.gz costs 82.509 real_cost = 191.737 T0293.try3-opt1.pdb.gz costs 85.850 real_cost = 187.836 T0293.try3-opt1-scwrl.pdb.gz costs 85.850 real_cost = 186.669 T0293.try2-opt2.repack-nonPC.pdb.gz costs 86.505 real_cost = 202.814 T0293.try2-opt2.pdb.gz costs 86.505 real_cost = 205.607 T0293.try2-opt2.gromacs0.pdb.gz costs 72.533 real_cost = 207.088 T0293.try2-opt1.pdb.gz costs 86.745 real_cost = 204.883 T0293.try2-opt1-scwrl.pdb.gz costs 86.745 real_cost = 200.869 T0293.try17-opt2.repack-nonPC.pdb.gz costs 73.295 real_cost = 131.919 T0293.try17-opt2.pdb.gz costs 73.295 real_cost = 131.774 T0293.try17-opt2.gromacs0.pdb.gz costs 61.308 real_cost = 131.405 T0293.try17-opt1.pdb.gz costs 74.696 real_cost = 132.828 T0293.try17-opt1-scwrl.pdb.gz costs 74.696 real_cost = 129.471 T0293.try16-opt2.repack-nonPC.pdb.gz costs 72.908 real_cost = 116.635 T0293.try16-opt2.pdb.gz costs 72.908 real_cost = 116.029 T0293.try16-opt2.gromacs0.pdb.gz costs 64.372 real_cost = 119.378 T0293.try16-opt1.pdb.gz costs 72.508 real_cost = 118.901 T0293.try16-opt1-scwrl.pdb.gz costs 72.508 real_cost = 117.585 T0293.try15-opt2.repack-nonPC.pdb.gz costs 73.100 real_cost = 95.251 T0293.try15-opt2.pdb.gz costs 73.100 real_cost = 96.651 T0293.try15-opt2.gromacs0.pdb.gz costs 59.811 real_cost = 98.430 T0293.try15-opt1.pdb.gz costs 73.654 real_cost = 100.926 T0293.try15-opt1-scwrl.pdb.gz costs 73.654 real_cost = 98.305 T0293.try14-opt2.repack-nonPC.pdb.gz costs 73.124 real_cost = 130.038 T0293.try14-opt2.pdb.gz costs 73.124 real_cost = 132.003 T0293.try14-opt2.gromacs0.pdb.gz costs 61.563 real_cost = 134.030 T0293.try14-opt1.pdb.gz costs 73.124 real_cost = 130.702 T0293.try14-opt1-scwrl.pdb.gz costs 73.124 real_cost = 127.838 T0293.try13-opt2.repack-nonPC.pdb.gz costs 73.395 real_cost = 135.056 T0293.try13-opt2.pdb.gz costs 73.395 real_cost = 135.754 T0293.try13-opt2.gromacs0.pdb.gz costs 61.603 real_cost = 136.376 T0293.try13-opt1.pdb.gz costs 73.484 real_cost = 137.636 T0293.try13-opt1-scwrl.pdb.gz costs 73.484 real_cost = 134.353 T0293.try12-opt2.repack-nonPC.pdb.gz costs 75.142 real_cost = 130.557 T0293.try12-opt2.pdb.gz costs 75.142 real_cost = 131.555 T0293.try12-opt2.gromacs0.pdb.gz costs 61.134 real_cost = 134.698 T0293.try12-opt1.pdb.gz costs 75.477 real_cost = 131.503 T0293.try12-opt1-scwrl.pdb.gz costs 75.477 real_cost = 128.971 T0293.try11-opt2.repack-nonPC.pdb.gz costs 74.386 real_cost = 133.177 T0293.try11-opt2.pdb.gz costs 74.386 real_cost = 133.069 T0293.try11-opt2.gromacs0.pdb.gz costs 58.555 real_cost = 133.590 T0293.try11-opt1.pdb.gz costs 74.414 real_cost = 133.174 T0293.try11-opt1-scwrl.pdb.gz costs 74.414 real_cost = 131.206 T0293.try10-opt2.repack-nonPC.pdb.gz costs 75.895 real_cost = 127.586 T0293.try10-opt2.pdb.gz costs 75.895 real_cost = 123.791 T0293.try10-opt2.gromacs0.pdb.gz costs 61.582 real_cost = 126.072 T0293.try10-opt1.pdb.gz costs 73.531 real_cost = 127.004 T0293.try10-opt1-scwrl.pdb.gz costs 73.531 real_cost = 125.121 T0293.try1-opt2.repack-nonPC.pdb.gz costs 92.725 real_cost = 215.660 T0293.try1-opt2.pdb.gz costs 92.725 real_cost = 216.075 T0293.try1-opt2.gromacs0.pdb.gz costs 80.042 real_cost = 214.197 T0293.try1-opt1.pdb.gz costs 87.793 real_cost = 209.747 T0293.try1-opt1-scwrl.pdb.gz costs 87.793 real_cost = 211.192 ../model5.ts-submitted costs 99.072 real_cost = 236.805 ../model4.ts-submitted costs 72.936 real_cost = 115.656 ../model3.ts-submitted costs 77.141 real_cost = 126.953 ../model2.ts-submitted costs 72.908 real_cost = 116.207 ../model1.ts-submitted costs 73.295 real_cost = 131.766 align5 costs 89.803 real_cost = 365.352 align4 costs 88.304 real_cost = 285.150 align3 costs 82.963 real_cost = 381.518 align2 costs 76.616 real_cost = 182.210 align1 costs 96.883 real_cost = 216.390 T0293.try1-opt2.pdb costs 92.725 real_cost = 216.200 model5-scwrl costs 99.141 real_cost = 338.980 model5.ts-submitted costs 99.072 real_cost = 236.805 model4-scwrl costs 72.936 real_cost = 116.838 model4.ts-submitted costs 72.936 real_cost = 115.656 model3-scwrl costs 77.141 real_cost = 124.685 model3.ts-submitted costs 77.141 real_cost = 126.953 model2-scwrl costs 72.908 real_cost = 115.195 model2.ts-submitted costs 72.908 real_cost = 116.207 model1-scwrl costs 73.295 real_cost = 131.010 model1.ts-submitted costs 73.295 real_cost = 131.762 2h00A costs 51.072 real_cost = -844.200 # command:CPU_time= 1669.641 sec, elapsed time= 3313.091 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/T0293'