make[1]: Entering directory `/projects/compbio/experiments/protein-predict/casp7/T0361' 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/T0361.} ;\ 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.predburial.rdb sed -e s/XXX0000/T0361/ -e s/START_COL/1/ \ -e s/COSTFCN/predburial/ \ -e s/_domain// \ -e s/read-pdb/read-pdb+servers/ \ -e s/REAL_PDB/2hktA/ \ < /projects/compbio/experiments/protein-predict/casp7/starter-directory/evaluate.under \ | nice -2 /cse/grads/jarchie/projects/cvs/karplus/undertaker/undertaker # command:# Seed set to 1173974655 # command:# Prefix for input files set to /projects/compbio/experiments/undertaker/atoms-inputs/ # command:# reading monomeric-50pc.atoms # After reading monomeric-50pc.atoms have 448 chains in training database # Count of chains,residues,atoms: 448,112605,876684 # 109826 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 1959 # 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= 6.26905 sec, elapsed time= 12.7672 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 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 6.5 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 6.5 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 6.5 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 9.65 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 8.9 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 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 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 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= 6.35703 sec, elapsed time= 12.9537 sec) # command:# Prefix for input files set to # command:# Making conformation for sequence T0361 numbered 1 through 169 Created new target T0361 from T0361.a2m # command:# command:# No conformations to remove in PopConform # command:# cleared Id set # command:# command:# WARNING: incomplete conformation T0361 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 * real_hbond + 50 * real_hbond_u + 50 * decoy_hbond + 50 * decoy_hbond_u + 10 * real_NO_hbond + 10 * real_NO_hbond_u + 10 * decoy_NO_hbond + 10 * decoy_NO_hbond_u + 10 * knot + 200 * clens + 0 * rmsd + 35 * log_rmsd + 0 * rmsd_ca + 30 * log_rmsd_ca + 1 * GDT + 1 * smooth_GDT + 0.2 * missing_atoms ) # command:# SetCost created cost = # ) # command:# reading script from file predburial.costfcn # Prefix for input files set to /projects/compbio/experiments/undertaker/spots/ # reading histogram from smoothed-near-backbone-2spot.hist # created burial cost function nb11 with radius 9.65 with spots at near-backbone-center.spot counting only near-backbone-count.spot # Prefix for input files set to # Prefix for input files set to /projects/compbio/lib/alphabet/ # Read 5 alphabets from two-spot-burial.alphabet # Prefix for input files set to # created predicted BurialPredCostFcn pred_nb11_2k # created predicted BurialPredCostFcn pred_nb11_2k_simple # created predicted BurialPredCostFcn pred_nb11_04 # created predicted BurialPredCostFcn pred_nb11_04_simple # created predicted BurialPredCostFcn pred_nb11_06 # created predicted BurialPredCostFcn pred_nb11_06_simple # reading predictions from T0361.t2k.alpha.rdb # created predicted alpha cost function pred_alpha2k with 360 bins smoothing outer_iter=2 inner_iter=1 width=7 # reading predictions from T0361.t04.alpha.rdb # created predicted alpha cost function pred_alpha04 with 360 bins smoothing outer_iter=2 inner_iter=1 width=7 # reading predictions from T0361.t06.alpha.rdb # created predicted alpha cost function pred_alpha06 with 360 bins smoothing outer_iter=2 inner_iter=1 width=7 # Prefix for input files set to /projects/compbio/experiments/undertaker/spots/ # reading histogram from smoothed-monomeric-50pc-CB14.hist # created burial cost function cb14 with radius 14 with spots at CB counting only CB # Prefix for input files set to # Prefix for input files set to /projects/compbio/lib/alphabet/ # Read 28 alphabets from burial.alphabet # Prefix for input files set to # created predicted BurialPredCostFcn pred_cb14_2k # created predicted BurialPredCostFcn pred_cb14_2k_simple # created predicted BurialPredCostFcn pred_cb14_04 # created predicted BurialPredCostFcn pred_cb14_04_simple # created predicted BurialPredCostFcn pred_cb14_06 # created predicted BurialPredCostFcn pred_cb14_06_simple Unrecognized cost function c_beta for SetCost Unrecognized cost function 5 for SetCost # SetCost created cost = # ( 15 * wet6.5(6.5, /log(length)) + 5 * near_backbone(9.65) + 5 * way_back(8.9) + 15 * dry5(5) + 20 * dry6.5(6.5) + 15 * dry8(8) + 5 * dry12(12) + 5 * nb11(9.65) + 5 * pred_nb11_2k_simple(9.65) + 5 * pred_nb11_2k(9.65) + 5 * pred_nb11_04_simple(9.65) + 5 * pred_nb11_04(9.65) + 5 * pred_nb11_06_simple(9.65) + 5 * pred_nb11_06(9.65) + 5 * cb14(14) + 5 * pred_cb14_2k_simple(14) + 5 * pred_cb14_2k(14) + 5 * pred_cb14_04_simple(14) + 5 * pred_cb14_04(14) + 5 * pred_cb14_06_simple(14) + 5 * pred_cb14_06(14) + 2 * phobic_fit + 10 * n_ca_c + 20 * bad_peptide + 5 * sidechain + 8 * bystroff + 20 * soft_clashes + 2 * backbone_clashes + 50 * break + 3 * pred_alpha2k + 4 * pred_alpha04 + 5 * pred_alpha06 + 5 * hbond_geom + 10 * hbond_geom_backbone + 50 * hbond_geom_beta + 100 * hbond_geom_beta_pair + 1 * missing_atoms ) # command:CPU_time= 9.28459 sec, elapsed time= 21.8609 sec) # command:# Prefix for input files set to # command:# ReadConformPDB reading from PDB file model1.ts-submitted looking for model 1 # Found a chain break before 146 # copying to AlignedFragments data structure # command:# fraction of real conformation used = 1 # GDT_score = -35.061 # GDT_score(maxd=8,maxw=2.9)= -35.1362 # GDT_score(maxd=8,maxw=3.2)= -33.059 # GDT_score(maxd=8,maxw=3.5)= -31.1587 # GDT_score(maxd=10,maxw=3.8)= -34.154 # GDT_score(maxd=10,maxw=4)= -32.9023 # GDT_score(maxd=10,maxw=4.2)= -31.7066 # GDT_score(maxd=12,maxw=4.3)= -35.2212 # GDT_score(maxd=12,maxw=4.5)= -33.9971 # GDT_score(maxd=12,maxw=4.7)= -32.8618 # GDT_score(maxd=14,maxw=5.2)= -33.4665 # GDT_score(maxd=14,maxw=5.5)= -31.9756 # command:# Prefix for output files set to # command:EXPDTA model1.ts-submitted MODEL 1 REMARK 44 REMARK 44 model 1 is called model1.ts-submitted ATOM 1 N MET A 1 5.334 -13.629 52.378 1.00 0.00 ATOM 2 CA MET A 1 5.299 -12.797 51.180 1.00 0.00 ATOM 3 CB MET A 1 5.590 -11.318 51.433 1.00 0.00 ATOM 4 CG MET A 1 5.015 -10.469 50.307 1.00 0.00 ATOM 5 SD MET A 1 3.759 -11.468 49.442 1.00 0.00 ATOM 6 CE MET A 1 2.458 -10.282 49.241 1.00 0.00 ATOM 7 O MET A 1 6.506 -12.690 49.108 1.00 0.00 ATOM 8 C MET A 1 6.488 -13.091 50.271 1.00 0.00 ATOM 9 N ALA A 2 7.428 -13.946 50.684 1.00 0.00 ATOM 10 CA ALA A 2 8.509 -14.384 49.809 1.00 0.00 ATOM 11 CB ALA A 2 9.540 -15.180 50.599 1.00 0.00 ATOM 12 O ALA A 2 8.582 -15.248 47.571 1.00 0.00 ATOM 13 C ALA A 2 7.975 -15.208 48.644 1.00 0.00 ATOM 14 N THR A 3 6.838 -15.861 48.858 1.00 0.00 ATOM 15 CA THR A 3 6.276 -16.766 47.863 1.00 0.00 ATOM 16 CB THR A 3 5.232 -17.711 48.485 1.00 0.00 ATOM 17 CG2 THR A 3 5.864 -18.563 49.574 1.00 0.00 ATOM 18 OG1 THR A 3 4.161 -16.940 49.046 1.00 0.00 ATOM 19 O THR A 3 5.268 -16.571 45.693 1.00 0.00 ATOM 20 C THR A 3 5.635 -15.992 46.716 1.00 0.00 ATOM 21 N LEU A 4 5.502 -14.682 46.892 1.00 0.00 ATOM 22 CA LEU A 4 4.936 -13.823 45.859 1.00 0.00 ATOM 23 CB LEU A 4 3.902 -12.870 46.472 1.00 0.00 ATOM 24 CG LEU A 4 2.749 -13.552 47.220 1.00 0.00 ATOM 25 CD1 LEU A 4 1.844 -12.502 47.851 1.00 0.00 ATOM 26 CD2 LEU A 4 1.967 -14.430 46.255 1.00 0.00 ATOM 27 O LEU A 4 7.134 -12.884 45.643 1.00 0.00 ATOM 28 C LEU A 4 6.021 -13.034 45.137 1.00 0.00 ATOM 29 N THR A 5 5.693 -12.530 43.952 1.00 0.00 ATOM 30 CA THR A 5 6.637 -11.749 43.161 1.00 0.00 ATOM 31 CB THR A 5 6.159 -11.590 41.705 1.00 0.00 ATOM 32 CG2 THR A 5 7.156 -10.766 40.906 1.00 0.00 ATOM 33 OG1 THR A 5 6.021 -12.883 41.102 1.00 0.00 ATOM 34 O THR A 5 5.936 -9.822 44.411 1.00 0.00 ATOM 35 C THR A 5 6.862 -10.405 43.839 1.00 0.00 ATOM 36 N GLU A 6 8.114 -9.947 43.849 1.00 0.00 ATOM 37 CA GLU A 6 8.460 -8.668 44.448 1.00 0.00 ATOM 38 CB GLU A 6 9.960 -8.402 44.309 1.00 0.00 ATOM 39 CG GLU A 6 10.427 -7.092 44.924 1.00 0.00 ATOM 40 CD GLU A 6 11.917 -6.929 44.800 1.00 0.00 ATOM 41 OE1 GLU A 6 12.550 -7.814 44.278 1.00 0.00 ATOM 42 OE2 GLU A 6 12.408 -5.873 45.125 1.00 0.00 ATOM 43 O GLU A 6 6.920 -6.817 44.414 1.00 0.00 ATOM 44 C GLU A 6 7.595 -7.609 43.748 1.00 0.00 ATOM 45 N ASP A 7 7.569 -7.605 42.440 1.00 0.00 ATOM 46 CA ASP A 7 6.815 -6.613 41.691 1.00 0.00 ATOM 47 CB ASP A 7 7.029 -6.730 40.187 1.00 0.00 ATOM 48 CG ASP A 7 8.322 -6.023 39.725 1.00 0.00 ATOM 49 OD1 ASP A 7 8.928 -5.308 40.532 1.00 0.00 ATOM 50 OD2 ASP A 7 8.626 -6.248 38.549 1.00 0.00 ATOM 51 O ASP A 7 4.638 -5.733 42.118 1.00 0.00 ATOM 52 C ASP A 7 5.304 -6.749 41.978 1.00 0.00 ATOM 53 N ASP A 8 4.846 -7.989 42.068 1.00 0.00 ATOM 54 CA ASP A 8 3.429 -8.208 42.408 1.00 0.00 ATOM 55 CB ASP A 8 3.099 -9.692 42.547 1.00 0.00 ATOM 56 CG ASP A 8 3.154 -10.602 41.363 1.00 0.00 ATOM 57 OD1 ASP A 8 3.032 -10.063 40.232 1.00 0.00 ATOM 58 OD2 ASP A 8 3.291 -11.854 41.480 1.00 0.00 ATOM 59 O ASP A 8 2.064 -6.853 43.879 1.00 0.00 ATOM 60 C ASP A 8 3.085 -7.543 43.727 1.00 0.00 ATOM 61 N VAL A 9 3.874 -7.860 44.796 1.00 0.00 ATOM 62 CA VAL A 9 3.499 -7.335 46.103 1.00 0.00 ATOM 63 CB VAL A 9 4.300 -8.058 47.228 1.00 0.00 ATOM 64 CG1 VAL A 9 4.018 -7.403 48.570 1.00 0.00 ATOM 65 CG2 VAL A 9 3.906 -9.531 47.281 1.00 0.00 ATOM 66 O VAL A 9 2.819 -5.145 46.766 1.00 0.00 ATOM 67 C VAL A 9 3.623 -5.828 46.131 1.00 0.00 ATOM 68 N LEU A 10 4.597 -5.256 45.417 1.00 0.00 ATOM 69 CA LEU A 10 4.726 -3.797 45.381 1.00 0.00 ATOM 70 CB LEU A 10 5.967 -3.400 44.581 1.00 0.00 ATOM 71 CG LEU A 10 6.286 -1.914 44.548 1.00 0.00 ATOM 72 CD1 LEU A 10 6.453 -1.300 45.939 1.00 0.00 ATOM 73 CD2 LEU A 10 7.592 -1.722 43.768 1.00 0.00 ATOM 74 O LEU A 10 2.935 -2.152 45.298 1.00 0.00 ATOM 75 C LEU A 10 3.508 -3.106 44.748 1.00 0.00 ATOM 76 N GLU A 11 3.080 -3.618 43.593 1.00 0.00 ATOM 77 CA GLU A 11 1.914 -3.088 42.929 1.00 0.00 ATOM 78 CB GLU A 11 1.621 -3.862 41.631 1.00 0.00 ATOM 79 CG GLU A 11 0.364 -3.216 40.970 1.00 0.00 ATOM 80 CD GLU A 11 0.359 -3.231 39.478 1.00 0.00 ATOM 81 OE1 GLU A 11 -0.216 -2.324 38.811 1.00 0.00 ATOM 82 OE2 GLU A 11 0.927 -4.187 38.895 1.00 0.00 ATOM 83 O GLU A 11 -0.070 -2.235 43.926 1.00 0.00 ATOM 84 C GLU A 11 0.700 -3.177 43.830 1.00 0.00 ATOM 85 N GLN A 12 0.507 -4.298 44.513 1.00 0.00 ATOM 86 CA GLN A 12 -0.692 -4.443 45.360 1.00 0.00 ATOM 87 CB GLN A 12 -0.729 -5.896 45.861 1.00 0.00 ATOM 88 CG GLN A 12 -1.833 -6.285 46.799 1.00 0.00 ATOM 89 CD GLN A 12 -1.633 -7.674 47.401 1.00 0.00 ATOM 90 OE1 GLN A 12 -1.334 -7.875 48.585 1.00 0.00 ATOM 91 NE2 GLN A 12 -1.790 -8.700 46.575 1.00 0.00 ATOM 92 O GLN A 12 -1.680 -2.807 46.848 1.00 0.00 ATOM 93 C GLN A 12 -0.671 -3.418 46.481 1.00 0.00 ATOM 94 N LEU A 13 0.493 -3.198 47.079 1.00 0.00 ATOM 95 CA LEU A 13 0.609 -2.232 48.165 1.00 0.00 ATOM 96 CB LEU A 13 2.019 -2.283 48.769 1.00 0.00 ATOM 97 CG LEU A 13 2.350 -3.565 49.545 1.00 0.00 ATOM 98 CD1 LEU A 13 3.821 -3.568 49.941 1.00 0.00 ATOM 99 CD2 LEU A 13 1.460 -3.659 50.775 1.00 0.00 ATOM 100 O LEU A 13 -0.300 -0.025 48.417 1.00 0.00 ATOM 101 C LEU A 13 0.288 -0.821 47.686 1.00 0.00 ATOM 102 N ASP A 14 0.679 -0.517 46.453 1.00 0.00 ATOM 103 CA ASP A 14 0.393 0.782 45.856 1.00 0.00 ATOM 104 CB ASP A 14 -1.108 0.940 45.608 1.00 0.00 ATOM 105 CG ASP A 14 -1.469 2.029 44.608 1.00 0.00 ATOM 106 OD1 ASP A 14 -0.602 2.452 43.879 1.00 0.00 ATOM 107 OD2 ASP A 14 -2.634 2.319 44.470 1.00 0.00 ATOM 108 O ASP A 14 0.220 2.928 46.919 1.00 0.00 ATOM 109 C ASP A 14 0.900 1.918 46.739 1.00 0.00 ATOM 110 N ALA A 15 2.097 1.745 47.287 1.00 0.00 ATOM 111 CA ALA A 15 2.711 2.767 48.126 1.00 0.00 ATOM 112 CB ALA A 15 4.057 2.286 48.650 1.00 0.00 ATOM 113 O ALA A 15 3.111 4.112 46.177 1.00 0.00 ATOM 114 C ALA A 15 2.916 4.090 47.394 1.00 0.00 ATOM 115 N GLN A 16 2.821 5.186 48.095 1.00 0.00 ATOM 116 CA GLN A 16 3.018 6.507 47.510 1.00 0.00 ATOM 117 CB GLN A 16 2.754 7.604 48.544 1.00 0.00 ATOM 118 CG GLN A 16 1.300 7.732 48.960 1.00 0.00 ATOM 119 CD GLN A 16 0.394 8.098 47.800 1.00 0.00 ATOM 120 OE1 GLN A 16 0.648 9.068 47.079 1.00 0.00 ATOM 121 NE2 GLN A 16 -0.672 7.327 47.614 1.00 0.00 ATOM 122 O GLN A 16 5.387 6.286 47.746 1.00 0.00 ATOM 123 C GLN A 16 4.454 6.687 47.051 1.00 0.00 ATOM 124 N ASP A 17 4.626 7.322 45.874 1.00 0.00 ATOM 125 CA ASP A 17 5.963 7.522 45.331 1.00 0.00 ATOM 126 CB ASP A 17 5.878 7.924 43.854 1.00 0.00 ATOM 127 CG ASP A 17 5.523 6.782 42.912 1.00 0.00 ATOM 128 OD1 ASP A 17 5.581 5.651 43.332 1.00 0.00 ATOM 129 OD2 ASP A 17 5.050 7.055 41.834 1.00 0.00 ATOM 130 O ASP A 17 7.927 8.752 45.881 1.00 0.00 ATOM 131 C ASP A 17 6.713 8.679 45.952 1.00 0.00 ATOM 132 N ASN A 18 5.905 9.698 46.544 1.00 0.00 ATOM 133 CA ASN A 18 6.549 10.830 47.112 1.00 0.00 ATOM 134 CB ASN A 18 5.500 11.881 47.425 1.00 0.00 ATOM 135 CG ASN A 18 5.040 12.655 46.221 1.00 0.00 ATOM 136 ND2 ASN A 18 3.902 13.287 46.359 1.00 0.00 ATOM 137 OD1 ASN A 18 5.740 12.739 45.206 1.00 0.00 ATOM 138 O ASN A 18 6.717 9.488 49.094 1.00 0.00 ATOM 139 C ASN A 18 7.238 10.346 48.382 1.00 0.00 ATOM 140 N LEU A 19 8.420 10.890 48.653 1.00 0.00 ATOM 141 CA LEU A 19 9.177 10.523 49.845 1.00 0.00 ATOM 142 CB LEU A 19 10.548 11.211 49.835 1.00 0.00 ATOM 143 CG LEU A 19 11.485 10.815 50.984 1.00 0.00 ATOM 144 CD1 LEU A 19 11.768 9.321 50.934 1.00 0.00 ATOM 145 CD2 LEU A 19 12.777 11.614 50.884 1.00 0.00 ATOM 146 O LEU A 19 8.154 10.010 51.961 1.00 0.00 ATOM 147 C LEU A 19 8.296 10.833 51.058 1.00 0.00 ATOM 148 N PHE A 20 7.676 11.989 51.025 1.00 0.00 ATOM 149 CA PHE A 20 6.817 12.401 52.129 1.00 0.00 ATOM 150 CB PHE A 20 6.426 13.870 51.954 1.00 0.00 ATOM 151 CG PHE A 20 5.577 14.408 53.071 1.00 0.00 ATOM 152 CD1 PHE A 20 6.151 14.803 54.270 1.00 0.00 ATOM 153 CD2 PHE A 20 4.203 14.520 52.924 1.00 0.00 ATOM 154 CE1 PHE A 20 5.371 15.298 55.297 1.00 0.00 ATOM 155 CE2 PHE A 20 3.420 15.016 53.948 1.00 0.00 ATOM 156 CZ PHE A 20 4.005 15.405 55.137 1.00 0.00 ATOM 157 O PHE A 20 5.263 11.054 53.366 1.00 0.00 ATOM 158 C PHE A 20 5.569 11.538 52.277 1.00 0.00 ATOM 159 N SER A 21 4.857 11.343 51.173 1.00 0.00 ATOM 160 CA SER A 21 3.643 10.535 51.175 1.00 0.00 ATOM 161 CB SER A 21 2.948 10.633 49.831 1.00 0.00 ATOM 162 OG SER A 21 2.475 11.927 49.577 1.00 0.00 ATOM 163 O SER A 21 3.247 8.474 52.324 1.00 0.00 ATOM 164 C SER A 21 3.982 9.105 51.567 1.00 0.00 ATOM 165 N PHE A 22 5.112 8.607 51.040 1.00 0.00 ATOM 166 CA PHE A 22 5.536 7.241 51.334 1.00 0.00 ATOM 167 CB PHE A 22 6.810 6.910 50.556 1.00 0.00 ATOM 168 CG PHE A 22 7.216 5.466 50.645 1.00 0.00 ATOM 169 CD1 PHE A 22 6.773 4.546 49.707 1.00 0.00 ATOM 170 CD2 PHE A 22 8.041 5.024 51.667 1.00 0.00 ATOM 171 CE1 PHE A 22 7.145 3.216 49.788 1.00 0.00 ATOM 172 CE2 PHE A 22 8.417 3.698 51.751 1.00 0.00 ATOM 173 CZ PHE A 22 7.968 2.793 50.811 1.00 0.00 ATOM 174 O PHE A 22 5.382 6.082 53.440 1.00 0.00 ATOM 175 C PHE A 22 5.800 7.071 52.831 1.00 0.00 ATOM 176 N MET A 23 6.504 8.022 53.422 1.00 0.00 ATOM 177 CA MET A 23 6.802 7.960 54.849 1.00 0.00 ATOM 178 CB MET A 23 7.772 9.079 55.221 1.00 0.00 ATOM 179 CG MET A 23 9.182 8.898 54.675 1.00 0.00 ATOM 180 SD MET A 23 10.380 9.985 55.470 1.00 0.00 ATOM 181 CE MET A 23 9.968 11.555 54.714 1.00 0.00 ATOM 182 O MET A 23 5.441 7.483 56.767 1.00 0.00 ATOM 183 C MET A 23 5.532 8.063 55.686 1.00 0.00 ATOM 184 N LYS A 24 4.554 8.806 55.179 1.00 0.00 ATOM 185 CA LYS A 24 3.271 8.951 55.858 1.00 0.00 ATOM 186 CB LYS A 24 2.410 10.003 55.158 1.00 0.00 ATOM 187 CG LYS A 24 1.067 10.262 55.824 1.00 0.00 ATOM 188 CD LYS A 24 0.304 11.373 55.120 1.00 0.00 ATOM 189 CE LYS A 24 -1.054 11.610 55.765 1.00 0.00 ATOM 190 NZ LYS A 24 -1.825 12.675 55.068 1.00 0.00 ATOM 191 O LYS A 24 1.988 7.254 56.969 1.00 0.00 ATOM 192 C LYS A 24 2.529 7.623 55.923 1.00 0.00 ATOM 193 N THR A 25 2.503 6.908 54.804 1.00 0.00 ATOM 194 CA THR A 25 1.806 5.630 54.726 1.00 0.00 ATOM 195 CB THR A 25 1.921 5.009 53.323 1.00 0.00 ATOM 196 CG2 THR A 25 1.231 3.654 53.280 1.00 0.00 ATOM 197 OG1 THR A 25 1.314 5.880 52.360 1.00 0.00 ATOM 198 O THR A 25 1.595 3.868 56.342 1.00 0.00 ATOM 199 C THR A 25 2.350 4.632 55.744 1.00 0.00 ATOM 200 N ALA A 26 3.666 4.646 55.934 1.00 0.00 ATOM 201 CA ALA A 26 4.319 3.719 56.851 1.00 0.00 ATOM 202 CB ALA A 26 5.831 3.846 56.748 1.00 0.00 ATOM 203 O ALA A 26 3.511 3.025 59.003 1.00 0.00 ATOM 204 C ALA A 26 3.848 3.965 58.281 1.00 0.00 ATOM 205 N HIS A 27 3.841 5.229 58.689 1.00 0.00 ATOM 206 CA HIS A 27 3.399 5.601 60.028 1.00 0.00 ATOM 207 CB HIS A 27 3.543 7.111 60.246 1.00 0.00 ATOM 208 CG HIS A 27 3.572 7.511 61.689 1.00 0.00 ATOM 209 CD2 HIS A 27 2.693 8.218 62.436 1.00 0.00 ATOM 210 ND1 HIS A 27 4.609 7.173 62.532 1.00 0.00 ATOM 211 CE1 HIS A 27 4.364 7.658 63.738 1.00 0.00 ATOM 212 NE2 HIS A 27 3.209 8.295 63.706 1.00 0.00 ATOM 213 O HIS A 27 1.653 4.566 61.322 1.00 0.00 ATOM 214 C HIS A 27 1.982 5.081 60.250 1.00 0.00 ATOM 215 N SER A 28 1.139 5.208 59.226 1.00 0.00 ATOM 216 CA SER A 28 -0.236 4.739 59.322 1.00 0.00 ATOM 217 CB SER A 28 -1.004 5.200 58.097 1.00 0.00 ATOM 218 OG SER A 28 -1.056 6.597 58.006 1.00 0.00 ATOM 219 O SER A 28 -1.170 2.738 60.236 1.00 0.00 ATOM 220 C SER A 28 -0.287 3.221 59.533 1.00 0.00 ATOM 221 N ILE A 29 0.616 2.500 58.909 1.00 0.00 ATOM 222 CA ILE A 29 0.709 1.060 59.173 1.00 0.00 ATOM 223 CB ILE A 29 1.755 0.410 58.248 1.00 0.00 ATOM 224 CG1 ILE A 29 1.290 0.471 56.790 1.00 0.00 ATOM 225 CG2 ILE A 29 2.017 -1.027 58.668 1.00 0.00 ATOM 226 CD1 ILE A 29 2.361 0.100 55.791 1.00 0.00 ATOM 227 O ILE A 29 0.469 -0.127 61.246 1.00 0.00 ATOM 228 C ILE A 29 1.051 0.764 60.630 1.00 0.00 ATOM 229 N LEU A 30 2.001 1.520 61.172 1.00 0.00 ATOM 230 CA LEU A 30 2.339 1.424 62.588 1.00 0.00 ATOM 231 CB LEU A 30 3.542 2.319 62.909 1.00 0.00 ATOM 232 CG LEU A 30 4.009 2.289 64.369 1.00 0.00 ATOM 233 CD1 LEU A 30 4.445 0.881 64.750 1.00 0.00 ATOM 234 CD2 LEU A 30 5.151 3.276 64.559 1.00 0.00 ATOM 235 O LEU A 30 0.888 1.169 64.499 1.00 0.00 ATOM 236 C LEU A 30 1.162 1.809 63.481 1.00 0.00 ATOM 237 N LEU A 31 0.470 2.878 63.114 1.00 0.00 ATOM 238 CA LEU A 31 -0.642 3.333 63.893 1.00 0.00 ATOM 239 CB LEU A 31 -1.179 4.666 63.358 1.00 0.00 ATOM 240 CG LEU A 31 -2.388 5.233 64.112 1.00 0.00 ATOM 241 CD1 LEU A 31 -2.016 5.509 65.563 1.00 0.00 ATOM 242 CD2 LEU A 31 -2.863 6.505 63.426 1.00 0.00 ATOM 243 O LEU A 31 -2.262 1.915 64.952 1.00 0.00 ATOM 244 C LEU A 31 -1.728 2.263 63.900 1.00 0.00 ATOM 245 N GLN A 32 -2.050 1.747 62.719 1.00 0.00 ATOM 246 CA GLN A 32 -3.057 0.699 62.590 1.00 0.00 ATOM 247 CB GLN A 32 -3.367 0.436 61.114 1.00 0.00 ATOM 248 CG GLN A 32 -4.104 1.570 60.421 1.00 0.00 ATOM 249 CD GLN A 32 -4.296 1.315 58.937 1.00 0.00 ATOM 250 OE1 GLN A 32 -3.796 0.325 58.393 1.00 0.00 ATOM 251 NE2 GLN A 32 -5.019 2.208 58.273 1.00 0.00 ATOM 252 O GLN A 32 -3.421 -1.284 63.893 1.00 0.00 ATOM 253 C GLN A 32 -2.618 -0.596 63.262 1.00 0.00 ATOM 254 N GLY A 33 -1.337 -0.925 63.122 1.00 0.00 ATOM 255 CA GLY A 33 -0.798 -2.159 63.678 1.00 0.00 ATOM 256 O GLY A 33 -1.264 -3.152 65.813 1.00 0.00 ATOM 257 C GLY A 33 -0.875 -2.158 65.202 1.00 0.00 ATOM 258 N ILE A 34 -0.510 -1.032 65.806 1.00 0.00 ATOM 259 CA ILE A 34 -0.530 -0.903 67.258 1.00 0.00 ATOM 260 CB ILE A 34 0.142 0.433 67.705 1.00 0.00 ATOM 261 CG1 ILE A 34 1.628 0.389 67.290 1.00 0.00 ATOM 262 CG2 ILE A 34 0.036 0.627 69.230 1.00 0.00 ATOM 263 CD1 ILE A 34 2.391 1.670 67.571 1.00 0.00 ATOM 264 O ILE A 34 -2.199 -1.780 68.734 1.00 0.00 ATOM 265 C ILE A 34 -1.962 -1.039 67.763 1.00 0.00 ATOM 266 N ARG A 35 -2.913 -0.392 67.118 1.00 0.00 ATOM 267 CA ARG A 35 -4.300 -0.502 67.564 1.00 0.00 ATOM 268 CB ARG A 35 -5.182 0.493 66.825 1.00 0.00 ATOM 269 CG ARG A 35 -5.000 1.944 67.242 1.00 0.00 ATOM 270 CD ARG A 35 -5.818 2.911 66.468 1.00 0.00 ATOM 271 NE ARG A 35 -5.624 4.303 66.845 1.00 0.00 ATOM 272 CZ ARG A 35 -6.210 5.350 66.234 1.00 0.00 ATOM 273 NH1 ARG A 35 -6.994 5.174 65.192 1.00 0.00 ATOM 274 NH2 ARG A 35 -5.956 6.563 66.693 1.00 0.00 ATOM 275 O ARG A 35 -5.395 -2.510 68.313 1.00 0.00 ATOM 276 C ARG A 35 -4.757 -1.955 67.415 1.00 0.00 ATOM 277 N GLN A 36 -4.436 -2.554 66.286 1.00 0.00 ATOM 278 CA GLN A 36 -4.810 -3.938 66.015 1.00 0.00 ATOM 279 CB GLN A 36 -4.787 -4.207 64.494 1.00 0.00 ATOM 280 CG GLN A 36 -5.845 -3.446 63.704 1.00 0.00 ATOM 281 CD GLN A 36 -6.036 -4.007 62.308 1.00 0.00 ATOM 282 OE1 GLN A 36 -6.394 -5.172 62.145 1.00 0.00 ATOM 283 NE2 GLN A 36 -5.795 -3.180 61.296 1.00 0.00 ATOM 284 O GLN A 36 -4.500 -5.871 67.375 1.00 0.00 ATOM 285 C GLN A 36 -3.983 -4.874 66.888 1.00 0.00 ATOM 286 N PHE A 37 -2.705 -4.576 67.068 1.00 0.00 ATOM 287 CA PHE A 37 -1.852 -5.396 67.916 1.00 0.00 ATOM 288 CB PHE A 37 -0.413 -4.887 67.815 1.00 0.00 ATOM 289 CG PHE A 37 0.263 -5.235 66.520 1.00 0.00 ATOM 290 CD1 PHE A 37 -0.252 -6.227 65.698 1.00 0.00 ATOM 291 CD2 PHE A 37 1.415 -4.575 66.122 1.00 0.00 ATOM 292 CE1 PHE A 37 0.369 -6.548 64.506 1.00 0.00 ATOM 293 CE2 PHE A 37 2.037 -4.894 64.931 1.00 0.00 ATOM 294 CZ PHE A 37 1.514 -5.883 64.121 1.00 0.00 ATOM 295 O PHE A 37 -2.349 -6.523 69.983 1.00 0.00 ATOM 296 C PHE A 37 -2.327 -5.454 69.371 1.00 0.00 ATOM 297 N LEU A 38 -2.714 -4.308 69.918 1.00 0.00 ATOM 298 CA LEU A 38 -3.195 -4.260 71.296 1.00 0.00 ATOM 299 CB LEU A 38 -3.381 -2.821 71.704 1.00 0.00 ATOM 300 CG LEU A 38 -2.098 -1.971 71.766 1.00 0.00 ATOM 301 CD1 LEU A 38 -2.444 -0.514 72.030 1.00 0.00 ATOM 302 CD2 LEU A 38 -1.182 -2.480 72.795 1.00 0.00 ATOM 303 O LEU A 38 -4.648 -5.839 72.311 1.00 0.00 ATOM 304 C LEU A 38 -4.526 -5.016 71.419 1.00 0.00 ATOM 305 N PRO A 39 -5.467 -4.799 70.542 1.00 0.00 ATOM 306 CA PRO A 39 -6.668 -5.646 70.589 1.00 0.00 ATOM 307 CB PRO A 39 -7.469 -5.184 69.366 1.00 0.00 ATOM 308 CG PRO A 39 -7.068 -3.784 69.186 1.00 0.00 ATOM 309 CD PRO A 39 -5.598 -3.727 69.538 1.00 0.00 ATOM 310 O PRO A 39 -7.128 -7.907 71.132 1.00 0.00 ATOM 311 C PRO A 39 -6.402 -7.141 70.491 1.00 0.00 ATOM 312 N SER A 40 -5.349 -7.547 69.758 1.00 0.00 ATOM 313 CA SER A 40 -5.049 -8.988 69.665 1.00 0.00 ATOM 314 CB SER A 40 -4.106 -9.241 68.443 1.00 0.00 ATOM 315 OG SER A 40 -2.778 -8.835 68.730 1.00 0.00 ATOM 316 O SER A 40 -4.641 -10.804 71.180 1.00 0.00 ATOM 317 C SER A 40 -4.544 -9.596 70.971 1.00 0.00 ATOM 318 N LEU A 41 -4.007 -8.750 71.844 1.00 0.00 ATOM 319 CA LEU A 41 -3.517 -9.197 73.142 1.00 0.00 ATOM 320 CB LEU A 41 -2.332 -8.350 73.591 1.00 0.00 ATOM 321 CG LEU A 41 -1.021 -8.604 72.834 1.00 0.00 ATOM 322 CD1 LEU A 41 -0.099 -7.413 72.981 1.00 0.00 ATOM 323 CD2 LEU A 41 -0.367 -9.877 73.352 1.00 0.00 ATOM 324 O LEU A 41 -4.555 -9.724 75.244 1.00 0.00 ATOM 325 C LEU A 41 -4.617 -9.076 74.196 1.00 0.00 ATOM 326 N PHE A 42 -5.606 -8.278 73.900 1.00 0.00 ATOM 327 CA PHE A 42 -6.748 -8.065 74.797 1.00 0.00 ATOM 328 CB PHE A 42 -7.694 -6.992 74.254 1.00 0.00 ATOM 329 CG PHE A 42 -8.737 -6.548 75.238 1.00 0.00 ATOM 330 CD1 PHE A 42 -8.395 -5.750 76.320 1.00 0.00 ATOM 331 CD2 PHE A 42 -10.062 -6.925 75.086 1.00 0.00 ATOM 332 CE1 PHE A 42 -9.353 -5.342 77.228 1.00 0.00 ATOM 333 CE2 PHE A 42 -11.023 -6.517 75.991 1.00 0.00 ATOM 334 CZ PHE A 42 -10.668 -5.724 77.063 1.00 0.00 ATOM 335 O PHE A 42 -8.200 -9.491 76.070 1.00 0.00 ATOM 336 C PHE A 42 -7.513 -9.356 75.058 1.00 0.00 ATOM 337 N VAL A 43 -7.416 -10.296 74.122 1.00 0.00 ATOM 338 CA VAL A 43 -7.977 -11.628 74.312 1.00 0.00 ATOM 339 CB VAL A 43 -7.696 -12.538 73.101 1.00 0.00 ATOM 340 CG1 VAL A 43 -8.109 -13.970 73.404 1.00 0.00 ATOM 341 CG2 VAL A 43 -8.423 -12.025 71.869 1.00 0.00 ATOM 342 O VAL A 43 -8.122 -13.025 76.259 1.00 0.00 ATOM 343 C VAL A 43 -7.416 -12.293 75.564 1.00 0.00 ATOM 344 N ASP A 44 -6.144 -12.034 75.848 1.00 0.00 ATOM 345 CA ASP A 44 -5.517 -12.520 77.070 1.00 0.00 ATOM 346 CB ASP A 44 -4.007 -12.686 76.874 1.00 0.00 ATOM 347 CG ASP A 44 -3.615 -13.854 75.977 1.00 0.00 ATOM 348 OD1 ASP A 44 -4.446 -14.697 75.736 1.00 0.00 ATOM 349 OD2 ASP A 44 -2.545 -13.813 75.418 1.00 0.00 ATOM 350 O ASP A 44 -5.375 -11.834 79.366 1.00 0.00 ATOM 351 C ASP A 44 -5.791 -11.578 78.237 1.00 0.00 ATOM 352 N ASN A 45 -6.492 -10.484 77.956 1.00 0.00 ATOM 353 CA ASN A 45 -6.808 -9.491 78.976 1.00 0.00 ATOM 354 CB ASN A 45 -7.920 -9.947 79.890 1.00 0.00 ATOM 355 CG ASN A 45 -9.174 -10.170 79.121 1.00 0.00 ATOM 356 ND2 ASN A 45 -9.763 -11.347 79.262 1.00 0.00 ATOM 357 OD1 ASN A 45 -9.598 -9.294 78.367 1.00 0.00 ATOM 358 O ASN A 45 -5.529 -9.197 80.987 1.00 0.00 ATOM 359 C ASN A 45 -5.570 -9.072 79.762 1.00 0.00 ATOM 360 N ASP A 46 -4.565 -8.574 79.051 1.00 0.00 ATOM 361 CA ASP A 46 -3.318 -8.149 79.678 1.00 0.00 ATOM 362 CB ASP A 46 -2.279 -8.993 79.871 1.00 0.00 ATOM 363 CG ASP A 46 -1.128 -8.357 80.577 1.00 0.00 ATOM 364 OD1 ASP A 46 -1.365 -7.457 81.448 1.00 0.00 ATOM 365 OD2 ASP A 46 0.020 -8.772 80.324 1.00 0.00 ATOM 366 O ASP A 46 -2.872 -6.003 78.696 1.00 0.00 ATOM 367 C ASP A 46 -3.191 -6.629 79.708 1.00 0.00 ATOM 368 N GLU A 47 -3.439 -6.043 80.874 1.00 0.00 ATOM 369 CA GLU A 47 -3.419 -4.592 81.020 1.00 0.00 ATOM 370 CB GLU A 47 -3.939 -4.187 82.402 1.00 0.00 ATOM 371 CG GLU A 47 -5.431 -4.407 82.602 1.00 0.00 ATOM 372 CD GLU A 47 -5.842 -4.104 84.017 1.00 0.00 ATOM 373 OE1 GLU A 47 -4.985 -3.808 84.815 1.00 0.00 ATOM 374 OE2 GLU A 47 -7.022 -4.059 84.273 1.00 0.00 ATOM 375 O GLU A 47 -1.842 -2.996 80.168 1.00 0.00 ATOM 376 C GLU A 47 -2.016 -4.035 80.803 1.00 0.00 ATOM 377 N GLU A 48 -1.017 -4.742 81.322 1.00 0.00 ATOM 378 CA GLU A 48 0.372 -4.336 81.162 1.00 0.00 ATOM 379 CB GLU A 48 1.316 -5.295 81.970 1.00 0.00 ATOM 380 CG GLU A 48 1.227 -5.059 83.465 1.00 0.00 ATOM 381 CD GLU A 48 1.791 -6.195 84.314 1.00 0.00 ATOM 382 OE1 GLU A 48 1.789 -7.382 83.878 1.00 0.00 ATOM 383 OE2 GLU A 48 2.218 -5.874 85.438 1.00 0.00 ATOM 384 O GLU A 48 1.420 -3.495 79.162 1.00 0.00 ATOM 385 C GLU A 48 0.784 -4.411 79.693 1.00 0.00 ATOM 386 N ILE A 49 0.399 -5.506 79.041 1.00 0.00 ATOM 387 CA ILE A 49 0.721 -5.708 77.630 1.00 0.00 ATOM 388 CB ILE A 49 0.265 -7.078 77.141 1.00 0.00 ATOM 389 CG1 ILE A 49 1.149 -8.182 77.733 1.00 0.00 ATOM 390 CG2 ILE A 49 0.306 -7.142 75.597 1.00 0.00 ATOM 391 CD1 ILE A 49 0.619 -9.564 77.517 1.00 0.00 ATOM 392 O ILE A 49 0.796 -3.999 75.947 1.00 0.00 ATOM 393 C ILE A 49 0.103 -4.638 76.737 1.00 0.00 ATOM 394 N VAL A 50 -1.206 -4.445 76.872 1.00 0.00 ATOM 395 CA VAL A 50 -1.921 -3.463 76.067 1.00 0.00 ATOM 396 CB VAL A 50 -3.444 -3.555 76.283 1.00 0.00 ATOM 397 CG1 VAL A 50 -3.911 -4.999 76.176 1.00 0.00 ATOM 398 CG2 VAL A 50 -3.826 -2.973 77.637 1.00 0.00 ATOM 399 O VAL A 50 -1.319 -1.212 75.489 1.00 0.00 ATOM 400 C VAL A 50 -1.459 -2.044 76.384 1.00 0.00 ATOM 401 N GLU A 51 -1.202 -1.784 77.663 1.00 0.00 ATOM 402 CA GLU A 51 -0.747 -0.471 78.100 1.00 0.00 ATOM 403 CB GLU A 51 -0.799 -0.366 79.625 1.00 0.00 ATOM 404 CG GLU A 51 -0.405 0.998 80.176 1.00 0.00 ATOM 405 CD GLU A 51 -0.555 1.047 81.671 1.00 0.00 ATOM 406 OE1 GLU A 51 -0.966 0.063 82.240 1.00 0.00 ATOM 407 OE2 GLU A 51 -0.154 2.026 82.257 1.00 0.00 ATOM 408 O GLU A 51 1.008 0.959 77.297 1.00 0.00 ATOM 409 C GLU A 51 0.667 -0.184 77.599 1.00 0.00 ATOM 410 N TYR A 52 1.494 -1.223 77.552 1.00 0.00 ATOM 411 CA TYR A 52 2.828 -1.115 76.976 1.00 0.00 ATOM 412 CB TYR A 52 3.570 -2.419 77.004 1.00 0.00 ATOM 413 CG TYR A 52 4.347 -2.656 78.276 1.00 0.00 ATOM 414 CD1 TYR A 52 5.255 -1.706 78.753 1.00 0.00 ATOM 415 CD2 TYR A 52 4.230 -3.865 78.967 1.00 0.00 ATOM 416 CE1 TYR A 52 6.036 -1.960 79.890 1.00 0.00 ATOM 417 CE2 TYR A 52 5.004 -4.134 80.092 1.00 0.00 ATOM 418 CZ TYR A 52 5.907 -3.175 80.545 1.00 0.00 ATOM 419 OH TYR A 52 6.687 -3.456 81.639 1.00 0.00 ATOM 420 O TYR A 52 3.468 0.142 74.982 1.00 0.00 ATOM 421 C TYR A 52 2.701 -0.704 75.483 1.00 0.00 ATOM 422 N ALA A 53 1.748 -1.295 74.815 1.00 0.00 ATOM 423 CA ALA A 53 1.522 -0.916 73.411 1.00 0.00 ATOM 424 CB ALA A 53 0.423 -1.790 72.821 1.00 0.00 ATOM 425 O ALA A 53 1.615 1.261 72.407 1.00 0.00 ATOM 426 C ALA A 53 1.148 0.559 73.302 1.00 0.00 ATOM 427 N VAL A 54 0.302 1.018 74.218 1.00 0.00 ATOM 428 CA VAL A 54 -0.036 2.434 74.304 1.00 0.00 ATOM 429 CB VAL A 54 -1.112 2.694 75.376 1.00 0.00 ATOM 430 CG1 VAL A 54 -1.306 4.187 75.586 1.00 0.00 ATOM 431 CG2 VAL A 54 -2.425 2.038 74.982 1.00 0.00 ATOM 432 O VAL A 54 1.392 4.345 74.038 1.00 0.00 ATOM 433 C VAL A 54 1.188 3.282 74.626 1.00 0.00 ATOM 434 N LYS A 55 2.002 2.809 75.565 1.00 0.00 ATOM 435 CA LYS A 55 3.234 3.495 75.929 1.00 0.00 ATOM 436 CB LYS A 55 3.958 2.739 77.044 1.00 0.00 ATOM 437 CG LYS A 55 3.272 2.810 78.402 1.00 0.00 ATOM 438 CD LYS A 55 4.051 2.040 79.456 1.00 0.00 ATOM 439 CE LYS A 55 3.357 2.096 80.810 1.00 0.00 ATOM 440 NZ LYS A 55 4.092 1.319 81.844 1.00 0.00 ATOM 441 O LYS A 55 4.698 4.675 74.438 1.00 0.00 ATOM 442 C LYS A 55 4.117 3.609 74.660 1.00 0.00 ATOM 443 N PRO A 56 4.191 2.573 73.798 1.00 0.00 ATOM 444 CA PRO A 56 4.997 2.707 72.552 1.00 0.00 ATOM 445 CB PRO A 56 4.946 1.311 71.966 1.00 0.00 ATOM 446 CG PRO A 56 5.005 0.462 73.161 1.00 0.00 ATOM 447 CD PRO A 56 4.023 1.130 74.110 1.00 0.00 ATOM 448 O PRO A 56 5.300 4.524 71.031 1.00 0.00 ATOM 449 C PRO A 56 4.485 3.815 71.645 1.00 0.00 ATOM 450 N LEU A 57 3.181 3.989 71.559 1.00 0.00 ATOM 451 CA LEU A 57 2.602 5.043 70.743 1.00 0.00 ATOM 452 CB LEU A 57 1.088 4.830 70.625 1.00 0.00 ATOM 453 CG LEU A 57 0.658 3.726 69.651 1.00 0.00 ATOM 454 CD1 LEU A 57 -0.844 3.489 69.760 1.00 0.00 ATOM 455 CD2 LEU A 57 1.040 4.119 68.233 1.00 0.00 ATOM 456 O LEU A 57 3.203 7.362 70.579 1.00 0.00 ATOM 457 C LEU A 57 2.900 6.422 71.317 1.00 0.00 ATOM 458 N LEU A 58 2.826 6.536 72.640 1.00 0.00 ATOM 459 CA LEU A 58 3.100 7.799 73.317 1.00 0.00 ATOM 460 CB LEU A 58 2.647 7.725 74.780 1.00 0.00 ATOM 461 CG LEU A 58 1.128 7.669 74.990 1.00 0.00 ATOM 462 CD1 LEU A 58 0.813 7.413 76.459 1.00 0.00 ATOM 463 CD2 LEU A 58 0.501 8.977 74.526 1.00 0.00 ATOM 464 O LEU A 58 4.970 9.213 72.777 1.00 0.00 ATOM 465 C LEU A 58 4.597 8.109 73.174 1.00 0.00 ATOM 466 N ALA A 59 5.434 7.151 73.465 1.00 0.00 ATOM 467 CA ALA A 59 6.878 7.355 73.350 1.00 0.00 ATOM 468 CB ALA A 59 7.609 6.305 74.175 1.00 0.00 ATOM 469 O ALA A 59 8.448 7.736 71.582 1.00 0.00 ATOM 470 C ALA A 59 7.308 7.393 71.888 1.00 0.00 ATOM 471 N GLN A 60 6.389 7.055 70.979 1.00 0.00 ATOM 472 CA GLN A 60 6.708 7.092 69.560 1.00 0.00 ATOM 473 CB GLN A 60 5.545 6.478 68.774 1.00 0.00 ATOM 474 CG GLN A 60 4.296 7.342 68.736 1.00 0.00 ATOM 475 CD GLN A 60 3.319 6.900 67.662 1.00 0.00 ATOM 476 OE1 GLN A 60 3.581 5.949 66.919 1.00 0.00 ATOM 477 NE2 GLN A 60 2.189 7.590 67.571 1.00 0.00 ATOM 478 O GLN A 60 7.536 8.646 67.928 1.00 0.00 ATOM 479 C GLN A 60 7.006 8.489 69.027 1.00 0.00 ATOM 480 N SER A 61 6.663 9.503 69.817 1.00 0.00 ATOM 481 CA SER A 61 6.897 10.889 69.429 1.00 0.00 ATOM 482 CB SER A 61 5.629 11.701 69.608 1.00 0.00 ATOM 483 OG SER A 61 5.214 11.744 70.945 1.00 0.00 ATOM 484 O SER A 61 8.485 12.611 69.942 1.00 0.00 ATOM 485 C SER A 61 8.037 11.503 70.235 1.00 0.00 ATOM 486 N GLY A 62 8.551 10.744 71.197 1.00 0.00 ATOM 487 CA GLY A 62 9.711 11.169 71.971 1.00 0.00 ATOM 488 O GLY A 62 10.837 9.279 71.044 1.00 0.00 ATOM 489 C GLY A 62 10.843 10.154 71.915 1.00 0.00 ATOM 490 N PRO A 63 11.783 10.257 72.858 1.00 0.00 ATOM 491 CA PRO A 63 12.782 9.192 73.002 1.00 0.00 ATOM 492 CB PRO A 63 13.598 9.636 74.221 1.00 0.00 ATOM 493 CG PRO A 63 13.438 11.146 74.226 1.00 0.00 ATOM 494 CD PRO A 63 11.997 11.355 73.816 1.00 0.00 ATOM 495 O PRO A 63 11.035 7.758 73.808 1.00 0.00 ATOM 496 C PRO A 63 12.121 7.839 73.233 1.00 0.00 ATOM 497 N LEU A 64 12.782 6.777 72.782 1.00 0.00 ATOM 498 CA LEU A 64 12.155 5.465 72.697 1.00 0.00 ATOM 499 CB LEU A 64 12.402 4.833 71.340 1.00 0.00 ATOM 500 CG LEU A 64 11.897 5.668 70.128 1.00 0.00 ATOM 501 CD1 LEU A 64 12.084 4.859 68.883 1.00 0.00 ATOM 502 CD2 LEU A 64 10.443 6.075 70.305 1.00 0.00 ATOM 503 O LEU A 64 12.589 3.312 73.668 1.00 0.00 ATOM 504 C LEU A 64 12.669 4.536 73.791 1.00 0.00 ATOM 505 N ASP A 65 13.180 5.122 74.867 1.00 0.00 ATOM 506 CA ASP A 65 13.758 4.350 75.960 1.00 0.00 ATOM 507 CB ASP A 65 14.364 5.281 77.014 1.00 0.00 ATOM 508 CG ASP A 65 15.661 5.954 76.586 1.00 0.00 ATOM 509 OD1 ASP A 65 16.221 5.548 75.596 1.00 0.00 ATOM 510 OD2 ASP A 65 16.000 6.964 77.156 1.00 0.00 ATOM 511 O ASP A 65 12.916 2.259 76.747 1.00 0.00 ATOM 512 C ASP A 65 12.682 3.445 76.527 1.00 0.00 ATOM 513 N ASP A 66 11.476 3.939 76.716 1.00 0.00 ATOM 514 CA ASP A 66 10.393 3.149 77.263 1.00 0.00 ATOM 515 CB ASP A 66 9.229 4.068 77.643 1.00 0.00 ATOM 516 CG ASP A 66 9.494 4.948 78.857 1.00 0.00 ATOM 517 OD1 ASP A 66 10.452 4.698 79.551 1.00 0.00 ATOM 518 OD2 ASP A 66 8.836 5.951 78.995 1.00 0.00 ATOM 519 O ASP A 66 9.718 0.906 76.739 1.00 0.00 ATOM 520 C ASP A 66 9.860 2.057 76.336 1.00 0.00 ATOM 521 N ILE A 67 9.495 2.465 75.110 1.00 0.00 ATOM 522 CA ILE A 67 8.949 1.529 74.139 1.00 0.00 ATOM 523 CB ILE A 67 8.575 2.161 72.816 1.00 0.00 ATOM 524 CG1 ILE A 67 7.475 3.223 72.970 1.00 0.00 ATOM 525 CG2 ILE A 67 8.203 1.097 71.813 1.00 0.00 ATOM 526 CD1 ILE A 67 7.466 4.174 71.749 1.00 0.00 ATOM 527 O ILE A 67 9.567 -0.773 73.864 1.00 0.00 ATOM 528 C ILE A 67 9.930 0.382 73.943 1.00 0.00 ATOM 529 N ASP A 68 11.203 0.734 73.849 1.00 0.00 ATOM 530 CA ASP A 68 12.247 -0.300 73.637 1.00 0.00 ATOM 531 CB ASP A 68 13.616 0.364 73.471 1.00 0.00 ATOM 532 CG ASP A 68 13.817 1.058 72.129 1.00 0.00 ATOM 533 OD1 ASP A 68 13.022 0.844 71.245 1.00 0.00 ATOM 534 OD2 ASP A 68 14.668 1.913 72.049 1.00 0.00 ATOM 535 O ASP A 68 12.325 -2.495 74.626 1.00 0.00 ATOM 536 C ASP A 68 12.237 -1.279 74.810 1.00 0.00 ATOM 537 N VAL A 69 12.069 -0.751 76.007 1.00 0.00 ATOM 538 CA VAL A 69 12.019 -1.594 77.208 1.00 0.00 ATOM 539 CB VAL A 69 11.985 -0.743 78.492 1.00 0.00 ATOM 540 CG1 VAL A 69 11.716 -1.622 79.705 1.00 0.00 ATOM 541 CG2 VAL A 69 13.295 0.014 78.663 1.00 0.00 ATOM 542 O VAL A 69 10.888 -3.703 77.391 1.00 0.00 ATOM 543 C VAL A 69 10.791 -2.497 77.161 1.00 0.00 ATOM 544 N ALA A 70 9.637 -1.907 76.862 1.00 0.00 ATOM 545 CA ALA A 70 8.391 -2.657 76.789 1.00 0.00 ATOM 546 CB ALA A 70 7.219 -1.713 76.564 1.00 0.00 ATOM 547 O ALA A 70 7.811 -4.758 75.784 1.00 0.00 ATOM 548 C ALA A 70 8.416 -3.691 75.667 1.00 0.00 ATOM 549 N LEU A 71 9.116 -3.375 74.579 1.00 0.00 ATOM 550 CA LEU A 71 9.218 -4.310 73.465 1.00 0.00 ATOM 551 CB LEU A 71 9.959 -3.635 72.303 1.00 0.00 ATOM 552 CG LEU A 71 9.191 -2.501 71.612 1.00 0.00 ATOM 553 CD1 LEU A 71 10.095 -1.796 70.607 1.00 0.00 ATOM 554 CD2 LEU A 71 7.960 -3.066 70.921 1.00 0.00 ATOM 555 O LEU A 71 9.524 -6.708 73.600 1.00 0.00 ATOM 556 C LEU A 71 9.891 -5.567 73.922 1.00 0.00 ATOM 557 N ARG A 72 10.976 -5.366 74.655 1.00 0.00 ATOM 558 CA ARG A 72 11.743 -6.443 75.157 1.00 0.00 ATOM 559 CB ARG A 72 12.974 -5.975 75.908 1.00 0.00 ATOM 560 CG ARG A 72 14.158 -5.697 74.986 1.00 0.00 ATOM 561 CD ARG A 72 15.467 -5.545 75.753 1.00 0.00 ATOM 562 NE ARG A 72 15.374 -4.494 76.755 1.00 0.00 ATOM 563 CZ ARG A 72 15.695 -3.221 76.551 1.00 0.00 ATOM 564 NH1 ARG A 72 16.290 -2.850 75.424 1.00 0.00 ATOM 565 NH2 ARG A 72 15.481 -2.325 77.503 1.00 0.00 ATOM 566 O ARG A 72 10.957 -8.560 75.962 1.00 0.00 ATOM 567 C ARG A 72 10.960 -7.337 76.113 1.00 0.00 ATOM 568 N LEU A 73 10.318 -6.757 77.105 1.00 0.00 ATOM 569 CA LEU A 73 9.571 -7.557 78.074 1.00 0.00 ATOM 570 CB LEU A 73 9.018 -6.635 79.168 1.00 0.00 ATOM 571 CG LEU A 73 10.065 -6.063 80.132 1.00 0.00 ATOM 572 CD1 LEU A 73 9.422 -5.036 81.054 1.00 0.00 ATOM 573 CD2 LEU A 73 10.687 -7.195 80.937 1.00 0.00 ATOM 574 O LEU A 73 8.162 -9.463 77.701 1.00 0.00 ATOM 575 C LEU A 73 8.445 -8.311 77.376 1.00 0.00 ATOM 576 N ILE A 74 7.805 -7.652 76.416 1.00 0.00 ATOM 577 CA ILE A 74 6.741 -8.273 75.638 1.00 0.00 ATOM 578 CB ILE A 74 6.083 -7.261 74.673 1.00 0.00 ATOM 579 CG1 ILE A 74 5.397 -6.123 75.425 1.00 0.00 ATOM 580 CG2 ILE A 74 5.172 -7.999 73.703 1.00 0.00 ATOM 581 CD1 ILE A 74 4.248 -6.556 76.319 1.00 0.00 ATOM 582 O ILE A 74 6.584 -10.553 74.898 1.00 0.00 ATOM 583 C ILE A 74 7.237 -9.509 74.896 1.00 0.00 ATOM 584 N TYR A 75 8.397 -9.384 74.259 1.00 0.00 ATOM 585 CA TYR A 75 9.011 -10.504 73.556 1.00 0.00 ATOM 586 CB TYR A 75 9.437 -9.527 72.077 1.00 0.00 ATOM 587 CG TYR A 75 10.915 -9.204 72.219 1.00 0.00 ATOM 588 CD1 TYR A 75 11.901 -10.169 71.983 1.00 0.00 ATOM 589 CD2 TYR A 75 11.340 -7.905 72.506 1.00 0.00 ATOM 590 CE1 TYR A 75 13.256 -9.855 72.026 1.00 0.00 ATOM 591 CE2 TYR A 75 12.705 -7.576 72.539 1.00 0.00 ATOM 592 CZ TYR A 75 13.654 -8.554 72.295 1.00 0.00 ATOM 593 OH TYR A 75 14.984 -8.222 72.280 1.00 0.00 ATOM 594 O TYR A 75 10.539 -12.283 74.066 1.00 0.00 ATOM 595 C TYR A 75 9.905 -11.316 74.487 1.00 0.00 ATOM 596 N ALA A 76 9.952 -10.915 75.754 1.00 0.00 ATOM 597 CA ALA A 76 10.766 -11.607 76.746 1.00 0.00 ATOM 598 CB ALA A 76 10.782 -10.826 78.053 1.00 0.00 ATOM 599 O ALA A 76 11.079 -13.970 77.034 1.00 0.00 ATOM 600 C ALA A 76 10.282 -13.033 76.983 1.00 0.00 ATOM 601 N LEU A 77 8.971 -13.189 77.131 1.00 0.00 ATOM 602 CA LEU A 77 8.375 -14.502 77.353 1.00 0.00 ATOM 603 CB LEU A 77 7.083 -14.368 78.169 1.00 0.00 ATOM 604 CG LEU A 77 7.258 -13.792 79.579 1.00 0.00 ATOM 605 CD1 LEU A 77 5.900 -13.612 80.243 1.00 0.00 ATOM 606 CD2 LEU A 77 8.143 -14.719 80.402 1.00 0.00 ATOM 607 O LEU A 77 7.556 -16.306 76.011 1.00 0.00 ATOM 608 C LEU A 77 8.103 -15.201 76.025 1.00 0.00 ATOM 609 N GLY A 78 8.489 -14.564 74.921 1.00 0.00 ATOM 610 CA GLY A 78 8.265 -15.139 73.605 1.00 0.00 ATOM 611 O GLY A 78 6.505 -15.627 72.085 1.00 0.00 ATOM 612 C GLY A 78 6.836 -15.027 73.114 1.00 0.00 ATOM 613 N LYS A 79 5.992 -14.253 73.771 1.00 0.00 ATOM 614 CA LYS A 79 4.588 -14.163 73.402 1.00 0.00 ATOM 615 CB LYS A 79 3.810 -13.620 74.601 1.00 0.00 ATOM 616 CG LYS A 79 3.815 -14.533 75.820 1.00 0.00 ATOM 617 CD LYS A 79 2.974 -13.955 76.949 1.00 0.00 ATOM 618 CE LYS A 79 2.991 -14.859 78.173 1.00 0.00 ATOM 619 NZ LYS A 79 2.266 -14.255 79.322 1.00 0.00 ATOM 620 O LYS A 79 3.529 -13.655 71.309 1.00 0.00 ATOM 621 C LYS A 79 4.354 -13.314 72.157 1.00 0.00 ATOM 622 N MET A 80 5.084 -12.209 72.052 1.00 0.00 ATOM 623 CA MET A 80 4.978 -11.327 70.897 1.00 0.00 ATOM 624 CB MET A 80 5.055 -9.871 71.353 1.00 0.00 ATOM 625 CG MET A 80 4.120 -9.521 72.503 1.00 0.00 ATOM 626 SD MET A 80 2.393 -9.876 72.124 1.00 0.00 ATOM 627 CE MET A 80 2.064 -8.650 70.863 1.00 0.00 ATOM 628 O MET A 80 7.165 -12.024 70.194 1.00 0.00 ATOM 629 C MET A 80 6.056 -11.612 69.855 1.00 0.00 ATOM 630 N ASP A 81 5.721 -11.390 68.588 1.00 0.00 ATOM 631 CA ASP A 81 6.666 -11.600 67.499 1.00 0.00 ATOM 632 CB ASP A 81 5.953 -11.514 66.146 1.00 0.00 ATOM 633 CG ASP A 81 6.834 -11.840 64.948 1.00 0.00 ATOM 634 OD1 ASP A 81 8.004 -12.074 65.143 1.00 0.00 ATOM 635 OD2 ASP A 81 6.306 -12.007 63.876 1.00 0.00 ATOM 636 O ASP A 81 7.576 -9.381 67.595 1.00 0.00 ATOM 637 C ASP A 81 7.805 -10.590 67.555 1.00 0.00 ATOM 638 N LYS A 82 9.036 -11.091 67.557 1.00 0.00 ATOM 639 CA LYS A 82 10.215 -10.236 67.624 1.00 0.00 ATOM 640 CB LYS A 82 11.473 -11.072 67.859 1.00 0.00 ATOM 641 CG LYS A 82 11.568 -11.688 69.250 1.00 0.00 ATOM 642 CD LYS A 82 12.843 -12.501 69.409 1.00 0.00 ATOM 643 CE LYS A 82 12.928 -13.134 70.791 1.00 0.00 ATOM 644 NZ LYS A 82 14.158 -13.956 70.951 1.00 0.00 ATOM 645 O LYS A 82 10.724 -8.268 66.376 1.00 0.00 ATOM 646 C LYS A 82 10.334 -9.431 66.336 1.00 0.00 ATOM 647 N TRP A 83 9.996 -10.038 65.200 1.00 0.00 ATOM 648 CA TRP A 83 10.097 -9.311 63.937 1.00 0.00 ATOM 649 CB TRP A 83 9.846 -10.336 62.800 1.00 0.00 ATOM 650 CG TRP A 83 9.957 -9.739 61.424 1.00 0.00 ATOM 651 CD1 TRP A 83 11.058 -9.607 60.691 1.00 0.00 ATOM 652 CD2 TRP A 83 8.890 -9.219 60.643 1.00 0.00 ATOM 653 CE2 TRP A 83 9.436 -8.770 59.423 1.00 0.00 ATOM 654 CE3 TRP A 83 7.505 -9.081 60.846 1.00 0.00 ATOM 655 NE1 TRP A 83 10.790 -9.006 59.470 1.00 0.00 ATOM 656 CZ2 TRP A 83 8.670 -8.185 58.393 1.00 0.00 ATOM 657 CZ3 TRP A 83 6.760 -8.510 59.826 1.00 0.00 ATOM 658 CH2 TRP A 83 7.336 -8.068 58.624 1.00 0.00 ATOM 659 O TRP A 83 9.573 -7.041 63.359 1.00 0.00 ATOM 660 C TRP A 83 9.199 -8.080 63.902 1.00 0.00 ATOM 661 N LEU A 84 8.012 -8.205 64.486 1.00 0.00 ATOM 662 CA LEU A 84 7.096 -7.075 64.609 1.00 0.00 ATOM 663 CB LEU A 84 5.726 -7.555 65.104 1.00 0.00 ATOM 664 CG LEU A 84 4.924 -8.389 64.095 1.00 0.00 ATOM 665 CD1 LEU A 84 3.679 -8.960 64.763 1.00 0.00 ATOM 666 CD2 LEU A 84 4.546 -7.521 62.904 1.00 0.00 ATOM 667 O LEU A 84 7.710 -4.831 65.201 1.00 0.00 ATOM 668 C LEU A 84 7.656 -6.013 65.548 1.00 0.00 ATOM 669 N TYR A 85 8.071 -6.438 66.737 1.00 0.00 ATOM 670 CA TYR A 85 8.632 -5.524 67.725 1.00 0.00 ATOM 671 CB TYR A 85 8.553 -6.246 69.126 1.00 0.00 ATOM 672 CG TYR A 85 7.171 -6.368 69.718 1.00 0.00 ATOM 673 CD1 TYR A 85 6.618 -5.329 70.468 1.00 0.00 ATOM 674 CD2 TYR A 85 6.409 -7.519 69.525 1.00 0.00 ATOM 675 CE1 TYR A 85 5.344 -5.433 71.013 1.00 0.00 ATOM 676 CE2 TYR A 85 5.131 -7.635 70.065 1.00 0.00 ATOM 677 CZ TYR A 85 4.607 -6.588 70.809 1.00 0.00 ATOM 678 OH TYR A 85 3.346 -6.695 71.343 1.00 0.00 ATOM 679 O TYR A 85 10.428 -3.935 67.622 1.00 0.00 ATOM 680 C TYR A 85 10.024 -5.055 67.313 1.00 0.00 ATOM 681 N ALA A 86 10.752 -5.920 66.615 1.00 0.00 ATOM 682 CA ALA A 86 11.999 -5.527 65.970 1.00 0.00 ATOM 683 CB ALA A 86 12.638 -6.631 65.221 1.00 0.00 ATOM 684 O ALA A 86 12.416 -3.387 64.956 1.00 0.00 ATOM 685 C ALA A 86 11.746 -4.412 64.962 1.00 0.00 ATOM 686 N ASP A 87 10.732 -4.601 64.114 1.00 0.00 ATOM 687 CA ASP A 87 10.365 -3.585 63.147 1.00 0.00 ATOM 688 CB ASP A 87 9.256 -4.038 62.234 1.00 0.00 ATOM 689 CG ASP A 87 9.745 -5.019 61.186 1.00 0.00 ATOM 690 OD1 ASP A 87 10.970 -5.165 61.037 1.00 0.00 ATOM 691 OD2 ASP A 87 8.909 -5.635 60.493 1.00 0.00 ATOM 692 O ASP A 87 10.293 -1.216 63.431 1.00 0.00 ATOM 693 C ASP A 87 9.881 -2.305 63.801 1.00 0.00 ATOM 694 N ILE A 88 9.037 -2.414 64.820 1.00 0.00 ATOM 695 CA ILE A 88 8.558 -1.244 65.541 1.00 0.00 ATOM 696 CB ILE A 88 7.510 -1.644 66.594 1.00 0.00 ATOM 697 CG1 ILE A 88 6.250 -2.186 65.912 1.00 0.00 ATOM 698 CG2 ILE A 88 7.169 -0.458 67.482 1.00 0.00 ATOM 699 CD1 ILE A 88 5.277 -2.845 66.864 1.00 0.00 ATOM 700 O ILE A 88 9.672 0.772 66.232 1.00 0.00 ATOM 701 C ILE A 88 9.676 -0.461 66.227 1.00 0.00 ATOM 702 N THR A 89 10.645 -1.194 66.781 1.00 0.00 ATOM 703 CA THR A 89 11.764 -0.568 67.473 1.00 0.00 ATOM 704 CB THR A 89 12.767 -1.542 67.848 1.00 0.00 ATOM 705 CG2 THR A 89 13.950 -0.867 68.502 1.00 0.00 ATOM 706 OG1 THR A 89 12.153 -2.386 68.830 1.00 0.00 ATOM 707 O THR A 89 12.561 1.596 66.800 1.00 0.00 ATOM 708 C THR A 89 12.505 0.391 66.546 1.00 0.00 ATOM 709 N HIS A 90 13.072 -0.149 65.473 1.00 0.00 ATOM 710 CA HIS A 90 13.771 0.664 64.485 1.00 0.00 ATOM 711 CB HIS A 90 14.458 -0.223 63.443 1.00 0.00 ATOM 712 CG HIS A 90 15.650 -0.958 63.970 1.00 0.00 ATOM 713 CD2 HIS A 90 15.880 -2.281 64.134 1.00 0.00 ATOM 714 ND1 HIS A 90 16.790 -0.314 64.402 1.00 0.00 ATOM 715 CE1 HIS A 90 17.672 -1.212 64.810 1.00 0.00 ATOM 716 NE2 HIS A 90 17.144 -2.413 64.657 1.00 0.00 ATOM 717 O HIS A 90 13.141 2.795 63.553 1.00 0.00 ATOM 718 C HIS A 90 12.802 1.628 63.809 1.00 0.00 ATOM 719 N PHE A 91 11.628 1.128 63.424 1.00 0.00 ATOM 720 CA PHE A 91 10.661 1.980 62.732 1.00 0.00 ATOM 721 CB PHE A 91 9.317 1.370 62.457 1.00 0.00 ATOM 722 CG PHE A 91 9.332 0.302 61.415 1.00 0.00 ATOM 723 CD1 PHE A 91 10.411 0.094 60.570 1.00 0.00 ATOM 724 CD2 PHE A 91 8.241 -0.551 61.347 1.00 0.00 ATOM 725 CE1 PHE A 91 10.365 -0.927 59.590 1.00 0.00 ATOM 726 CE2 PHE A 91 8.203 -1.561 60.392 1.00 0.00 ATOM 727 CZ PHE A 91 9.276 -1.734 59.527 1.00 0.00 ATOM 728 O PHE A 91 10.223 4.312 63.097 1.00 0.00 ATOM 729 C PHE A 91 10.256 3.180 63.580 1.00 0.00 ATOM 730 N SER A 92 9.949 2.924 64.848 1.00 0.00 ATOM 731 CA SER A 92 9.529 3.981 65.762 1.00 0.00 ATOM 732 CB SER A 92 9.144 3.386 67.103 1.00 0.00 ATOM 733 OG SER A 92 8.007 2.572 67.011 1.00 0.00 ATOM 734 O SER A 92 10.429 6.233 65.842 1.00 0.00 ATOM 735 C SER A 92 10.665 5.010 65.873 1.00 0.00 ATOM 736 N GLN A 93 11.912 4.515 65.908 1.00 0.00 ATOM 737 CA GLN A 93 13.019 5.463 66.065 1.00 0.00 ATOM 738 CB GLN A 93 14.353 4.687 66.198 1.00 0.00 ATOM 739 CG GLN A 93 14.476 3.868 67.492 1.00 0.00 ATOM 740 CD GLN A 93 15.893 3.397 67.767 1.00 0.00 ATOM 741 OE1 GLN A 93 16.849 4.170 67.688 1.00 0.00 ATOM 742 NE2 GLN A 93 16.036 2.116 68.092 1.00 0.00 ATOM 743 O GLN A 93 13.367 7.620 65.091 1.00 0.00 ATOM 744 C GLN A 93 13.255 6.411 64.894 1.00 0.00 ATOM 745 N TYR A 94 13.344 5.884 63.690 1.00 0.00 ATOM 746 CA TYR A 94 13.599 6.725 62.507 1.00 0.00 ATOM 747 CB TYR A 94 13.823 5.674 61.416 1.00 0.00 ATOM 748 CG TYR A 94 15.029 4.792 61.651 1.00 0.00 ATOM 749 CD1 TYR A 94 16.000 5.145 62.576 1.00 0.00 ATOM 750 CD2 TYR A 94 15.189 3.607 60.951 1.00 0.00 ATOM 751 CE1 TYR A 94 17.104 4.343 62.796 1.00 0.00 ATOM 752 CE2 TYR A 94 16.288 2.795 61.162 1.00 0.00 ATOM 753 CZ TYR A 94 17.244 3.168 62.086 1.00 0.00 ATOM 754 OH TYR A 94 18.339 2.364 62.300 1.00 0.00 ATOM 755 O TYR A 94 12.510 8.818 61.965 1.00 0.00 ATOM 756 C TYR A 94 12.385 7.612 62.242 1.00 0.00 ATOM 757 N TRP A 95 11.183 7.086 62.322 1.00 0.00 ATOM 758 CA TRP A 95 9.997 7.875 62.095 1.00 0.00 ATOM 759 CB TRP A 95 8.789 6.937 62.038 1.00 0.00 ATOM 760 CG TRP A 95 8.901 5.883 60.976 1.00 0.00 ATOM 761 CD1 TRP A 95 9.892 5.761 60.050 1.00 0.00 ATOM 762 CD2 TRP A 95 7.990 4.803 60.735 1.00 0.00 ATOM 763 CE2 TRP A 95 8.493 4.068 59.648 1.00 0.00 ATOM 764 CE3 TRP A 95 6.795 4.389 61.338 1.00 0.00 ATOM 765 NE1 TRP A 95 9.656 4.674 59.244 1.00 0.00 ATOM 766 CZ2 TRP A 95 7.848 2.948 59.148 1.00 0.00 ATOM 767 CZ3 TRP A 95 6.150 3.264 60.835 1.00 0.00 ATOM 768 CH2 TRP A 95 6.662 2.564 59.772 1.00 0.00 ATOM 769 O TRP A 95 9.365 10.078 62.832 1.00 0.00 ATOM 770 C TRP A 95 9.793 8.966 63.156 1.00 0.00 ATOM 771 N HIS A 96 10.118 8.667 64.396 1.00 0.00 ATOM 772 CA HIS A 96 9.994 9.661 65.454 1.00 0.00 ATOM 773 CB HIS A 96 10.172 8.984 66.816 1.00 0.00 ATOM 774 CG HIS A 96 11.595 8.651 67.141 1.00 0.00 ATOM 775 CD2 HIS A 96 12.332 7.542 66.891 1.00 0.00 ATOM 776 ND1 HIS A 96 12.430 9.524 67.808 1.00 0.00 ATOM 777 CE1 HIS A 96 13.619 8.966 67.953 1.00 0.00 ATOM 778 NE2 HIS A 96 13.585 7.765 67.407 1.00 0.00 ATOM 779 O HIS A 96 10.675 11.957 65.619 1.00 0.00 ATOM 780 C HIS A 96 10.988 10.807 65.308 1.00 0.00 ATOM 781 N TYR A 97 12.201 10.482 64.871 1.00 0.00 ATOM 782 CA TYR A 97 13.235 11.487 64.662 1.00 0.00 ATOM 783 CB TYR A 97 14.565 10.708 64.336 1.00 0.00 ATOM 784 CG TYR A 97 15.831 11.516 64.502 1.00 0.00 ATOM 785 CD1 TYR A 97 16.302 11.852 65.773 1.00 0.00 ATOM 786 CD2 TYR A 97 16.562 11.943 63.394 1.00 0.00 ATOM 787 CE1 TYR A 97 17.470 12.592 65.933 1.00 0.00 ATOM 788 CE2 TYR A 97 17.732 12.685 63.544 1.00 0.00 ATOM 789 CZ TYR A 97 18.179 13.005 64.817 1.00 0.00 ATOM 790 OH TYR A 97 19.338 13.734 64.977 1.00 0.00 ATOM 791 O TYR A 97 13.132 13.688 63.709 1.00 0.00 ATOM 792 C TYR A 97 12.806 12.506 63.611 1.00 0.00 ATOM 793 N LEU A 98 12.073 12.019 62.604 1.00 0.00 ATOM 794 CA LEU A 98 11.579 12.919 61.565 1.00 0.00 ATOM 795 CB LEU A 98 10.878 12.140 60.445 1.00 0.00 ATOM 796 CG LEU A 98 11.802 11.453 59.426 1.00 0.00 ATOM 797 CD1 LEU A 98 10.998 10.488 58.572 1.00 0.00 ATOM 798 CD2 LEU A 98 12.493 12.500 58.546 1.00 0.00 ATOM 799 O LEU A 98 10.627 15.101 61.830 1.00 0.00 ATOM 800 C LEU A 98 10.611 13.929 62.189 1.00 0.00 ATOM 801 N ASN A 99 9.774 13.474 63.127 1.00 0.00 ATOM 802 CA ASN A 99 8.833 14.376 63.793 1.00 0.00 ATOM 803 CB ASN A 99 7.892 13.605 64.727 1.00 0.00 ATOM 804 CG ASN A 99 6.853 12.797 63.977 1.00 0.00 ATOM 805 ND2 ASN A 99 6.305 11.781 64.636 1.00 0.00 ATOM 806 OD1 ASN A 99 6.530 13.092 62.827 1.00 0.00 ATOM 807 O ASN A 99 9.196 16.613 64.555 1.00 0.00 ATOM 808 C ASN A 99 9.566 15.443 64.594 1.00 0.00 ATOM 809 N GLU A 100 10.618 15.043 65.302 1.00 0.00 ATOM 810 CA GLU A 100 11.406 15.988 66.086 1.00 0.00 ATOM 811 CB GLU A 100 12.014 15.321 67.301 1.00 0.00 ATOM 812 CG GLU A 100 11.010 15.179 68.441 1.00 0.00 ATOM 813 CD GLU A 100 11.618 14.579 69.701 1.00 0.00 ATOM 814 OE1 GLU A 100 11.529 13.344 69.882 1.00 0.00 ATOM 815 OE2 GLU A 100 12.193 15.348 70.500 1.00 0.00 ATOM 816 O GLU A 100 12.864 17.846 65.554 1.00 0.00 ATOM 817 C GLU A 100 12.447 16.740 65.214 1.00 0.00 ATOM 818 N GLN A 101 12.717 16.204 63.960 1.00 0.00 ATOM 819 CA GLN A 101 13.761 16.783 63.102 1.00 0.00 ATOM 820 CB GLN A 101 15.104 16.262 63.467 1.00 0.00 ATOM 821 CG GLN A 101 16.231 17.149 63.013 1.00 0.00 ATOM 822 CD GLN A 101 16.263 18.494 63.726 1.00 0.00 ATOM 823 OE1 GLN A 101 17.284 18.876 64.303 1.00 0.00 ATOM 824 NE2 GLN A 101 15.149 19.223 63.680 1.00 0.00 ATOM 825 O GLN A 101 13.222 17.193 60.801 1.00 0.00 ATOM 826 C GLN A 101 13.144 17.588 61.964 1.00 0.00 ATOM 827 N ASP A 102 12.536 18.719 62.307 1.00 0.00 ATOM 828 CA ASP A 102 11.886 19.569 61.316 1.00 0.00 ATOM 829 CB ASP A 102 11.317 20.826 61.980 1.00 0.00 ATOM 830 CG ASP A 102 10.068 20.587 62.814 1.00 0.00 ATOM 831 OD1 ASP A 102 9.506 19.521 62.715 1.00 0.00 ATOM 832 OD2 ASP A 102 9.774 21.403 63.655 1.00 0.00 ATOM 833 O ASP A 102 12.581 19.971 59.068 1.00 0.00 ATOM 834 C ASP A 102 12.900 19.958 60.248 1.00 0.00 ATOM 835 N GLU A 103 14.107 20.286 60.629 1.00 0.00 ATOM 836 CA GLU A 103 15.127 20.686 59.669 1.00 0.00 ATOM 837 CB GLU A 103 16.277 21.376 60.408 1.00 0.00 ATOM 838 CG GLU A 103 15.900 22.699 61.057 1.00 0.00 ATOM 839 CD GLU A 103 17.040 23.256 61.864 1.00 0.00 ATOM 840 OE1 GLU A 103 18.057 22.610 61.944 1.00 0.00 ATOM 841 OE2 GLU A 103 16.937 24.374 62.312 1.00 0.00 ATOM 842 O GLU A 103 16.544 19.684 58.007 1.00 0.00 ATOM 843 C GLU A 103 15.651 19.518 58.838 1.00 0.00 ATOM 844 N THR A 104 15.087 18.336 59.069 1.00 0.00 ATOM 845 CA THR A 104 15.501 17.138 58.350 1.00 0.00 ATOM 846 CB THR A 104 16.182 16.131 59.294 1.00 0.00 ATOM 847 CG2 THR A 104 17.468 16.717 59.859 1.00 0.00 ATOM 848 OG1 THR A 104 15.296 15.805 60.372 1.00 0.00 ATOM 849 O THR A 104 13.882 15.385 58.084 1.00 0.00 ATOM 850 C THR A 104 14.327 16.450 57.658 1.00 0.00 ATOM 851 N PRO A 105 13.832 17.067 56.591 1.00 0.00 ATOM 852 CA PRO A 105 12.703 16.521 55.848 1.00 0.00 ATOM 853 CB PRO A 105 12.430 17.571 54.757 1.00 0.00 ATOM 854 CG PRO A 105 12.972 18.858 55.314 1.00 0.00 ATOM 855 CD PRO A 105 14.342 18.309 55.996 1.00 0.00 ATOM 856 O PRO A 105 12.149 14.301 55.122 1.00 0.00 ATOM 857 C PRO A 105 13.026 15.153 55.258 1.00 0.00 ATOM 858 N GLY A 106 14.294 14.948 54.911 1.00 0.00 ATOM 859 CA GLY A 106 14.730 13.693 54.310 1.00 0.00 ATOM 860 O GLY A 106 16.432 12.230 55.128 1.00 0.00 ATOM 861 C GLY A 106 15.484 12.964 55.407 1.00 0.00 ATOM 862 N PHE A 107 15.111 13.194 56.781 1.00 0.00 ATOM 863 CA PHE A 107 15.731 12.545 57.931 1.00 0.00 ATOM 864 CB PHE A 107 15.083 11.162 58.031 1.00 0.00 ATOM 865 CG PHE A 107 15.185 10.351 56.770 1.00 0.00 ATOM 866 CD1 PHE A 107 16.278 9.528 56.544 1.00 0.00 ATOM 867 CD2 PHE A 107 14.188 10.412 55.807 1.00 0.00 ATOM 868 CE1 PHE A 107 16.372 8.782 55.383 1.00 0.00 ATOM 869 CE2 PHE A 107 14.279 9.668 54.647 1.00 0.00 ATOM 870 CZ PHE A 107 15.374 8.852 54.434 1.00 0.00 ATOM 871 O PHE A 107 17.811 12.808 56.761 1.00 0.00 ATOM 872 C PHE A 107 17.242 12.404 57.776 1.00 0.00 ATOM 873 N ALA A 108 17.894 11.895 58.815 1.00 0.00 ATOM 874 CA ALA A 108 19.335 11.677 58.783 1.00 0.00 ATOM 875 CB ALA A 108 19.849 11.332 60.173 1.00 0.00 ATOM 876 O ALA A 108 18.945 9.635 57.583 1.00 0.00 ATOM 877 C ALA A 108 19.706 10.581 57.790 1.00 0.00 ATOM 878 N ASP A 109 20.894 10.695 57.207 1.00 0.00 ATOM 879 CA ASP A 109 21.376 9.707 56.249 1.00 0.00 ATOM 880 CB ASP A 109 22.674 10.182 55.594 1.00 0.00 ATOM 881 CG ASP A 109 22.496 11.309 54.584 1.00 0.00 ATOM 882 OD1 ASP A 109 21.378 11.571 54.211 1.00 0.00 ATOM 883 OD2 ASP A 109 23.451 11.997 54.317 1.00 0.00 ATOM 884 O ASP A 109 21.393 7.307 56.296 1.00 0.00 ATOM 885 C ASP A 109 21.591 8.353 56.917 1.00 0.00 ATOM 886 N ASP A 110 21.997 8.380 58.182 1.00 0.00 ATOM 887 CA ASP A 110 22.209 7.156 58.944 1.00 0.00 ATOM 888 CB ASP A 110 22.926 7.462 60.262 1.00 0.00 ATOM 889 CG ASP A 110 24.399 7.814 60.110 1.00 0.00 ATOM 890 OD1 ASP A 110 24.933 7.601 59.048 1.00 0.00 ATOM 891 OD2 ASP A 110 24.935 8.436 60.995 1.00 0.00 ATOM 892 O ASP A 110 20.749 5.256 59.208 1.00 0.00 ATOM 893 C ASP A 110 20.848 6.484 59.204 1.00 0.00 ATOM 894 N ILE A 111 19.797 7.272 59.414 1.00 0.00 ATOM 895 CA ILE A 111 18.498 6.664 59.619 1.00 0.00 ATOM 896 CB ILE A 111 17.477 7.759 59.977 1.00 0.00 ATOM 897 CG1 ILE A 111 17.711 8.258 61.406 1.00 0.00 ATOM 898 CG2 ILE A 111 16.059 7.236 59.818 1.00 0.00 ATOM 899 CD1 ILE A 111 16.933 9.509 61.750 1.00 0.00 ATOM 900 O ILE A 111 17.538 4.793 58.460 1.00 0.00 ATOM 901 C ILE A 111 18.044 5.913 58.372 1.00 0.00 ATOM 902 N THR A 112 18.218 6.513 57.223 1.00 0.00 ATOM 903 CA THR A 112 17.902 5.906 55.935 1.00 0.00 ATOM 904 CB THR A 112 18.777 6.803 54.779 1.00 0.00 ATOM 905 CG2 THR A 112 18.267 6.709 53.343 1.00 0.00 ATOM 906 OG1 THR A 112 18.972 8.175 55.135 1.00 0.00 ATOM 907 O THR A 112 18.231 3.630 55.246 1.00 0.00 ATOM 908 C THR A 112 18.746 4.663 55.674 1.00 0.00 ATOM 909 N TRP A 113 20.046 4.769 55.936 1.00 0.00 ATOM 910 CA TRP A 113 20.962 3.656 55.726 1.00 0.00 ATOM 911 CB TRP A 113 22.404 4.099 55.974 1.00 0.00 ATOM 912 CG TRP A 113 22.935 5.030 54.926 1.00 0.00 ATOM 913 CD1 TRP A 113 22.357 5.319 53.727 1.00 0.00 ATOM 914 CD2 TRP A 113 24.146 5.791 54.982 1.00 0.00 ATOM 915 CE2 TRP A 113 24.238 6.519 53.784 1.00 0.00 ATOM 916 CE3 TRP A 113 25.164 5.928 55.935 1.00 0.00 ATOM 917 NE1 TRP A 113 23.133 6.213 53.030 1.00 0.00 ATOM 918 CZ2 TRP A 113 25.300 7.366 53.506 1.00 0.00 ATOM 919 CZ3 TRP A 113 26.228 6.779 55.659 1.00 0.00 ATOM 920 CH2 TRP A 113 26.294 7.478 54.481 1.00 0.00 ATOM 921 O TRP A 113 20.675 1.325 56.189 1.00 0.00 ATOM 922 C TRP A 113 20.634 2.474 56.633 1.00 0.00 ATOM 923 N ASP A 114 20.281 2.774 57.871 1.00 0.00 ATOM 924 CA ASP A 114 19.902 1.743 58.839 1.00 0.00 ATOM 925 CB ASP A 114 19.708 2.350 60.231 1.00 0.00 ATOM 926 CG ASP A 114 20.999 2.764 60.923 1.00 0.00 ATOM 927 OD1 ASP A 114 22.048 2.383 60.457 1.00 0.00 ATOM 928 OD2 ASP A 114 20.939 3.580 61.812 1.00 0.00 ATOM 929 O ASP A 114 18.560 -0.212 58.477 1.00 0.00 ATOM 930 C ASP A 114 18.653 1.017 58.377 1.00 0.00 ATOM 931 N PHE A 115 17.702 1.759 57.824 1.00 0.00 ATOM 932 CA PHE A 115 16.455 1.177 57.333 1.00 0.00 ATOM 933 CB PHE A 115 15.436 2.274 57.016 1.00 0.00 ATOM 934 CG PHE A 115 14.063 1.752 56.703 1.00 0.00 ATOM 935 CD1 PHE A 115 13.214 1.338 57.719 1.00 0.00 ATOM 936 CD2 PHE A 115 13.617 1.673 55.392 1.00 0.00 ATOM 937 CE1 PHE A 115 11.952 0.859 57.432 1.00 0.00 ATOM 938 CE2 PHE A 115 12.355 1.195 55.102 1.00 0.00 ATOM 939 CZ PHE A 115 11.521 0.786 56.125 1.00 0.00 ATOM 940 O PHE A 115 16.097 -0.687 55.858 1.00 0.00 ATOM 941 C PHE A 115 16.699 0.369 56.061 1.00 0.00 ATOM 942 N ILE A 116 17.568 0.876 55.184 1.00 0.00 ATOM 943 CA ILE A 116 17.876 0.161 53.953 1.00 0.00 ATOM 944 CB ILE A 116 18.929 0.931 53.136 1.00 0.00 ATOM 945 CG1 ILE A 116 18.330 2.223 52.576 1.00 0.00 ATOM 946 CG2 ILE A 116 19.470 0.060 52.012 1.00 0.00 ATOM 947 CD1 ILE A 116 19.356 3.168 51.994 1.00 0.00 ATOM 948 O ILE A 116 17.978 -2.221 53.664 1.00 0.00 ATOM 949 C ILE A 116 18.406 -1.235 54.264 1.00 0.00 ATOM 950 N SER A 117 19.344 -1.310 55.204 1.00 0.00 ATOM 951 CA SER A 117 19.945 -2.581 55.586 1.00 0.00 ATOM 952 CB SER A 117 21.129 -2.344 56.501 1.00 0.00 ATOM 953 OG SER A 117 20.745 -1.793 57.731 1.00 0.00 ATOM 954 O SER A 117 19.001 -4.716 56.149 1.00 0.00 ATOM 955 C SER A 117 18.917 -3.492 56.250 1.00 0.00 ATOM 956 N ASN A 118 17.948 -2.886 56.928 1.00 0.00 ATOM 957 CA ASN A 118 16.914 -3.640 57.627 1.00 0.00 ATOM 958 CB ASN A 118 16.074 -2.737 58.512 1.00 0.00 ATOM 959 CG ASN A 118 16.793 -2.258 59.743 1.00 0.00 ATOM 960 ND2 ASN A 118 16.254 -1.230 60.346 1.00 0.00 ATOM 961 OD1 ASN A 118 17.782 -2.855 60.181 1.00 0.00 ATOM 962 O ASN A 118 15.646 -5.547 56.904 1.00 0.00 ATOM 963 C ASN A 118 16.020 -4.402 56.653 1.00 0.00 ATOM 964 N VAL A 119 15.685 -3.759 55.539 1.00 0.00 ATOM 965 CA VAL A 119 14.889 -4.396 54.496 1.00 0.00 ATOM 966 CB VAL A 119 14.429 -3.491 53.378 1.00 0.00 ATOM 967 CG1 VAL A 119 15.429 -2.896 52.578 1.00 0.00 ATOM 968 CG2 VAL A 119 13.385 -4.208 52.495 1.00 0.00 ATOM 969 O VAL A 119 15.154 -6.668 53.766 1.00 0.00 ATOM 970 C VAL A 119 15.685 -5.577 53.929 1.00 0.00 ATOM 971 N ASN A 120 16.956 -5.378 53.638 1.00 0.00 ATOM 972 CA ASN A 120 17.800 -6.406 53.098 1.00 0.00 ATOM 973 CB ASN A 120 19.215 -5.900 52.874 1.00 0.00 ATOM 974 CG ASN A 120 19.332 -4.912 51.748 1.00 0.00 ATOM 975 ND2 ASN A 120 20.431 -4.201 51.734 1.00 0.00 ATOM 976 OD1 ASN A 120 18.472 -4.841 50.863 1.00 0.00 ATOM 977 O ASN A 120 17.779 -8.785 53.419 1.00 0.00 ATOM 978 C ASN A 120 17.839 -7.675 53.944 1.00 0.00 ATOM 979 N SER A 121 17.942 -7.499 55.258 1.00 0.00 ATOM 980 CA SER A 121 17.949 -8.628 56.181 1.00 0.00 ATOM 981 CB SER A 121 18.278 -8.153 57.584 1.00 0.00 ATOM 982 OG SER A 121 19.593 -7.680 57.686 1.00 0.00 ATOM 983 O SER A 121 16.540 -10.554 55.920 1.00 0.00 ATOM 984 C SER A 121 16.604 -9.346 56.150 1.00 0.00 ATOM 985 N ILE A 122 15.531 -8.595 56.373 1.00 0.00 ATOM 986 CA ILE A 122 14.187 -9.158 56.374 1.00 0.00 ATOM 987 CB ILE A 122 13.197 -8.018 56.730 1.00 0.00 ATOM 988 CG1 ILE A 122 13.421 -7.630 58.211 1.00 0.00 ATOM 989 CG2 ILE A 122 11.775 -8.539 56.536 1.00 0.00 ATOM 990 CD1 ILE A 122 12.654 -6.415 58.658 1.00 0.00 ATOM 991 O ILE A 122 13.323 -10.867 54.929 1.00 0.00 ATOM 992 C ILE A 122 13.821 -9.746 55.016 1.00 0.00 ATOM 993 N THR A 123 14.073 -8.980 53.959 1.00 0.00 ATOM 994 CA THR A 123 13.635 -9.354 52.620 1.00 0.00 ATOM 995 CB THR A 123 13.728 -8.167 51.642 1.00 0.00 ATOM 996 CG2 THR A 123 13.299 -8.592 50.247 1.00 0.00 ATOM 997 OG1 THR A 123 12.881 -7.104 52.097 1.00 0.00 ATOM 998 O THR A 123 13.961 -11.332 51.299 1.00 0.00 ATOM 999 C THR A 123 14.458 -10.519 52.079 1.00 0.00 ATOM 1000 N ARG A 124 15.725 -10.574 52.474 1.00 0.00 ATOM 1001 CA ARG A 124 16.625 -11.624 52.012 1.00 0.00 ATOM 1002 CB ARG A 124 18.078 -11.173 52.017 1.00 0.00 ATOM 1003 CG ARG A 124 18.417 -10.098 50.998 1.00 0.00 ATOM 1004 CD ARG A 124 19.832 -9.647 51.031 1.00 0.00 ATOM 1005 NE ARG A 124 20.154 -8.599 50.075 1.00 0.00 ATOM 1006 CZ ARG A 124 21.309 -7.907 50.058 1.00 0.00 ATOM 1007 NH1 ARG A 124 22.240 -8.121 50.961 1.00 0.00 ATOM 1008 NH2 ARG A 124 21.475 -6.990 49.120 1.00 0.00 ATOM 1009 O ARG A 124 16.960 -13.962 52.447 1.00 0.00 ATOM 1010 C ARG A 124 16.450 -12.906 52.820 1.00 0.00 ATOM 1011 N ASN A 125 15.725 -12.805 53.931 1.00 0.00 ATOM 1012 CA ASN A 125 15.444 -13.963 54.769 1.00 0.00 ATOM 1013 CB ASN A 125 15.331 -13.581 56.234 1.00 0.00 ATOM 1014 CG ASN A 125 15.064 -14.745 57.145 1.00 0.00 ATOM 1015 ND2 ASN A 125 14.560 -14.443 58.314 1.00 0.00 ATOM 1016 OD1 ASN A 125 15.242 -15.909 56.768 1.00 0.00 ATOM 1017 O ASN A 125 13.068 -14.293 54.699 1.00 0.00 ATOM 1018 C ASN A 125 14.174 -14.688 54.335 1.00 0.00 ATOM 1019 N ALA A 126 14.345 -15.750 53.554 1.00 0.00 ATOM 1020 CA ALA A 126 13.211 -16.475 52.991 1.00 0.00 ATOM 1021 CB ALA A 126 13.677 -17.363 51.847 1.00 0.00 ATOM 1022 O ALA A 126 11.330 -17.597 53.975 1.00 0.00 ATOM 1023 C ALA A 126 12.487 -17.198 54.125 1.00 0.00 ATOM 1024 N THR A 127 13.169 -17.388 55.253 1.00 0.00 ATOM 1025 CA THR A 127 12.560 -18.080 56.386 1.00 0.00 ATOM 1026 CB THR A 127 13.629 -18.579 57.375 1.00 0.00 ATOM 1027 CG2 THR A 127 14.671 -19.422 56.653 1.00 0.00 ATOM 1028 OG1 THR A 127 14.274 -17.455 57.992 1.00 0.00 ATOM 1029 O THR A 127 10.864 -17.819 58.066 1.00 0.00 ATOM 1030 C THR A 127 11.500 -17.293 57.152 1.00 0.00 ATOM 1031 N LEU A 128 11.347 -16.020 56.802 1.00 0.00 ATOM 1032 CA LEU A 128 10.392 -15.151 57.477 1.00 0.00 ATOM 1033 CB LEU A 128 10.455 -13.736 56.886 1.00 0.00 ATOM 1034 CG LEU A 128 9.523 -12.711 57.546 1.00 0.00 ATOM 1035 CD1 LEU A 128 9.885 -12.546 59.014 1.00 0.00 ATOM 1036 CD2 LEU A 128 9.628 -11.382 56.812 1.00 0.00 ATOM 1037 O LEU A 128 8.193 -15.609 58.322 1.00 0.00 ATOM 1038 C LEU A 128 8.977 -15.709 57.379 1.00 0.00 ATOM 1039 N TYR A 129 8.656 -16.296 56.231 1.00 0.00 ATOM 1040 CA TYR A 129 7.290 -16.712 55.936 1.00 0.00 ATOM 1041 CB TYR A 129 7.123 -16.976 54.439 1.00 0.00 ATOM 1042 CG TYR A 129 5.736 -17.441 54.050 1.00 0.00 ATOM 1043 CD1 TYR A 129 4.684 -16.541 53.957 1.00 0.00 ATOM 1044 CD2 TYR A 129 5.487 -18.775 53.772 1.00 0.00 ATOM 1045 CE1 TYR A 129 3.416 -16.960 53.602 1.00 0.00 ATOM 1046 CE2 TYR A 129 4.223 -19.206 53.416 1.00 0.00 ATOM 1047 CZ TYR A 129 3.189 -18.294 53.333 1.00 0.00 ATOM 1048 OH TYR A 129 1.929 -18.717 52.976 1.00 0.00 ATOM 1049 O TYR A 129 5.870 -17.977 57.402 1.00 0.00 ATOM 1050 C TYR A 129 6.904 -17.953 56.734 1.00 0.00 ATOM 1051 N ASP A 130 7.742 -18.982 56.658 1.00 0.00 ATOM 1052 CA ASP A 130 7.473 -20.240 57.344 1.00 0.00 ATOM 1053 CB ASP A 130 8.542 -21.279 56.997 1.00 0.00 ATOM 1054 CG ASP A 130 8.443 -21.836 55.583 1.00 0.00 ATOM 1055 OD1 ASP A 130 7.444 -21.607 54.944 1.00 0.00 ATOM 1056 OD2 ASP A 130 9.424 -22.346 55.098 1.00 0.00 ATOM 1057 O ASP A 130 6.741 -20.797 59.563 1.00 0.00 ATOM 1058 C ASP A 130 7.394 -20.030 58.853 1.00 0.00 ATOM 1059 N ALA A 131 8.088 -18.915 59.391 1.00 0.00 ATOM 1060 CA ALA A 131 8.096 -18.583 60.810 1.00 0.00 ATOM 1061 CB ALA A 131 9.075 -17.437 61.014 1.00 0.00 ATOM 1062 O ALA A 131 6.446 -18.357 62.532 1.00 0.00 ATOM 1063 C ALA A 131 6.679 -18.362 61.325 1.00 0.00 ATOM 1064 N LEU A 132 5.729 -18.176 60.375 1.00 0.00 ATOM 1065 CA LEU A 132 4.342 -17.971 60.775 1.00 0.00 ATOM 1066 CB LEU A 132 3.519 -17.604 59.532 1.00 0.00 ATOM 1067 CG LEU A 132 3.869 -16.253 58.895 1.00 0.00 ATOM 1068 CD1 LEU A 132 3.073 -16.060 57.611 1.00 0.00 ATOM 1069 CD2 LEU A 132 3.579 -15.134 59.883 1.00 0.00 ATOM 1070 O LEU A 132 2.875 -19.105 62.297 1.00 0.00 ATOM 1071 C LEU A 132 3.835 -19.196 61.533 1.00 0.00 ATOM 1072 N LYS A 133 4.497 -20.328 61.351 1.00 0.00 ATOM 1073 CA LYS A 133 4.077 -21.553 62.028 1.00 0.00 ATOM 1074 CB LYS A 133 4.887 -22.733 61.491 1.00 0.00 ATOM 1075 CG LYS A 133 4.594 -23.088 60.038 1.00 0.00 ATOM 1076 CD LYS A 133 5.431 -24.271 59.578 1.00 0.00 ATOM 1077 CE LYS A 133 5.139 -24.625 58.127 1.00 0.00 ATOM 1078 NZ LYS A 133 5.960 -25.775 57.658 1.00 0.00 ATOM 1079 O LYS A 133 3.368 -21.991 64.269 1.00 0.00 ATOM 1080 C LYS A 133 4.196 -21.433 63.544 1.00 0.00 ATOM 1081 N ALA A 134 5.203 -20.756 64.017 1.00 0.00 ATOM 1082 CA ALA A 134 5.437 -20.581 65.445 1.00 0.00 ATOM 1083 CB ALA A 134 6.928 -20.482 65.726 1.00 0.00 ATOM 1084 O ALA A 134 4.815 -19.052 67.189 1.00 0.00 ATOM 1085 C ALA A 134 4.713 -19.360 66.001 1.00 0.00 ATOM 1086 N MET A 135 3.994 -18.657 65.130 1.00 0.00 ATOM 1087 CA MET A 135 3.268 -17.457 65.528 1.00 0.00 ATOM 1088 CB MET A 135 3.282 -16.466 64.338 1.00 0.00 ATOM 1089 CG MET A 135 4.623 -15.898 64.067 1.00 0.00 ATOM 1090 SD MET A 135 5.248 -14.929 65.450 1.00 0.00 ATOM 1091 CE MET A 135 3.896 -13.713 65.671 1.00 0.00 ATOM 1092 O MET A 135 1.065 -18.412 65.513 1.00 0.00 ATOM 1093 C MET A 135 1.930 -17.820 66.161 1.00 0.00 ATOM 1094 N LYS A 136 1.749 -17.429 67.419 1.00 0.00 ATOM 1095 CA LYS A 136 0.523 -17.734 68.147 1.00 0.00 ATOM 1096 CB LYS A 136 0.764 -17.662 69.657 1.00 0.00 ATOM 1097 CG LYS A 136 -0.450 -18.025 70.505 1.00 0.00 ATOM 1098 CD LYS A 136 -0.094 -18.082 71.981 1.00 0.00 ATOM 1099 CE LYS A 136 -1.302 -18.460 72.828 1.00 0.00 ATOM 1100 NZ LYS A 136 -0.961 -18.548 74.274 1.00 0.00 ATOM 1101 O LYS A 136 -1.722 -17.208 67.477 1.00 0.00 ATOM 1102 C LYS A 136 -0.596 -16.782 67.738 1.00 0.00 ATOM 1103 N PHE A 137 -0.272 -15.495 67.656 1.00 0.00 ATOM 1104 CA PHE A 137 -1.256 -14.478 67.310 1.00 0.00 ATOM 1105 CB PHE A 137 -0.716 -13.084 67.631 1.00 0.00 ATOM 1106 CG PHE A 137 -0.625 -12.793 69.101 1.00 0.00 ATOM 1107 CD1 PHE A 137 0.607 -12.654 69.721 1.00 0.00 ATOM 1108 CD2 PHE A 137 -1.772 -12.658 69.870 1.00 0.00 ATOM 1109 CE1 PHE A 137 0.694 -12.386 71.074 1.00 0.00 ATOM 1110 CE2 PHE A 137 -1.690 -12.391 71.221 1.00 0.00 ATOM 1111 CZ PHE A 137 -0.456 -12.254 71.825 1.00 0.00 ATOM 1112 O PHE A 137 -0.806 -14.465 64.952 1.00 0.00 ATOM 1113 C PHE A 137 -1.651 -14.575 65.839 1.00 0.00 ATOM 1114 N ALA A 138 -2.939 -14.780 65.590 1.00 0.00 ATOM 1115 CA ALA A 138 -3.438 -14.969 64.233 1.00 0.00 ATOM 1116 CB ALA A 138 -4.874 -15.469 64.259 1.00 0.00 ATOM 1117 O ALA A 138 -2.873 -13.632 62.338 1.00 0.00 ATOM 1118 C ALA A 138 -3.298 -13.651 63.496 1.00 0.00 ATOM 1119 N ASP A 139 -3.629 -12.535 64.146 1.00 0.00 ATOM 1120 CA ASP A 139 -3.488 -11.245 63.464 1.00 0.00 ATOM 1121 CB ASP A 139 -4.215 -10.184 64.293 1.00 0.00 ATOM 1122 CG ASP A 139 -5.734 -10.269 64.231 1.00 0.00 ATOM 1123 OD1 ASP A 139 -6.237 -10.964 63.379 1.00 0.00 ATOM 1124 OD2 ASP A 139 -6.374 -9.772 65.127 1.00 0.00 ATOM 1125 O ASP A 139 -1.537 -10.575 62.142 1.00 0.00 ATOM 1126 C ASP A 139 -1.995 -10.971 63.239 1.00 0.00 ATOM 1127 N PHE A 140 -1.199 -11.374 64.248 1.00 0.00 ATOM 1128 CA PHE A 140 0.252 -11.186 64.147 1.00 0.00 ATOM 1129 CB PHE A 140 0.957 -11.406 65.488 1.00 0.00 ATOM 1130 CG PHE A 140 0.935 -10.205 66.388 1.00 0.00 ATOM 1131 CD1 PHE A 140 -0.189 -9.908 67.146 1.00 0.00 ATOM 1132 CD2 PHE A 140 2.036 -9.366 66.480 1.00 0.00 ATOM 1133 CE1 PHE A 140 -0.212 -8.804 67.975 1.00 0.00 ATOM 1134 CE2 PHE A 140 2.016 -8.261 67.308 1.00 0.00 ATOM 1135 CZ PHE A 140 0.891 -7.981 68.057 1.00 0.00 ATOM 1136 O PHE A 140 1.659 -11.668 62.266 1.00 0.00 ATOM 1137 C PHE A 140 0.854 -12.104 63.085 1.00 0.00 ATOM 1138 N ALA A 141 0.473 -13.366 63.108 1.00 0.00 ATOM 1139 CA ALA A 141 0.981 -14.335 62.143 1.00 0.00 ATOM 1140 CB ALA A 141 0.402 -15.713 62.428 1.00 0.00 ATOM 1141 O ALA A 141 1.486 -13.897 59.837 1.00 0.00 ATOM 1142 C ALA A 141 0.629 -13.913 60.719 1.00 0.00 ATOM 1143 N VAL A 142 -0.587 -13.650 60.508 1.00 0.00 ATOM 1144 CA VAL A 142 -1.058 -13.250 59.186 1.00 0.00 ATOM 1145 CB VAL A 142 -2.577 -12.991 59.181 1.00 0.00 ATOM 1146 CG1 VAL A 142 -3.005 -12.369 57.862 1.00 0.00 ATOM 1147 CG2 VAL A 142 -3.338 -14.283 59.432 1.00 0.00 ATOM 1148 O VAL A 142 0.009 -11.865 57.541 1.00 0.00 ATOM 1149 C VAL A 142 -0.334 -11.992 58.716 1.00 0.00 ATOM 1150 N TRP A 143 -0.108 -11.065 59.642 1.00 0.00 ATOM 1151 CA TRP A 143 0.579 -9.819 59.326 1.00 0.00 ATOM 1152 CB TRP A 143 0.681 -8.936 60.570 1.00 0.00 ATOM 1153 CG TRP A 143 1.149 -7.542 60.279 1.00 0.00 ATOM 1154 CD1 TRP A 143 2.436 -7.095 60.289 1.00 0.00 ATOM 1155 CD2 TRP A 143 0.335 -6.416 59.932 1.00 0.00 ATOM 1156 CE2 TRP A 143 1.196 -5.319 59.748 1.00 0.00 ATOM 1157 CE3 TRP A 143 -1.042 -6.229 59.759 1.00 0.00 ATOM 1158 NE1 TRP A 143 2.476 -5.760 59.973 1.00 0.00 ATOM 1159 CZ2 TRP A 143 0.734 -4.059 59.402 1.00 0.00 ATOM 1160 CZ3 TRP A 143 -1.506 -4.964 59.413 1.00 0.00 ATOM 1161 CH2 TRP A 143 -0.645 -3.912 59.239 1.00 0.00 ATOM 1162 O TRP A 143 2.329 -9.567 57.701 1.00 0.00 ATOM 1163 C TRP A 143 1.970 -10.086 58.759 1.00 0.00 ATOM 1164 N SER A 144 2.739 -10.954 59.463 1.00 0.00 ATOM 1165 CA SER A 144 4.090 -11.288 59.033 1.00 0.00 ATOM 1166 CB SER A 144 4.772 -12.154 60.077 1.00 0.00 ATOM 1167 OG SER A 144 4.973 -11.466 61.281 1.00 0.00 ATOM 1168 O SER A 144 4.969 -11.782 56.855 1.00 0.00 ATOM 1169 C SER A 144 4.080 -11.989 57.679 1.00 0.00 ATOM 1170 N GLU A 145 3.068 -12.821 57.457 1.00 0.00 ATOM 1171 CA GLU A 145 2.882 -13.477 56.169 1.00 0.00 ATOM 1172 CB GLU A 145 1.706 -14.453 56.229 1.00 0.00 ATOM 1173 CG GLU A 145 1.475 -15.238 54.945 1.00 0.00 ATOM 1174 CD GLU A 145 0.344 -16.217 55.101 1.00 0.00 ATOM 1175 OE1 GLU A 145 -0.217 -16.284 56.167 1.00 0.00 ATOM 1176 OE2 GLU A 145 -0.035 -16.816 54.121 1.00 0.00 ATOM 1177 O GLU A 145 3.173 -12.615 53.947 1.00 0.00 ATOM 1178 C GLU A 145 2.661 -12.459 55.055 1.00 0.00 ATOM 1179 N ALA A 146 1.890 -11.416 55.371 1.00 0.00 ATOM 1180 CA ALA A 146 1.600 -10.379 54.374 1.00 0.00 ATOM 1181 CB ALA A 146 0.631 -9.349 54.971 1.00 0.00 ATOM 1182 O ALA A 146 3.040 -9.289 52.759 1.00 0.00 ATOM 1183 C ALA A 146 2.894 -9.673 53.924 1.00 0.00 ATOM 1184 N ARG A 147 3.843 -9.479 54.931 1.00 0.00 ATOM 1185 CA ARG A 147 5.062 -8.780 54.541 1.00 0.00 ATOM 1186 CB ARG A 147 5.825 -9.657 53.558 1.00 0.00 ATOM 1187 CG ARG A 147 5.963 -11.056 54.141 1.00 0.00 ATOM 1188 CD ARG A 147 7.102 -11.805 53.588 1.00 0.00 ATOM 1189 NE ARG A 147 8.383 -11.310 54.071 1.00 0.00 ATOM 1190 CZ ARG A 147 9.531 -11.871 53.726 1.00 0.00 ATOM 1191 NH1 ARG A 147 9.504 -12.923 52.916 1.00 0.00 ATOM 1192 NH2 ARG A 147 10.687 -11.383 54.170 1.00 0.00 ATOM 1193 O ARG A 147 5.450 -6.968 53.014 1.00 0.00 ATOM 1194 C ARG A 147 4.743 -7.427 53.912 1.00 0.00 ATOM 1195 N PHE A 148 3.673 -6.796 54.385 1.00 0.00 ATOM 1196 CA PHE A 148 3.359 -5.426 53.997 1.00 0.00 ATOM 1197 CB PHE A 148 2.076 -4.957 54.684 1.00 0.00 ATOM 1198 CG PHE A 148 0.835 -5.632 54.175 1.00 0.00 ATOM 1199 CD1 PHE A 148 0.860 -6.361 52.996 1.00 0.00 ATOM 1200 CD2 PHE A 148 -0.361 -5.538 54.872 1.00 0.00 ATOM 1201 CE1 PHE A 148 -0.282 -6.983 52.525 1.00 0.00 ATOM 1202 CE2 PHE A 148 -1.502 -6.158 54.405 1.00 0.00 ATOM 1203 CZ PHE A 148 -1.463 -6.881 53.229 1.00 0.00 ATOM 1204 O PHE A 148 4.955 -3.681 53.513 1.00 0.00 ATOM 1205 C PHE A 148 4.506 -4.467 54.350 1.00 0.00 ATOM 1206 N SER A 149 5.010 -4.590 55.572 1.00 0.00 ATOM 1207 CA SER A 149 6.097 -3.720 56.013 1.00 0.00 ATOM 1208 CB SER A 149 6.376 -3.966 57.483 1.00 0.00 ATOM 1209 OG SER A 149 5.293 -3.599 58.293 1.00 0.00 ATOM 1210 O SER A 149 8.059 -2.956 54.859 1.00 0.00 ATOM 1211 C SER A 149 7.365 -3.917 55.192 1.00 0.00 ATOM 1212 N GLY A 150 7.656 -5.170 54.853 1.00 0.00 ATOM 1213 CA GLY A 150 8.864 -5.501 54.108 1.00 0.00 ATOM 1214 O GLY A 150 9.803 -4.296 52.256 1.00 0.00 ATOM 1215 C GLY A 150 8.831 -4.901 52.706 1.00 0.00 ATOM 1216 N MET A 151 7.699 -5.059 52.027 1.00 0.00 ATOM 1217 CA MET A 151 7.540 -4.545 50.671 1.00 0.00 ATOM 1218 CB MET A 151 6.247 -5.034 50.036 1.00 0.00 ATOM 1219 CG MET A 151 6.232 -6.555 49.779 1.00 0.00 ATOM 1220 SD MET A 151 7.626 -7.164 48.782 1.00 0.00 ATOM 1221 CE MET A 151 8.825 -7.615 50.050 1.00 0.00 ATOM 1222 O MET A 151 8.234 -2.408 49.818 1.00 0.00 ATOM 1223 C MET A 151 7.581 -3.013 50.666 1.00 0.00 ATOM 1224 N VAL A 152 6.890 -2.399 51.610 1.00 0.00 ATOM 1225 CA VAL A 152 6.870 -0.941 51.692 1.00 0.00 ATOM 1226 CB VAL A 152 5.835 -0.468 52.787 1.00 0.00 ATOM 1227 CG1 VAL A 152 5.943 1.063 52.939 1.00 0.00 ATOM 1228 CG2 VAL A 152 4.409 -0.805 52.443 1.00 0.00 ATOM 1229 O VAL A 152 8.682 0.609 51.408 1.00 0.00 ATOM 1230 C VAL A 152 8.261 -0.391 51.992 1.00 0.00 ATOM 1231 N LYS A 153 8.968 -1.049 52.904 1.00 0.00 ATOM 1232 CA LYS A 153 10.308 -0.620 53.290 1.00 0.00 ATOM 1233 CB LYS A 153 11.112 -1.978 53.741 1.00 0.00 ATOM 1234 CG LYS A 153 11.958 -2.059 55.003 1.00 0.00 ATOM 1235 CD LYS A 153 11.788 -3.424 55.663 1.00 0.00 ATOM 1236 CE LYS A 153 11.872 -3.313 57.176 1.00 0.00 ATOM 1237 NZ LYS A 153 11.548 -4.589 57.876 1.00 0.00 ATOM 1238 O LYS A 153 12.009 0.390 51.931 1.00 0.00 ATOM 1239 C LYS A 153 11.253 -0.568 52.095 1.00 0.00 ATOM 1240 N THR A 154 11.213 -1.607 51.268 1.00 0.00 ATOM 1241 CA THR A 154 12.099 -1.704 50.116 1.00 0.00 ATOM 1242 CB THR A 154 11.880 -3.017 49.341 1.00 0.00 ATOM 1243 CG2 THR A 154 12.772 -3.066 48.110 1.00 0.00 ATOM 1244 OG1 THR A 154 12.180 -4.132 50.189 1.00 0.00 ATOM 1245 O THR A 154 12.852 0.092 48.712 1.00 0.00 ATOM 1246 C THR A 154 11.892 -0.523 49.172 1.00 0.00 ATOM 1247 N ALA A 155 10.631 -0.212 48.891 1.00 0.00 ATOM 1248 CA ALA A 155 10.294 0.916 48.033 1.00 0.00 ATOM 1249 CB ALA A 155 8.786 1.005 47.840 1.00 0.00 ATOM 1250 O ALA A 155 11.298 3.092 47.848 1.00 0.00 ATOM 1251 C ALA A 155 10.791 2.246 48.593 1.00 0.00 ATOM 1252 N LEU A 156 10.626 2.424 49.898 1.00 0.00 ATOM 1253 CA LEU A 156 11.069 3.662 50.547 1.00 0.00 ATOM 1254 CB LEU A 156 10.831 3.635 52.030 1.00 0.00 ATOM 1255 CG LEU A 156 11.292 4.866 52.814 1.00 0.00 ATOM 1256 CD1 LEU A 156 10.686 6.157 52.253 1.00 0.00 ATOM 1257 CD2 LEU A 156 10.946 4.671 54.290 1.00 0.00 ATOM 1258 O LEU A 156 13.008 4.967 49.985 1.00 0.00 ATOM 1259 C LEU A 156 12.569 3.875 50.355 1.00 0.00 ATOM 1260 N THR A 157 13.348 2.828 50.590 1.00 0.00 ATOM 1261 CA THR A 157 14.797 2.909 50.436 1.00 0.00 ATOM 1262 CB THR A 157 15.460 1.555 50.797 1.00 0.00 ATOM 1263 CG2 THR A 157 16.986 1.641 50.648 1.00 0.00 ATOM 1264 OG1 THR A 157 15.141 1.211 52.149 1.00 0.00 ATOM 1265 O THR A 157 16.090 4.044 48.761 1.00 0.00 ATOM 1266 C THR A 157 15.159 3.274 49.001 1.00 0.00 ATOM 1267 N LEU A 158 14.430 2.723 48.043 1.00 0.00 ATOM 1268 CA LEU A 158 14.695 2.921 46.623 1.00 0.00 ATOM 1269 CB LEU A 158 13.842 1.959 45.786 1.00 0.00 ATOM 1270 CG LEU A 158 14.239 0.479 45.889 1.00 0.00 ATOM 1271 CD1 LEU A 158 13.212 -0.385 45.168 1.00 0.00 ATOM 1272 CD2 LEU A 158 15.624 0.281 45.294 1.00 0.00 ATOM 1273 O LEU A 158 15.282 5.008 45.601 1.00 0.00 ATOM 1274 C LEU A 158 14.426 4.364 46.210 1.00 0.00 ATOM 1275 N ALA A 159 13.299 4.904 46.661 1.00 0.00 ATOM 1276 CA ALA A 159 12.947 6.291 46.379 1.00 0.00 ATOM 1277 CB ALA A 159 11.501 6.561 46.766 1.00 0.00 ATOM 1278 O ALA A 159 14.299 8.273 46.539 1.00 0.00 ATOM 1279 C ALA A 159 13.891 7.253 47.099 1.00 0.00 ATOM 1280 N VAL A 160 14.232 6.915 48.335 1.00 0.00 ATOM 1281 CA VAL A 160 15.133 7.740 49.133 1.00 0.00 ATOM 1282 CB VAL A 160 15.269 7.196 50.567 1.00 0.00 ATOM 1283 CG1 VAL A 160 16.310 7.988 51.343 1.00 0.00 ATOM 1284 CG2 VAL A 160 13.926 7.240 51.283 1.00 0.00 ATOM 1285 O VAL A 160 17.071 8.977 48.439 1.00 0.00 ATOM 1286 C VAL A 160 16.523 7.876 48.519 1.00 0.00 ATOM 1287 N THR A 161 17.079 6.751 48.090 1.00 0.00 ATOM 1288 CA THR A 161 18.390 6.758 47.444 1.00 0.00 ATOM 1289 CB THR A 161 18.832 5.287 47.152 1.00 0.00 ATOM 1290 CG2 THR A 161 20.152 5.289 46.416 1.00 0.00 ATOM 1291 OG1 THR A 161 18.975 4.598 48.393 1.00 0.00 ATOM 1292 O THR A 161 19.312 8.352 45.926 1.00 0.00 ATOM 1293 C THR A 161 18.377 7.602 46.181 1.00 0.00 ATOM 1294 N THR A 162 17.312 7.499 45.401 1.00 0.00 ATOM 1295 CA THR A 162 17.184 8.290 44.182 1.00 0.00 ATOM 1296 CB THR A 162 15.948 7.820 43.367 1.00 0.00 ATOM 1297 CG2 THR A 162 15.787 8.690 42.141 1.00 0.00 ATOM 1298 OG1 THR A 162 16.155 6.465 42.969 1.00 0.00 ATOM 1299 O THR A 162 17.765 10.586 43.905 1.00 0.00 ATOM 1300 C THR A 162 17.095 9.777 44.512 1.00 0.00 ATOM 1301 N THR A 163 16.294 10.135 45.516 1.00 0.00 ATOM 1302 CA THR A 163 16.182 11.525 45.946 1.00 0.00 ATOM 1303 CB THR A 163 15.057 11.639 46.995 1.00 0.00 ATOM 1304 CG2 THR A 163 14.971 13.061 47.499 1.00 0.00 ATOM 1305 OG1 THR A 163 13.821 11.271 46.384 1.00 0.00 ATOM 1306 O THR A 163 17.899 13.181 46.218 1.00 0.00 ATOM 1307 C THR A 163 17.516 12.046 46.485 1.00 0.00 ATOM 1308 N LEU A 164 18.232 11.228 47.276 1.00 0.00 ATOM 1309 CA LEU A 164 19.520 11.627 47.826 1.00 0.00 ATOM 1310 CB LEU A 164 20.043 10.598 48.812 1.00 0.00 ATOM 1311 CG LEU A 164 19.256 10.506 50.124 1.00 0.00 ATOM 1312 CD1 LEU A 164 19.762 9.338 50.965 1.00 0.00 ATOM 1313 CD2 LEU A 164 19.388 11.814 50.890 1.00 0.00 ATOM 1314 O LEU A 164 21.321 12.777 46.743 1.00 0.00 ATOM 1315 C LEU A 164 20.518 11.835 46.693 1.00 0.00 ATOM 1316 N LYS A 165 20.470 10.999 45.632 1.00 0.00 ATOM 1317 CA LYS A 165 21.337 11.198 44.490 1.00 0.00 ATOM 1318 CB LYS A 165 21.251 9.998 43.543 1.00 0.00 ATOM 1319 CG LYS A 165 22.219 10.067 42.371 1.00 0.00 ATOM 1320 CD LYS A 165 22.044 8.899 41.403 1.00 0.00 ATOM 1321 CE LYS A 165 23.080 8.974 40.286 1.00 0.00 ATOM 1322 NZ LYS A 165 22.805 8.001 39.182 1.00 0.00 ATOM 1323 O LYS A 165 21.890 13.231 43.339 1.00 0.00 ATOM 1324 C LYS A 165 20.999 12.510 43.791 1.00 0.00 ATOM 1325 N GLU A 166 19.706 12.799 43.673 1.00 0.00 ATOM 1326 CA GLU A 166 19.265 14.026 43.021 1.00 0.00 ATOM 1327 CB GLU A 166 17.747 14.013 42.825 1.00 0.00 ATOM 1328 CG GLU A 166 17.274 13.021 41.778 1.00 0.00 ATOM 1329 CD GLU A 166 17.932 13.252 40.428 1.00 0.00 ATOM 1330 OE1 GLU A 166 17.814 14.376 39.891 1.00 0.00 ATOM 1331 OE2 GLU A 166 18.566 12.312 39.908 1.00 0.00 ATOM 1332 O GLU A 166 20.117 16.252 43.218 1.00 0.00 ATOM 1333 C GLU A 166 19.670 15.263 43.801 1.00 0.00 ATOM 1334 N LEU A 167 19.539 15.203 45.124 1.00 0.00 ATOM 1335 CA LEU A 167 19.907 16.339 45.949 1.00 0.00 ATOM 1336 CB LEU A 167 19.427 16.124 47.389 1.00 0.00 ATOM 1337 CG LEU A 167 19.603 17.297 48.355 1.00 0.00 ATOM 1338 CD1 LEU A 167 19.009 18.567 47.753 1.00 0.00 ATOM 1339 CD2 LEU A 167 18.930 16.961 49.682 1.00 0.00 ATOM 1340 O LEU A 167 21.916 17.652 45.834 1.00 0.00 ATOM 1341 C LEU A 167 21.425 16.526 45.894 1.00 0.00 ATOM 1342 N THR A 168 22.162 15.398 45.903 1.00 0.00 ATOM 1343 CA THR A 168 23.627 15.488 45.816 1.00 0.00 ATOM 1344 CB THR A 168 24.300 14.990 47.109 1.00 0.00 ATOM 1345 CG2 THR A 168 23.807 15.787 48.307 1.00 0.00 ATOM 1346 OG1 THR A 168 23.987 13.606 47.312 1.00 0.00 ATOM 1347 O THR A 168 23.535 13.653 44.240 1.00 0.00 ATOM 1348 C THR A 168 24.171 14.638 44.656 1.00 0.00 ATOM 1349 N PRO A 169 25.371 14.963 44.174 1.00 0.00 ATOM 1350 CA PRO A 169 26.004 14.175 43.099 1.00 0.00 ATOM 1351 CB PRO A 169 27.271 14.963 42.761 1.00 0.00 ATOM 1352 CG PRO A 169 27.700 15.558 44.059 1.00 0.00 ATOM 1353 CD PRO A 169 26.441 15.992 44.756 1.00 0.00 ATOM 1354 O PRO A 169 26.700 11.972 42.581 1.00 0.00 ATOM 1355 C PRO A 169 26.368 12.740 43.503 1.00 0.00 ENDMDL EXPDTA 2hktA MODEL 2 REMARK 44 REMARK 44 model 2 is called 2hktA ATOM 1 N MET 1 -8.417 4.409 61.081 1.00 0.00 ATOM 2 CA MET 1 -8.574 3.220 61.973 1.00 0.00 ATOM 3 CB MET 1 -9.091 3.621 63.369 1.00 0.00 ATOM 4 CG MET 1 -9.175 5.111 63.646 1.00 0.00 ATOM 5 SD MET 1 -7.454 5.990 63.668 1.00 0.00 ATOM 6 CE MET 1 -7.611 6.856 65.375 1.00 0.00 ATOM 7 O MET 1 -10.263 1.504 62.068 1.00 0.00 ATOM 8 C MET 1 -9.503 2.177 61.358 1.00 0.00 ATOM 9 N ALA 2 -9.432 2.029 60.033 1.00 0.00 ATOM 10 CA ALA 2 -10.234 1.041 59.309 1.00 0.00 ATOM 11 CB ALA 2 -10.197 1.327 57.821 1.00 0.00 ATOM 12 O ALA 2 -9.252 -0.632 60.733 1.00 0.00 ATOM 13 C ALA 2 -9.608 -0.323 59.592 1.00 0.00 ATOM 14 N THR 3 -9.467 -1.139 58.559 1.00 0.00 ATOM 15 CA THR 3 -8.856 -2.440 58.730 1.00 0.00 ATOM 16 CB THR 3 -9.911 -3.563 58.789 1.00 0.00 ATOM 17 CG2 THR 3 -9.549 -4.551 59.892 1.00 0.00 ATOM 18 OG1 THR 3 -11.186 -2.997 59.126 1.00 0.00 ATOM 19 O THR 3 -7.933 -1.943 56.567 1.00 0.00 ATOM 20 C THR 3 -7.841 -2.600 57.611 1.00 0.00 ATOM 21 N LEU 4 -6.825 -3.408 57.872 1.00 0.00 ATOM 22 CA LEU 4 -5.752 -3.602 56.918 1.00 0.00 ATOM 23 CB LEU 4 -4.418 -3.669 57.666 1.00 0.00 ATOM 24 CG LEU 4 -3.638 -2.467 58.219 1.00 0.00 ATOM 25 CD1 LEU 4 -4.410 -1.160 58.344 1.00 0.00 ATOM 26 CD2 LEU 4 -3.091 -2.895 59.528 1.00 0.00 ATOM 27 O LEU 4 -5.685 -5.935 56.365 1.00 0.00 ATOM 28 C LEU 4 -5.843 -4.778 55.958 1.00 0.00 ATOM 29 N THR 5 -6.141 -4.482 54.691 1.00 0.00 ATOM 30 CA THR 5 -6.145 -5.518 53.652 1.00 0.00 ATOM 31 CB THR 5 -7.016 -5.203 52.402 1.00 0.00 ATOM 32 CG2 THR 5 -7.741 -6.467 51.920 1.00 0.00 ATOM 33 OG1 THR 5 -7.965 -4.171 52.694 1.00 0.00 ATOM 34 O THR 5 -4.153 -4.259 53.283 1.00 0.00 ATOM 35 C THR 5 -4.718 -5.363 53.178 1.00 0.00 ATOM 36 N GLU 6 -4.121 -6.438 52.671 1.00 0.00 ATOM 37 CA GLU 6 -2.762 -6.319 52.182 1.00 0.00 ATOM 38 CB GLU 6 -2.092 -7.667 51.905 1.00 0.00 ATOM 39 CG GLU 6 -0.556 -7.557 51.800 1.00 0.00 ATOM 40 CD GLU 6 0.186 -8.147 52.996 1.00 0.00 ATOM 41 OE1 GLU 6 -0.142 -7.818 54.164 1.00 0.00 ATOM 42 OE2 GLU 6 1.128 -8.930 52.754 1.00 0.00 ATOM 43 O GLU 6 -1.924 -4.591 50.798 1.00 0.00 ATOM 44 C GLU 6 -2.786 -5.463 50.929 1.00 0.00 ATOM 45 N ASP 7 -3.792 -5.611 50.055 1.00 0.00 ATOM 46 CA ASP 7 -3.700 -4.732 48.904 1.00 0.00 ATOM 47 CB ASP 7 -3.516 -5.373 47.484 1.00 0.00 ATOM 48 CG ASP 7 -4.668 -6.247 47.000 1.00 0.00 ATOM 49 OD1 ASP 7 -4.423 -7.456 46.769 1.00 0.00 ATOM 50 OD2 ASP 7 -5.756 -5.718 46.695 1.00 0.00 ATOM 51 O ASP 7 -3.576 -2.507 48.085 1.00 0.00 ATOM 52 C ASP 7 -4.029 -3.237 48.965 1.00 0.00 ATOM 53 N ASP 8 -4.665 -2.739 50.033 1.00 0.00 ATOM 54 CA ASP 8 -4.809 -1.281 50.096 1.00 0.00 ATOM 55 CB ASP 8 -6.243 -0.755 50.250 1.00 0.00 ATOM 56 CG ASP 8 -6.683 -0.651 51.676 1.00 0.00 ATOM 57 OD1 ASP 8 -6.557 0.447 52.268 1.00 0.00 ATOM 58 OD2 ASP 8 -7.153 -1.675 52.196 1.00 0.00 ATOM 59 O ASP 8 -3.670 0.641 51.005 1.00 0.00 ATOM 60 C ASP 8 -3.776 -0.588 51.013 1.00 0.00 ATOM 61 N VAL 9 -3.016 -1.376 51.789 1.00 0.00 ATOM 62 CA VAL 9 -1.920 -0.840 52.620 1.00 0.00 ATOM 63 CB VAL 9 -1.392 -1.878 53.658 1.00 0.00 ATOM 64 CG1 VAL 9 0.101 -1.658 53.992 1.00 0.00 ATOM 65 CG2 VAL 9 -2.175 -1.749 54.911 1.00 0.00 ATOM 66 O VAL 9 -0.192 0.449 51.543 1.00 0.00 ATOM 67 C VAL 9 -0.860 -0.588 51.559 1.00 0.00 ATOM 68 N LEU 10 -0.834 -1.525 50.614 1.00 0.00 ATOM 69 CA LEU 10 0.050 -1.527 49.471 1.00 0.00 ATOM 70 CB LEU 10 -0.105 -2.858 48.741 1.00 0.00 ATOM 71 CG LEU 10 0.968 -3.451 47.831 1.00 0.00 ATOM 72 CD1 LEU 10 2.359 -2.979 48.201 1.00 0.00 ATOM 73 CD2 LEU 10 0.883 -4.966 47.930 1.00 0.00 ATOM 74 O LEU 10 0.585 0.146 47.847 1.00 0.00 ATOM 75 C LEU 10 -0.287 -0.356 48.549 1.00 0.00 ATOM 76 N GLU 11 -1.540 0.100 48.589 1.00 0.00 ATOM 77 CA GLU 11 -1.985 1.237 47.779 1.00 0.00 ATOM 78 CB GLU 11 -3.520 1.242 47.632 1.00 0.00 ATOM 79 CG GLU 11 -4.136 2.520 47.048 1.00 0.00 ATOM 80 CD GLU 11 -5.647 2.529 47.115 1.00 0.00 ATOM 81 OE1 GLU 11 -6.272 2.173 46.092 1.00 0.00 ATOM 82 OE2 GLU 11 -6.207 2.885 48.182 1.00 0.00 ATOM 83 O GLU 11 -1.006 3.429 47.713 1.00 0.00 ATOM 84 C GLU 11 -1.510 2.547 48.412 1.00 0.00 ATOM 85 N GLN 12 -1.653 2.643 49.735 1.00 0.00 ATOM 86 CA GLN 12 -1.270 3.831 50.497 1.00 0.00 ATOM 87 CB GLN 12 -1.681 3.698 51.964 1.00 0.00 ATOM 88 CG GLN 12 -3.169 3.595 52.201 1.00 0.00 ATOM 89 CD GLN 12 -3.543 3.878 53.636 1.00 0.00 ATOM 90 OE1 GLN 12 -4.086 3.017 54.327 1.00 0.00 ATOM 91 NE2 GLN 12 -3.266 5.097 54.091 1.00 0.00 ATOM 92 O GLN 12 0.591 5.309 50.394 1.00 0.00 ATOM 93 C GLN 12 0.208 4.142 50.447 1.00 0.00 ATOM 94 N LEU 13 1.025 3.092 50.433 1.00 0.00 ATOM 95 CA LEU 13 2.474 3.249 50.419 1.00 0.00 ATOM 96 CB LEU 13 3.150 2.034 51.038 1.00 0.00 ATOM 97 CG LEU 13 2.906 1.930 52.540 1.00 0.00 ATOM 98 CD1 LEU 13 3.349 0.599 53.009 1.00 0.00 ATOM 99 CD2 LEU 13 3.617 3.032 53.293 1.00 0.00 ATOM 100 O LEU 13 4.073 4.325 49.020 1.00 0.00 ATOM 101 C LEU 13 3.079 3.596 49.079 1.00 0.00 ATOM 102 N ASP 14 2.447 3.129 48.002 1.00 0.00 ATOM 103 CA ASP 14 2.947 3.431 46.667 1.00 0.00 ATOM 104 CB ASP 14 2.510 2.398 45.627 1.00 0.00 ATOM 105 CG ASP 14 3.591 2.157 44.569 1.00 0.00 ATOM 106 OD1 ASP 14 3.580 2.852 43.530 1.00 0.00 ATOM 107 OD2 ASP 14 4.480 1.302 44.797 1.00 0.00 ATOM 108 O ASP 14 3.270 5.500 45.515 1.00 0.00 ATOM 109 C ASP 14 2.549 4.843 46.260 1.00 0.00 ATOM 110 N ALA 15 1.467 5.339 46.855 1.00 0.00 ATOM 111 CA ALA 15 0.988 6.691 46.602 1.00 0.00 ATOM 112 CB ALA 15 -0.373 6.896 47.255 1.00 0.00 ATOM 113 O ALA 15 2.038 8.859 46.616 1.00 0.00 ATOM 114 C ALA 15 1.993 7.735 47.118 1.00 0.00 ATOM 115 N GLN 16 2.826 7.334 48.080 1.00 0.00 ATOM 116 CA GLN 16 3.841 8.209 48.668 1.00 0.00 ATOM 117 CB GLN 16 4.147 7.777 50.094 1.00 0.00 ATOM 118 CG GLN 16 2.930 7.450 50.976 1.00 0.00 ATOM 119 CD GLN 16 1.848 8.538 51.028 1.00 0.00 ATOM 120 OE1 GLN 16 2.137 9.735 50.973 1.00 0.00 ATOM 121 NE2 GLN 16 0.591 8.108 51.146 1.00 0.00 ATOM 122 O GLN 16 5.651 7.150 47.506 1.00 0.00 ATOM 123 C GLN 16 5.097 8.204 47.799 1.00 0.00 ATOM 124 N ASP 17 5.550 9.396 47.422 1.00 0.00 ATOM 125 CA ASP 17 6.688 9.590 46.507 1.00 0.00 ATOM 126 CB ASP 17 6.179 10.431 45.323 1.00 0.00 ATOM 127 CG ASP 17 5.831 11.889 45.721 1.00 0.00 ATOM 128 OD1 ASP 17 5.403 12.151 46.876 1.00 0.00 ATOM 129 OD2 ASP 17 6.022 12.781 44.873 1.00 0.00 ATOM 130 O ASP 17 8.770 10.796 46.417 1.00 0.00 ATOM 131 C ASP 17 7.888 10.301 47.121 1.00 0.00 ATOM 132 N ASN 18 7.911 10.318 48.441 1.00 0.00 ATOM 133 CA ASN 18 8.900 11.036 49.224 1.00 0.00 ATOM 134 CB ASN 18 8.239 12.434 49.426 1.00 0.00 ATOM 135 CG ASN 18 8.504 13.080 50.740 1.00 0.00 ATOM 136 ND2 ASN 18 7.905 12.555 51.776 1.00 0.00 ATOM 137 OD1 ASN 18 9.131 14.135 50.801 1.00 0.00 ATOM 138 O ASN 18 8.155 9.462 50.886 1.00 0.00 ATOM 139 C ASN 18 9.093 10.147 50.468 1.00 0.00 ATOM 140 N LEU 19 10.320 10.071 50.987 1.00 0.00 ATOM 141 CA LEU 19 10.607 9.236 52.161 1.00 0.00 ATOM 142 CB LEU 19 12.107 9.204 52.486 1.00 0.00 ATOM 143 CG LEU 19 12.841 8.070 53.244 1.00 0.00 ATOM 144 CD1 LEU 19 13.569 8.640 54.436 1.00 0.00 ATOM 145 CD2 LEU 19 11.964 6.897 53.656 1.00 0.00 ATOM 146 O LEU 19 9.218 8.806 54.031 1.00 0.00 ATOM 147 C LEU 19 9.812 9.656 53.379 1.00 0.00 ATOM 148 N PHE 20 9.733 10.966 53.612 1.00 0.00 ATOM 149 CA PHE 20 8.995 11.534 54.746 1.00 0.00 ATOM 150 CB PHE 20 9.098 13.073 54.740 1.00 0.00 ATOM 151 CG PHE 20 8.283 13.736 55.821 1.00 0.00 ATOM 152 CD1 PHE 20 6.991 14.221 55.555 1.00 0.00 ATOM 153 CD2 PHE 20 8.773 13.817 57.134 1.00 0.00 ATOM 154 CE1 PHE 20 6.196 14.739 56.592 1.00 0.00 ATOM 155 CE2 PHE 20 7.983 14.341 58.180 1.00 0.00 ATOM 156 CZ PHE 20 6.698 14.806 57.907 1.00 0.00 ATOM 157 O PHE 20 7.007 10.673 55.785 1.00 0.00 ATOM 158 C PHE 20 7.522 11.101 54.751 1.00 0.00 ATOM 159 N SER 21 6.859 11.268 53.604 1.00 0.00 ATOM 160 CA SER 21 5.451 10.922 53.425 1.00 0.00 ATOM 161 CB SER 21 4.957 11.328 52.044 1.00 0.00 ATOM 162 OG SER 21 5.022 12.725 51.886 1.00 0.00 ATOM 163 O SER 21 4.337 9.010 54.272 1.00 0.00 ATOM 164 C SER 21 5.270 9.441 53.600 1.00 0.00 ATOM 165 N PHE 22 6.223 8.677 53.061 1.00 0.00 ATOM 166 CA PHE 22 6.215 7.225 53.151 1.00 0.00 ATOM 167 CB PHE 22 7.393 6.622 52.371 1.00 0.00 ATOM 168 CG PHE 22 7.359 5.124 52.272 1.00 0.00 ATOM 169 CD1 PHE 22 6.793 4.503 51.155 1.00 0.00 ATOM 170 CD2 PHE 22 7.806 4.322 53.348 1.00 0.00 ATOM 171 CE1 PHE 22 6.672 3.100 51.108 1.00 0.00 ATOM 172 CE2 PHE 22 7.687 2.934 53.318 1.00 0.00 ATOM 173 CZ PHE 22 7.114 2.317 52.201 1.00 0.00 ATOM 174 O PHE 22 5.436 6.063 55.079 1.00 0.00 ATOM 175 C PHE 22 6.275 6.833 54.608 1.00 0.00 ATOM 176 N MET 23 7.245 7.398 55.319 1.00 0.00 ATOM 177 CA MET 23 7.412 7.095 56.723 1.00 0.00 ATOM 178 CB MET 23 8.765 7.562 57.222 1.00 0.00 ATOM 179 CG MET 23 9.944 6.801 56.595 1.00 0.00 ATOM 180 SD MET 23 10.035 4.874 56.831 1.00 0.00 ATOM 181 CE MET 23 10.317 4.853 58.739 1.00 0.00 ATOM 182 O MET 23 5.960 6.934 58.595 1.00 0.00 ATOM 183 C MET 23 6.275 7.584 57.602 1.00 0.00 ATOM 184 N LYS 24 5.616 8.675 57.197 1.00 0.00 ATOM 185 CA LYS 24 4.465 9.220 57.932 1.00 0.00 ATOM 186 CB LYS 24 4.045 10.600 57.383 1.00 0.00 ATOM 187 CG LYS 24 2.937 11.299 58.197 1.00 0.00 ATOM 188 CD LYS 24 2.794 12.773 57.877 1.00 0.00 ATOM 189 CE LYS 24 1.438 13.312 58.357 1.00 0.00 ATOM 190 NZ LYS 24 1.142 14.701 57.875 1.00 0.00 ATOM 191 O LYS 24 2.693 7.846 58.806 1.00 0.00 ATOM 192 C LYS 24 3.319 8.224 57.812 1.00 0.00 ATOM 193 N THR 25 3.146 7.728 56.590 1.00 0.00 ATOM 194 CA THR 25 2.122 6.753 56.247 1.00 0.00 ATOM 195 CB THR 25 1.986 6.662 54.727 1.00 0.00 ATOM 196 CG2 THR 25 0.771 5.841 54.312 1.00 0.00 ATOM 197 OG1 THR 25 1.852 7.987 54.202 1.00 0.00 ATOM 198 O THR 25 1.529 4.753 57.403 1.00 0.00 ATOM 199 C THR 25 2.425 5.375 56.838 1.00 0.00 ATOM 200 N ALA 26 3.684 4.932 56.750 1.00 0.00 ATOM 201 CA ALA 26 4.105 3.632 57.285 1.00 0.00 ATOM 202 CB ALA 26 5.587 3.379 57.006 1.00 0.00 ATOM 203 O ALA 26 3.231 2.654 59.274 1.00 0.00 ATOM 204 C ALA 26 3.847 3.591 58.773 1.00 0.00 ATOM 205 N HIS 27 4.216 4.676 59.450 1.00 0.00 ATOM 206 CA HIS 27 4.031 4.796 60.891 1.00 0.00 ATOM 207 CB HIS 27 4.578 6.129 61.407 1.00 0.00 ATOM 208 CG HIS 27 4.275 6.382 62.850 1.00 0.00 ATOM 209 CD2 HIS 27 4.799 5.835 63.982 1.00 0.00 ATOM 210 ND1 HIS 27 3.277 7.230 63.265 1.00 0.00 ATOM 211 CE1 HIS 27 3.186 7.201 64.583 1.00 0.00 ATOM 212 NE2 HIS 27 4.102 6.360 65.035 1.00 0.00 ATOM 213 O HIS 27 2.277 3.995 62.308 1.00 0.00 ATOM 214 C HIS 27 2.573 4.655 61.314 1.00 0.00 ATOM 215 N SER 28 1.672 5.293 60.579 1.00 0.00 ATOM 216 CA SER 28 0.272 5.198 60.941 1.00 0.00 ATOM 217 CB SER 28 -0.535 6.432 60.507 1.00 0.00 ATOM 218 OG SER 28 -1.169 6.256 59.260 1.00 0.00 ATOM 219 O SER 28 -1.369 3.508 61.037 1.00 0.00 ATOM 220 C SER 28 -0.346 3.876 60.509 1.00 0.00 ATOM 221 N ILE 29 0.309 3.138 59.612 1.00 0.00 ATOM 222 CA ILE 29 -0.193 1.822 59.201 1.00 0.00 ATOM 223 CB ILE 29 0.259 1.427 57.774 1.00 0.00 ATOM 224 CG1 ILE 29 -0.627 2.142 56.756 1.00 0.00 ATOM 225 CG2 ILE 29 0.145 -0.085 57.543 1.00 0.00 ATOM 226 CD1 ILE 29 -0.033 2.206 55.369 1.00 0.00 ATOM 227 O ILE 29 -0.533 -0.090 60.594 1.00 0.00 ATOM 228 C ILE 29 0.248 0.798 60.245 1.00 0.00 ATOM 229 N LEU 30 1.472 0.951 60.755 1.00 0.00 ATOM 230 CA LEU 30 1.994 0.068 61.798 1.00 0.00 ATOM 231 CB LEU 30 3.496 0.275 62.003 1.00 0.00 ATOM 232 CG LEU 30 4.337 -0.075 60.775 1.00 0.00 ATOM 233 CD1 LEU 30 5.759 0.408 60.942 1.00 0.00 ATOM 234 CD2 LEU 30 4.284 -1.570 60.507 1.00 0.00 ATOM 235 O LEU 30 0.949 -0.668 63.817 1.00 0.00 ATOM 236 C LEU 30 1.242 0.292 63.112 1.00 0.00 ATOM 237 N LEU 31 0.868 1.551 63.390 1.00 0.00 ATOM 238 CA LEU 31 0.107 1.904 64.593 1.00 0.00 ATOM 239 CB LEU 31 -0.041 3.425 64.768 1.00 0.00 ATOM 240 CG LEU 31 -0.009 4.075 66.173 1.00 0.00 ATOM 241 CD1 LEU 31 -1.011 5.197 66.236 1.00 0.00 ATOM 242 CD2 LEU 31 -0.265 3.108 67.327 1.00 0.00 ATOM 243 O LEU 31 -1.687 0.543 65.348 1.00 0.00 ATOM 244 C LEU 31 -1.270 1.272 64.449 1.00 0.00 ATOM 245 N GLN 32 -1.913 1.479 63.285 1.00 0.00 ATOM 246 CA GLN 32 -3.240 0.905 62.973 1.00 0.00 ATOM 247 CB GLN 32 -3.737 1.297 61.544 1.00 0.00 ATOM 248 CG GLN 32 -4.236 2.789 61.308 1.00 0.00 ATOM 249 CD GLN 32 -4.651 3.149 59.827 1.00 0.00 ATOM 250 OE1 GLN 32 -3.877 3.008 58.874 1.00 0.00 ATOM 251 NE2 GLN 32 -5.865 3.665 59.675 1.00 0.00 ATOM 252 O GLN 32 -3.983 -1.300 63.624 1.00 0.00 ATOM 253 C GLN 32 -3.106 -0.629 63.081 1.00 0.00 ATOM 254 N GLY 33 -1.924 -1.128 62.705 1.00 0.00 ATOM 255 CA GLY 33 -1.617 -2.551 62.740 1.00 0.00 ATOM 256 O GLY 33 -2.127 -4.132 64.431 1.00 0.00 ATOM 257 C GLY 33 -1.466 -3.149 64.118 1.00 0.00 ATOM 258 N ILE 34 -0.603 -2.538 64.931 1.00 0.00 ATOM 259 CA ILE 34 -0.330 -2.949 66.315 1.00 0.00 ATOM 260 CB ILE 34 0.785 -2.050 66.968 1.00 0.00 ATOM 261 CG1 ILE 34 2.137 -2.250 66.266 1.00 0.00 ATOM 262 CG2 ILE 34 0.916 -2.324 68.478 1.00 0.00 ATOM 263 CD1 ILE 34 2.872 -3.532 66.619 1.00 0.00 ATOM 264 O ILE 34 -1.863 -3.723 67.991 1.00 0.00 ATOM 265 C ILE 34 -1.601 -2.849 67.165 1.00 0.00 ATOM 266 N ARG 35 -2.383 -1.791 66.945 1.00 0.00 ATOM 267 CA ARG 35 -3.621 -1.574 67.684 1.00 0.00 ATOM 268 CB ARG 35 -4.165 -0.166 67.454 1.00 0.00 ATOM 269 CG ARG 35 -3.322 0.913 68.115 1.00 0.00 ATOM 270 CD ARG 35 -3.962 2.276 68.004 1.00 0.00 ATOM 271 NE ARG 35 -4.872 2.547 69.114 1.00 0.00 ATOM 272 CZ ARG 35 -6.199 2.614 69.012 1.00 0.00 ATOM 273 NH1 ARG 35 -6.801 2.423 67.839 1.00 0.00 ATOM 274 NH2 ARG 35 -6.926 2.888 70.087 1.00 0.00 ATOM 275 O ARG 35 -5.457 -2.965 68.343 1.00 0.00 ATOM 276 C ARG 35 -4.697 -2.627 67.435 1.00 0.00 ATOM 277 N GLN 36 -4.711 -3.181 66.224 1.00 0.00 ATOM 278 CA GLN 36 -5.654 -4.228 65.840 1.00 0.00 ATOM 279 CB GLN 36 -5.679 -4.384 64.326 1.00 0.00 ATOM 280 CG GLN 36 -6.632 -3.431 63.636 1.00 0.00 ATOM 281 CD GLN 36 -6.478 -3.421 62.124 1.00 0.00 ATOM 282 OE1 GLN 36 -6.691 -2.385 61.482 1.00 0.00 ATOM 283 NE2 GLN 36 -6.111 -4.570 61.546 1.00 0.00 ATOM 284 O GLN 36 -6.113 -6.442 66.619 1.00 0.00 ATOM 285 C GLN 36 -5.273 -5.557 66.475 1.00 0.00 ATOM 286 N PHE 37 -4.003 -5.668 66.861 1.00 0.00 ATOM 287 CA PHE 37 -3.444 -6.864 67.492 1.00 0.00 ATOM 288 CB PHE 37 -1.929 -6.962 67.217 1.00 0.00 ATOM 289 CG PHE 37 -1.262 -8.176 67.817 1.00 0.00 ATOM 290 CD1 PHE 37 -0.573 -8.088 69.040 1.00 0.00 ATOM 291 CD2 PHE 37 -1.361 -9.421 67.191 1.00 0.00 ATOM 292 CE1 PHE 37 0.020 -9.223 69.622 1.00 0.00 ATOM 293 CE2 PHE 37 -0.770 -10.576 67.758 1.00 0.00 ATOM 294 CZ PHE 37 -0.085 -10.477 68.982 1.00 0.00 ATOM 295 O PHE 37 -3.869 -7.951 69.571 1.00 0.00 ATOM 296 C PHE 37 -3.689 -6.879 68.999 1.00 0.00 ATOM 297 N LEU 38 -3.703 -5.694 69.624 1.00 0.00 ATOM 298 CA LEU 38 -3.905 -5.548 71.069 1.00 0.00 ATOM 299 CB LEU 38 -4.001 -4.070 71.457 1.00 0.00 ATOM 300 CG LEU 38 -2.772 -3.292 71.950 1.00 0.00 ATOM 301 CD1 LEU 38 -1.475 -3.977 71.673 1.00 0.00 ATOM 302 CD2 LEU 38 -2.773 -1.922 71.337 1.00 0.00 ATOM 303 O LEU 38 -4.728 -7.026 72.767 1.00 0.00 ATOM 304 C LEU 38 -4.996 -6.426 71.721 1.00 0.00 ATOM 305 N PRO 39 -6.201 -6.572 71.092 1.00 0.00 ATOM 306 CA PRO 39 -7.213 -7.434 71.724 1.00 0.00 ATOM 307 CB PRO 39 -8.400 -7.303 70.782 1.00 0.00 ATOM 308 CG PRO 39 -8.291 -5.935 70.284 1.00 0.00 ATOM 309 CD PRO 39 -6.830 -5.798 69.996 1.00 0.00 ATOM 310 O PRO 39 -7.280 -9.609 72.768 1.00 0.00 ATOM 311 C PRO 39 -6.777 -8.920 71.880 1.00 0.00 ATOM 312 N SER 40 -5.812 -9.378 71.061 1.00 0.00 ATOM 313 CA SER 40 -5.251 -10.754 71.102 1.00 0.00 ATOM 314 CB SER 40 -4.044 -10.894 70.151 1.00 0.00 ATOM 315 OG SER 40 -4.370 -11.438 68.887 1.00 0.00 ATOM 316 O SER 40 -4.798 -12.178 72.988 1.00 0.00 ATOM 317 C SER 40 -4.709 -11.053 72.494 1.00 0.00 ATOM 318 N LEU 41 -4.139 -10.008 73.093 1.00 0.00 ATOM 319 CA LEU 41 -3.512 -10.020 74.414 1.00 0.00 ATOM 320 CB LEU 41 -2.804 -8.681 74.631 1.00 0.00 ATOM 321 CG LEU 41 -1.341 -8.409 74.296 1.00 0.00 ATOM 322 CD1 LEU 41 -0.788 -9.308 73.229 1.00 0.00 ATOM 323 CD2 LEU 41 -1.203 -6.950 73.935 1.00 0.00 ATOM 324 O LEU 41 -3.954 -10.839 76.609 1.00 0.00 ATOM 325 C LEU 41 -4.390 -10.245 75.630 1.00 0.00 ATOM 326 N PHE 42 -5.606 -9.720 75.571 1.00 0.00 ATOM 327 CA PHE 42 -6.537 -9.766 76.695 1.00 0.00 ATOM 328 CB PHE 42 -7.125 -8.362 76.914 1.00 0.00 ATOM 329 CG PHE 42 -6.105 -7.279 76.954 1.00 0.00 ATOM 330 CD1 PHE 42 -5.072 -7.305 77.895 1.00 0.00 ATOM 331 CD2 PHE 42 -6.128 -6.259 75.997 1.00 0.00 ATOM 332 CE1 PHE 42 -4.068 -6.337 77.892 1.00 0.00 ATOM 333 CE2 PHE 42 -5.126 -5.266 75.972 1.00 0.00 ATOM 334 CZ PHE 42 -4.086 -5.307 76.921 1.00 0.00 ATOM 335 O PHE 42 -7.885 -11.411 75.592 1.00 0.00 ATOM 336 C PHE 42 -7.684 -10.755 76.620 1.00 0.00 ATOM 337 N VAL 43 -8.465 -10.792 77.711 1.00 0.00 ATOM 338 CA VAL 43 -9.650 -11.635 77.850 1.00 0.00 ATOM 339 CB VAL 43 -10.262 -11.540 79.276 1.00 0.00 ATOM 340 CG1 VAL 43 -11.679 -12.096 79.339 1.00 0.00 ATOM 341 CG2 VAL 43 -9.390 -12.327 80.242 1.00 0.00 ATOM 342 O VAL 43 -10.762 -10.205 76.222 1.00 0.00 ATOM 343 C VAL 43 -10.622 -11.335 76.707 1.00 0.00 ATOM 344 N ASP 44 -11.265 -12.410 76.299 1.00 0.00 ATOM 345 CA ASP 44 -12.118 -12.487 75.140 1.00 0.00 ATOM 346 CB ASP 44 -11.443 -13.628 74.358 1.00 0.00 ATOM 347 CG ASP 44 -11.872 -13.755 72.926 1.00 0.00 ATOM 348 OD1 ASP 44 -12.696 -12.962 72.423 1.00 0.00 ATOM 349 OD2 ASP 44 -11.347 -14.700 72.295 1.00 0.00 ATOM 350 O ASP 44 -14.502 -12.125 74.983 1.00 0.00 ATOM 351 C ASP 44 -13.586 -12.820 75.431 1.00 0.00 ATOM 352 N ASN 45 -13.759 -13.918 76.164 1.00 0.00 ATOM 353 CA ASN 45 -15.033 -14.540 76.537 1.00 0.00 ATOM 354 CB ASN 45 -14.761 -16.035 76.775 1.00 0.00 ATOM 355 CG ASN 45 -13.684 -16.288 77.853 1.00 0.00 ATOM 356 ND2 ASN 45 -13.366 -17.560 78.082 1.00 0.00 ATOM 357 OD1 ASN 45 -13.154 -15.353 78.464 1.00 0.00 ATOM 358 O ASN 45 -16.951 -14.582 77.982 1.00 0.00 ATOM 359 C ASN 45 -15.896 -14.007 77.691 1.00 0.00 ATOM 360 N ASP 46 -15.432 -12.971 78.379 1.00 0.00 ATOM 361 CA ASP 46 -16.168 -12.382 79.508 1.00 0.00 ATOM 362 CB ASP 46 -15.284 -12.449 80.775 1.00 0.00 ATOM 363 CG ASP 46 -15.928 -11.819 82.023 1.00 0.00 ATOM 364 OD1 ASP 46 -16.768 -10.897 81.922 1.00 0.00 ATOM 365 OD2 ASP 46 -15.524 -12.212 83.137 1.00 0.00 ATOM 366 O ASP 46 -15.595 -10.167 78.830 1.00 0.00 ATOM 367 C ASP 46 -16.499 -10.943 79.124 1.00 0.00 ATOM 368 N GLU 47 -17.777 -10.568 79.197 1.00 0.00 ATOM 369 CA GLU 47 -18.159 -9.209 78.816 1.00 0.00 ATOM 370 CB GLU 47 -19.486 -9.162 78.050 1.00 0.00 ATOM 371 CG GLU 47 -19.409 -8.163 76.878 1.00 0.00 ATOM 372 CD GLU 47 -20.753 -7.650 76.420 1.00 0.00 ATOM 373 OE1 GLU 47 -21.293 -6.709 77.053 1.00 0.00 ATOM 374 OE2 GLU 47 -21.261 -8.181 75.410 1.00 0.00 ATOM 375 O GLU 47 -18.295 -6.920 79.492 1.00 0.00 ATOM 376 C GLU 47 -18.093 -8.084 79.848 1.00 0.00 ATOM 377 N GLU 48 -17.819 -8.403 81.113 1.00 0.00 ATOM 378 CA GLU 48 -17.680 -7.341 82.112 1.00 0.00 ATOM 379 CB GLU 48 -17.899 -7.854 83.539 1.00 0.00 ATOM 380 CG GLU 48 -18.810 -6.943 84.376 1.00 0.00 ATOM 381 CD GLU 48 -20.014 -7.674 84.961 1.00 0.00 ATOM 382 OE1 GLU 48 -21.162 -7.377 84.555 1.00 0.00 ATOM 383 OE2 GLU 48 -19.812 -8.544 85.835 1.00 0.00 ATOM 384 O GLU 48 -16.055 -5.604 81.752 1.00 0.00 ATOM 385 C GLU 48 -16.258 -6.816 81.909 1.00 0.00 ATOM 386 N ILE 49 -15.328 -7.764 81.728 1.00 0.00 ATOM 387 CA ILE 49 -13.912 -7.485 81.478 1.00 0.00 ATOM 388 CB ILE 49 -13.052 -8.790 81.452 1.00 0.00 ATOM 389 CG1 ILE 49 -13.176 -9.537 82.785 1.00 0.00 ATOM 390 CG2 ILE 49 -11.594 -8.454 81.175 1.00 0.00 ATOM 391 CD1 ILE 49 -12.273 -10.770 82.991 1.00 0.00 ATOM 392 O ILE 49 -12.987 -5.721 80.135 1.00 0.00 ATOM 393 C ILE 49 -13.709 -6.714 80.158 1.00 0.00 ATOM 394 N VAL 50 -14.373 -7.143 79.083 1.00 0.00 ATOM 395 CA VAL 50 -14.234 -6.479 77.783 1.00 0.00 ATOM 396 CB VAL 50 -14.914 -7.273 76.609 1.00 0.00 ATOM 397 CG1 VAL 50 -14.807 -6.496 75.286 1.00 0.00 ATOM 398 CG2 VAL 50 -14.261 -8.630 76.436 1.00 0.00 ATOM 399 O VAL 50 -14.049 -4.121 77.410 1.00 0.00 ATOM 400 C VAL 50 -14.756 -5.051 77.795 1.00 0.00 ATOM 401 N GLU 51 -15.970 -4.893 78.306 1.00 0.00 ATOM 402 CA GLU 51 -16.640 -3.602 78.357 1.00 0.00 ATOM 403 CB GLU 51 -18.141 -3.820 78.599 1.00 0.00 ATOM 404 CG GLU 51 -19.069 -2.818 77.905 1.00 0.00 ATOM 405 CD GLU 51 -18.937 -2.819 76.383 1.00 0.00 ATOM 406 OE1 GLU 51 -18.849 -3.912 75.770 1.00 0.00 ATOM 407 OE2 GLU 51 -18.919 -1.712 75.803 1.00 0.00 ATOM 408 O GLU 51 -16.152 -1.377 79.110 1.00 0.00 ATOM 409 C GLU 51 -16.087 -2.585 79.354 1.00 0.00 ATOM 410 N TYR 52 -15.535 -3.065 80.466 1.00 0.00 ATOM 411 CA TYR 52 -15.029 -2.159 81.489 1.00 0.00 ATOM 412 CB TYR 52 -15.829 -2.354 82.791 1.00 0.00 ATOM 413 CG TYR 52 -17.303 -2.000 82.610 1.00 0.00 ATOM 414 CD1 TYR 52 -18.314 -2.981 82.737 1.00 0.00 ATOM 415 CD2 TYR 52 -17.687 -0.695 82.204 1.00 0.00 ATOM 416 CE1 TYR 52 -19.686 -2.671 82.448 1.00 0.00 ATOM 417 CE2 TYR 52 -19.042 -0.372 81.912 1.00 0.00 ATOM 418 CZ TYR 52 -20.037 -1.362 82.036 1.00 0.00 ATOM 419 OH TYR 52 -21.352 -1.039 81.749 1.00 0.00 ATOM 420 O TYR 52 -13.013 -1.158 82.319 1.00 0.00 ATOM 421 C TYR 52 -13.519 -2.112 81.717 1.00 0.00 ATOM 422 N ALA 53 -12.796 -3.094 81.178 1.00 0.00 ATOM 423 CA ALA 53 -11.347 -3.132 81.324 1.00 0.00 ATOM 424 CB ALA 53 -10.904 -4.395 82.052 1.00 0.00 ATOM 425 O ALA 53 -9.757 -2.092 79.870 1.00 0.00 ATOM 426 C ALA 53 -10.607 -2.972 79.994 1.00 0.00 ATOM 427 N VAL 54 -10.999 -3.756 78.985 1.00 0.00 ATOM 428 CA VAL 54 -10.363 -3.739 77.655 1.00 0.00 ATOM 429 CB VAL 54 -10.696 -5.035 76.843 1.00 0.00 ATOM 430 CG1 VAL 54 -10.010 -5.057 75.487 1.00 0.00 ATOM 431 CG2 VAL 54 -10.290 -6.252 77.622 1.00 0.00 ATOM 432 O VAL 54 -9.724 -1.890 76.284 1.00 0.00 ATOM 433 C VAL 54 -10.651 -2.486 76.819 1.00 0.00 ATOM 434 N LYS 55 -11.918 -2.085 76.729 1.00 0.00 ATOM 435 CA LYS 55 -12.312 -0.901 75.964 1.00 0.00 ATOM 436 CB LYS 55 -13.831 -0.746 75.952 1.00 0.00 ATOM 437 CG LYS 55 -14.534 -1.215 74.707 1.00 0.00 ATOM 438 CD LYS 55 -15.912 -0.558 74.634 1.00 0.00 ATOM 439 CE LYS 55 -15.864 0.971 74.895 1.00 0.00 ATOM 440 NZ LYS 55 -17.194 1.630 74.859 1.00 0.00 ATOM 441 O LYS 55 -11.030 1.070 75.535 1.00 0.00 ATOM 442 C LYS 55 -11.625 0.416 76.384 1.00 0.00 ATOM 443 N PRO 56 -11.673 0.815 77.684 1.00 0.00 ATOM 444 CA PRO 56 -10.991 2.076 78.035 1.00 0.00 ATOM 445 CB PRO 56 -11.500 2.355 79.447 1.00 0.00 ATOM 446 CG PRO 56 -11.805 1.000 79.974 1.00 0.00 ATOM 447 CD PRO 56 -12.452 0.324 78.843 1.00 0.00 ATOM 448 O PRO 56 -8.761 3.015 77.982 1.00 0.00 ATOM 449 C PRO 56 -9.454 1.992 77.973 1.00 0.00 ATOM 450 N LEU 57 -8.950 0.761 77.885 1.00 0.00 ATOM 451 CA LEU 57 -7.520 0.478 77.791 1.00 0.00 ATOM 452 CB LEU 57 -7.277 -0.958 78.231 1.00 0.00 ATOM 453 CG LEU 57 -6.087 -1.460 79.040 1.00 0.00 ATOM 454 CD1 LEU 57 -5.616 -0.466 80.095 1.00 0.00 ATOM 455 CD2 LEU 57 -6.533 -2.757 79.688 1.00 0.00 ATOM 456 O LEU 57 -5.973 1.061 76.049 1.00 0.00 ATOM 457 C LEU 57 -7.095 0.653 76.330 1.00 0.00 ATOM 458 N LEU 58 -8.021 0.357 75.415 1.00 0.00 ATOM 459 CA LEU 58 -7.797 0.458 73.972 1.00 0.00 ATOM 460 CB LEU 58 -8.209 -0.840 73.274 1.00 0.00 ATOM 461 CG LEU 58 -7.516 -2.120 73.722 1.00 0.00 ATOM 462 CD1 LEU 58 -7.914 -3.240 72.817 1.00 0.00 ATOM 463 CD2 LEU 58 -6.033 -1.948 73.703 1.00 0.00 ATOM 464 O LEU 58 -8.720 1.666 72.113 1.00 0.00 ATOM 465 C LEU 58 -8.557 1.609 73.341 1.00 0.00 ATOM 466 N ALA 59 -9.030 2.525 74.184 1.00 0.00 ATOM 467 CA ALA 59 -9.771 3.688 73.714 1.00 0.00 ATOM 468 CB ALA 59 -10.394 4.450 74.881 1.00 0.00 ATOM 469 O ALA 59 -7.600 4.541 73.176 1.00 0.00 ATOM 470 C ALA 59 -8.814 4.583 72.973 1.00 0.00 ATOM 471 N GLN 60 -9.378 5.348 72.057 1.00 0.00 ATOM 472 CA GLN 60 -8.632 6.294 71.270 1.00 0.00 ATOM 473 CB GLN 60 -9.572 6.845 70.204 1.00 0.00 ATOM 474 CG GLN 60 -9.315 8.264 69.738 1.00 0.00 ATOM 475 CD GLN 60 -9.600 8.459 68.273 1.00 0.00 ATOM 476 OE1 GLN 60 -8.974 9.282 67.628 1.00 0.00 ATOM 477 NE2 GLN 60 -10.531 7.693 67.734 1.00 0.00 ATOM 478 O GLN 60 -8.880 7.794 73.118 1.00 0.00 ATOM 479 C GLN 60 -8.136 7.365 72.236 1.00 0.00 ATOM 480 N SER 61 -6.852 7.702 72.114 1.00 0.00 ATOM 481 CA SER 61 -6.151 8.684 72.964 1.00 0.00 ATOM 482 CB SER 61 -6.888 10.031 73.060 1.00 0.00 ATOM 483 OG SER 61 -6.636 10.837 71.928 1.00 0.00 ATOM 484 O SER 61 -5.355 8.903 75.227 1.00 0.00 ATOM 485 C SER 61 -5.840 8.159 74.364 1.00 0.00 ATOM 486 N GLY 62 -6.088 6.865 74.562 1.00 0.00 ATOM 487 CA GLY 62 -5.838 6.221 75.843 1.00 0.00 ATOM 488 O GLY 62 -3.550 5.989 75.201 1.00 0.00 ATOM 489 C GLY 62 -4.404 5.753 76.060 1.00 0.00 ATOM 490 N PRO 63 -4.121 5.046 77.181 1.00 0.00 ATOM 491 CA PRO 63 -2.788 4.533 77.530 1.00 0.00 ATOM 492 CB PRO 63 -3.047 3.751 78.822 1.00 0.00 ATOM 493 CG PRO 63 -4.514 3.437 78.763 1.00 0.00 ATOM 494 CD PRO 63 -5.082 4.703 78.233 1.00 0.00 ATOM 495 O PRO 63 -0.818 3.793 76.461 1.00 0.00 ATOM 496 C PRO 63 -2.032 3.713 76.499 1.00 0.00 ATOM 497 N LEU 64 -2.743 2.979 75.639 1.00 0.00 ATOM 498 CA LEU 64 -2.100 2.168 74.601 1.00 0.00 ATOM 499 CB LEU 64 -2.663 0.739 74.604 1.00 0.00 ATOM 500 CG LEU 64 -2.639 -0.045 75.920 1.00 0.00 ATOM 501 CD1 LEU 64 -3.259 -1.384 75.694 1.00 0.00 ATOM 502 CD2 LEU 64 -1.225 -0.226 76.460 1.00 0.00 ATOM 503 O LEU 64 -1.711 2.085 72.223 1.00 0.00 ATOM 504 C LEU 64 -2.126 2.753 73.176 1.00 0.00 ATOM 505 N ASP 65 -2.588 3.999 73.030 1.00 0.00 ATOM 506 CA ASP 65 -2.643 4.649 71.718 1.00 0.00 ATOM 507 CB ASP 65 -3.821 5.627 71.630 1.00 0.00 ATOM 508 CG ASP 65 -4.189 6.001 70.181 1.00 0.00 ATOM 509 OD1 ASP 65 -3.558 5.500 69.217 1.00 0.00 ATOM 510 OD2 ASP 65 -5.126 6.810 70.010 1.00 0.00 ATOM 511 O ASP 65 -1.244 6.544 71.129 1.00 0.00 ATOM 512 C ASP 65 -1.318 5.350 71.449 1.00 0.00 ATOM 513 N ASP 66 -0.271 4.561 71.606 1.00 0.00 ATOM 514 CA ASP 66 1.090 4.981 71.403 1.00 0.00 ATOM 515 CB ASP 66 1.675 5.490 72.712 1.00 0.00 ATOM 516 CG ASP 66 3.009 6.160 72.525 1.00 0.00 ATOM 517 OD1 ASP 66 4.026 5.571 72.932 1.00 0.00 ATOM 518 OD2 ASP 66 3.043 7.272 71.957 1.00 0.00 ATOM 519 O ASP 66 1.686 2.692 71.658 1.00 0.00 ATOM 520 C ASP 66 1.779 3.707 70.972 1.00 0.00 ATOM 521 N ILE 67 2.438 3.761 69.819 1.00 0.00 ATOM 522 CA ILE 67 3.150 2.615 69.252 1.00 0.00 ATOM 523 CB ILE 67 3.660 2.932 67.806 1.00 0.00 ATOM 524 CG1 ILE 67 4.298 1.702 67.166 1.00 0.00 ATOM 525 CG2 ILE 67 4.578 4.151 67.807 1.00 0.00 ATOM 526 CD1 ILE 67 4.526 1.837 65.690 1.00 0.00 ATOM 527 O ILE 67 4.494 0.934 70.300 1.00 0.00 ATOM 528 C ILE 67 4.281 2.135 70.161 1.00 0.00 ATOM 529 N ASP 68 4.912 3.077 70.860 1.00 0.00 ATOM 530 CA ASP 68 6.008 2.745 71.754 1.00 0.00 ATOM 531 CB ASP 68 6.907 3.964 71.991 1.00 0.00 ATOM 532 CG ASP 68 7.615 4.439 70.704 1.00 0.00 ATOM 533 OD1 ASP 68 7.441 3.804 69.645 1.00 0.00 ATOM 534 OD2 ASP 68 8.349 5.455 70.752 1.00 0.00 ATOM 535 O ASP 68 6.262 1.114 73.472 1.00 0.00 ATOM 536 C ASP 68 5.579 2.042 73.049 1.00 0.00 ATOM 537 N VAL 69 4.432 2.409 73.638 1.00 0.00 ATOM 538 CA VAL 69 3.987 1.709 74.847 1.00 0.00 ATOM 539 CB VAL 69 3.168 2.589 75.885 1.00 0.00 ATOM 540 CG1 VAL 69 3.454 4.053 75.741 1.00 0.00 ATOM 541 CG2 VAL 69 1.699 2.312 75.845 1.00 0.00 ATOM 542 O VAL 69 3.331 -0.589 75.192 1.00 0.00 ATOM 543 C VAL 69 3.245 0.411 74.470 1.00 0.00 ATOM 544 N ALA 70 2.568 0.417 73.321 1.00 0.00 ATOM 545 CA ALA 70 1.832 -0.758 72.848 1.00 0.00 ATOM 546 CB ALA 70 0.952 -0.400 71.670 1.00 0.00 ATOM 547 O ALA 70 2.550 -3.059 72.767 1.00 0.00 ATOM 548 C ALA 70 2.802 -1.885 72.474 1.00 0.00 ATOM 549 N LEU 71 3.938 -1.498 71.891 1.00 0.00 ATOM 550 CA LEU 71 4.985 -2.431 71.493 1.00 0.00 ATOM 551 CB LEU 71 6.092 -1.712 70.741 1.00 0.00 ATOM 552 CG LEU 71 6.107 -1.798 69.229 1.00 0.00 ATOM 553 CD1 LEU 71 7.202 -0.853 68.767 1.00 0.00 ATOM 554 CD2 LEU 71 6.350 -3.233 68.753 1.00 0.00 ATOM 555 O LEU 71 5.766 -4.265 72.793 1.00 0.00 ATOM 556 C LEU 71 5.607 -3.048 72.715 1.00 0.00 ATOM 557 N ARG 72 5.926 -2.187 73.680 1.00 0.00 ATOM 558 CA ARG 72 6.534 -2.616 74.926 1.00 0.00 ATOM 559 CB ARG 72 6.966 -1.420 75.758 1.00 0.00 ATOM 560 CG ARG 72 8.153 -0.739 75.127 1.00 0.00 ATOM 561 CD ARG 72 8.808 0.239 76.046 1.00 0.00 ATOM 562 NE ARG 72 8.265 1.591 75.981 1.00 0.00 ATOM 563 CZ ARG 72 8.933 2.646 75.519 1.00 0.00 ATOM 564 NH1 ARG 72 10.175 2.519 75.071 1.00 0.00 ATOM 565 NH2 ARG 72 8.361 3.838 75.521 1.00 0.00 ATOM 566 O ARG 72 6.166 -4.528 76.266 1.00 0.00 ATOM 567 C ARG 72 5.657 -3.572 75.709 1.00 0.00 ATOM 568 N LEU 73 4.338 -3.385 75.599 1.00 0.00 ATOM 569 CA LEU 73 3.355 -4.228 76.269 1.00 0.00 ATOM 570 CB LEU 73 1.954 -3.601 76.186 1.00 0.00 ATOM 571 CG LEU 73 0.882 -3.746 77.286 1.00 0.00 ATOM 572 CD1 LEU 73 -0.402 -4.268 76.682 1.00 0.00 ATOM 573 CD2 LEU 73 1.299 -4.608 78.464 1.00 0.00 ATOM 574 O LEU 73 3.454 -6.617 76.405 1.00 0.00 ATOM 575 C LEU 73 3.349 -5.639 75.663 1.00 0.00 ATOM 576 N ILE 74 3.292 -5.726 74.330 1.00 0.00 ATOM 577 CA ILE 74 3.285 -7.006 73.604 1.00 0.00 ATOM 578 CB ILE 74 3.118 -6.801 72.073 1.00 0.00 ATOM 579 CG1 ILE 74 1.814 -6.063 71.787 1.00 0.00 ATOM 580 CG2 ILE 74 3.092 -8.152 71.338 1.00 0.00 ATOM 581 CD1 ILE 74 1.639 -5.622 70.352 1.00 0.00 ATOM 582 O ILE 74 4.587 -8.943 74.195 1.00 0.00 ATOM 583 C ILE 74 4.593 -7.747 73.878 1.00 0.00 ATOM 584 N TYR 75 5.696 -7.001 73.830 1.00 0.00 ATOM 585 CA TYR 75 7.019 -7.553 74.084 1.00 0.00 ATOM 586 CB TYR 75 8.106 -6.534 73.736 1.00 0.00 ATOM 587 CG TYR 75 9.480 -7.129 73.485 1.00 0.00 ATOM 588 CD1 TYR 75 9.630 -8.320 72.748 1.00 0.00 ATOM 589 CD2 TYR 75 10.639 -6.482 73.944 1.00 0.00 ATOM 590 CE1 TYR 75 10.906 -8.857 72.470 1.00 0.00 ATOM 591 CE2 TYR 75 11.926 -6.999 73.665 1.00 0.00 ATOM 592 CZ TYR 75 12.049 -8.190 72.929 1.00 0.00 ATOM 593 OH TYR 75 13.291 -8.716 72.668 1.00 0.00 ATOM 594 O TYR 75 7.669 -9.072 75.792 1.00 0.00 ATOM 595 C TYR 75 7.167 -7.985 75.539 1.00 0.00 ATOM 596 N ALA 76 6.702 -7.143 76.470 1.00 0.00 ATOM 597 CA ALA 76 6.765 -7.406 77.917 1.00 0.00 ATOM 598 CB ALA 76 6.292 -6.214 78.706 1.00 0.00 ATOM 599 O ALA 76 6.414 -9.413 79.160 1.00 0.00 ATOM 600 C ALA 76 5.986 -8.660 78.295 1.00 0.00 ATOM 601 N LEU 77 4.862 -8.903 77.615 1.00 0.00 ATOM 602 CA LEU 77 4.100 -10.138 77.810 1.00 0.00 ATOM 603 CB LEU 77 2.648 -9.958 77.320 1.00 0.00 ATOM 604 CG LEU 77 1.775 -8.936 78.094 1.00 0.00 ATOM 605 CD1 LEU 77 0.485 -8.628 77.399 1.00 0.00 ATOM 606 CD2 LEU 77 1.469 -9.424 79.493 1.00 0.00 ATOM 607 O LEU 77 6.029 -10.807 76.518 1.00 0.00 ATOM 608 C LEU 77 4.920 -11.141 76.944 1.00 0.00 ATOM 609 N GLY 78 4.465 -12.356 76.684 1.00 0.00 ATOM 610 CA GLY 78 5.326 -13.210 75.861 1.00 0.00 ATOM 611 O GLY 78 5.070 -14.405 73.810 1.00 0.00 ATOM 612 C GLY 78 4.890 -13.337 74.410 1.00 0.00 ATOM 613 N LYS 79 4.397 -12.242 73.819 1.00 0.00 ATOM 614 CA LYS 79 3.841 -12.299 72.464 1.00 0.00 ATOM 615 CB LYS 79 2.364 -11.835 72.518 1.00 0.00 ATOM 616 CG LYS 79 1.523 -12.280 73.771 1.00 0.00 ATOM 617 CD LYS 79 1.253 -13.795 73.877 1.00 0.00 ATOM 618 CE LYS 79 0.562 -14.187 75.200 1.00 0.00 ATOM 619 NZ LYS 79 -0.914 -13.891 75.244 1.00 0.00 ATOM 620 O LYS 79 3.958 -11.589 70.147 1.00 0.00 ATOM 621 C LYS 79 4.569 -11.709 71.221 1.00 0.00 ATOM 622 N MET 80 5.865 -11.403 71.337 1.00 0.00 ATOM 623 CA MET 80 6.635 -10.862 70.208 1.00 0.00 ATOM 624 CB MET 80 6.562 -9.326 70.171 1.00 0.00 ATOM 625 CG MET 80 7.198 -8.702 68.928 1.00 0.00 ATOM 626 SD MET 80 6.789 -6.848 68.632 1.00 0.00 ATOM 627 CE MET 80 4.934 -7.005 68.153 1.00 0.00 ATOM 628 O MET 80 8.807 -11.131 71.205 1.00 0.00 ATOM 629 C MET 80 8.100 -11.298 70.207 1.00 0.00 ATOM 630 N ASP 81 8.557 -11.813 69.063 1.00 0.00 ATOM 631 CA ASP 81 9.948 -12.245 68.886 1.00 0.00 ATOM 632 CB ASP 81 10.112 -13.009 67.550 1.00 0.00 ATOM 633 CG ASP 81 9.204 -14.225 67.434 1.00 0.00 ATOM 634 OD1 ASP 81 9.399 -15.200 68.192 1.00 0.00 ATOM 635 OD2 ASP 81 8.316 -14.216 66.551 1.00 0.00 ATOM 636 O ASP 81 10.357 -9.926 68.392 1.00 0.00 ATOM 637 C ASP 81 10.799 -10.980 68.807 1.00 0.00 ATOM 638 N LYS 82 11.997 -11.065 69.299 1.00 0.00 ATOM 639 CA LYS 82 12.828 -10.000 69.167 1.00 0.00 ATOM 640 CB LYS 82 14.052 -10.440 69.762 1.00 0.00 ATOM 641 CG LYS 82 15.172 -9.520 69.514 1.00 0.00 ATOM 642 CD LYS 82 16.273 -9.367 70.546 1.00 0.00 ATOM 643 CE LYS 82 17.539 -10.193 70.389 1.00 0.00 ATOM 644 NZ LYS 82 18.848 -9.572 70.360 1.00 0.00 ATOM 645 O LYS 82 13.508 -8.367 67.929 1.00 0.00 ATOM 646 C LYS 82 13.133 -9.394 67.871 1.00 0.00 ATOM 647 N TRP 83 13.265 -10.090 66.770 1.00 0.00 ATOM 648 CA TRP 83 13.502 -9.489 65.443 1.00 0.00 ATOM 649 CB TRP 83 13.672 -10.597 64.360 1.00 0.00 ATOM 650 CG TRP 83 12.437 -11.393 63.942 1.00 0.00 ATOM 651 CD1 TRP 83 11.999 -12.565 64.490 1.00 0.00 ATOM 652 CD2 TRP 83 11.502 -11.073 62.886 1.00 0.00 ATOM 653 CE2 TRP 83 10.530 -12.118 62.872 1.00 0.00 ATOM 654 CE3 TRP 83 11.398 -10.016 61.960 1.00 0.00 ATOM 655 NE1 TRP 83 10.854 -13.002 63.852 1.00 0.00 ATOM 656 CZ2 TRP 83 9.447 -12.118 61.959 1.00 0.00 ATOM 657 CZ3 TRP 83 10.312 -10.018 61.048 1.00 0.00 ATOM 658 CH2 TRP 83 9.357 -11.072 61.056 1.00 0.00 ATOM 659 O TRP 83 12.699 -7.380 64.616 1.00 0.00 ATOM 660 C TRP 83 12.401 -8.499 65.045 1.00 0.00 ATOM 661 N LEU 84 11.149 -8.915 65.260 1.00 0.00 ATOM 662 CA LEU 84 9.956 -8.122 64.955 1.00 0.00 ATOM 663 CB LEU 84 8.683 -8.970 65.105 1.00 0.00 ATOM 664 CG LEU 84 7.339 -8.299 64.792 1.00 0.00 ATOM 665 CD1 LEU 84 7.324 -7.745 63.381 1.00 0.00 ATOM 666 CD2 LEU 84 6.231 -9.286 64.983 1.00 0.00 ATOM 667 O LEU 84 9.509 -5.800 65.337 1.00 0.00 ATOM 668 C LEU 84 9.874 -6.879 65.828 1.00 0.00 ATOM 669 N TYR 85 10.235 -7.039 67.106 1.00 0.00 ATOM 670 CA TYR 85 10.241 -5.933 68.041 1.00 0.00 ATOM 671 CB TYR 85 10.592 -6.395 69.462 1.00 0.00 ATOM 672 CG TYR 85 10.808 -5.263 70.452 1.00 0.00 ATOM 673 CD1 TYR 85 12.113 -4.864 70.811 1.00 0.00 ATOM 674 CD2 TYR 85 9.723 -4.572 71.022 1.00 0.00 ATOM 675 CE1 TYR 85 12.337 -3.808 71.709 1.00 0.00 ATOM 676 CE2 TYR 85 9.938 -3.497 71.944 1.00 0.00 ATOM 677 CZ TYR 85 11.249 -3.132 72.273 1.00 0.00 ATOM 678 OH TYR 85 11.494 -2.110 73.154 1.00 0.00 ATOM 679 O TYR 85 10.872 -3.773 67.280 1.00 0.00 ATOM 680 C TYR 85 11.242 -4.918 67.517 1.00 0.00 ATOM 681 N ALA 86 12.457 -5.382 67.224 1.00 0.00 ATOM 682 CA ALA 86 13.527 -4.527 66.708 1.00 0.00 ATOM 683 CB ALA 86 14.786 -5.329 66.521 1.00 0.00 ATOM 684 O ALA 86 13.454 -2.606 65.267 1.00 0.00 ATOM 685 C ALA 86 13.161 -3.797 65.407 1.00 0.00 ATOM 686 N ASP 87 12.453 -4.478 64.504 1.00 0.00 ATOM 687 CA ASP 87 12.055 -3.867 63.238 1.00 0.00 ATOM 688 CB ASP 87 11.427 -4.890 62.280 1.00 0.00 ATOM 689 CG ASP 87 12.463 -5.657 61.474 1.00 0.00 ATOM 690 OD1 ASP 87 13.671 -5.533 61.776 1.00 0.00 ATOM 691 OD2 ASP 87 12.073 -6.392 60.535 1.00 0.00 ATOM 692 O ASP 87 11.418 -1.584 62.969 1.00 0.00 ATOM 693 C ASP 87 11.115 -2.688 63.424 1.00 0.00 ATOM 694 N ILE 88 10.043 -2.904 64.189 1.00 0.00 ATOM 695 CA ILE 88 9.048 -1.870 64.427 1.00 0.00 ATOM 696 CB ILE 88 7.787 -2.418 65.127 1.00 0.00 ATOM 697 CG1 ILE 88 7.281 -3.652 64.381 1.00 0.00 ATOM 698 CG2 ILE 88 6.673 -1.340 65.145 1.00 0.00 ATOM 699 CD1 ILE 88 6.003 -4.267 64.933 1.00 0.00 ATOM 700 O ILE 88 9.303 0.472 64.766 1.00 0.00 ATOM 701 C ILE 88 9.599 -0.656 65.171 1.00 0.00 ATOM 702 N THR 89 10.452 -0.872 66.184 1.00 0.00 ATOM 703 CA THR 89 11.000 0.271 66.913 1.00 0.00 ATOM 704 CB THR 89 11.498 -0.008 68.395 1.00 0.00 ATOM 705 CG2 THR 89 11.244 -1.399 68.838 1.00 0.00 ATOM 706 OG1 THR 89 12.888 0.298 68.542 1.00 0.00 ATOM 707 O THR 89 12.190 2.230 66.317 1.00 0.00 ATOM 708 C THR 89 12.001 1.048 66.082 1.00 0.00 ATOM 709 N HIS 90 12.585 0.402 65.070 1.00 0.00 ATOM 710 CA HIS 90 13.512 1.091 64.168 1.00 0.00 ATOM 711 CB HIS 90 14.384 0.116 63.374 1.00 0.00 ATOM 712 CG HIS 90 15.518 -0.459 64.172 1.00 0.00 ATOM 713 CD2 HIS 90 16.176 0.011 65.251 1.00 0.00 ATOM 714 ND1 HIS 90 16.079 -1.683 63.878 1.00 0.00 ATOM 715 CE1 HIS 90 17.038 -1.939 64.753 1.00 0.00 ATOM 716 NE2 HIS 90 17.119 -0.932 65.596 1.00 0.00 ATOM 717 O HIS 90 13.094 3.112 62.968 1.00 0.00 ATOM 718 C HIS 90 12.695 1.983 63.240 1.00 0.00 ATOM 719 N PHE 91 11.515 1.502 62.831 1.00 0.00 ATOM 720 CA PHE 91 10.610 2.273 61.979 1.00 0.00 ATOM 721 CB PHE 91 9.415 1.429 61.510 1.00 0.00 ATOM 722 CG PHE 91 9.560 0.900 60.111 1.00 0.00 ATOM 723 CD1 PHE 91 10.251 -0.304 59.860 1.00 0.00 ATOM 724 CD2 PHE 91 9.051 1.621 59.022 1.00 0.00 ATOM 725 CE1 PHE 91 10.440 -0.774 58.530 1.00 0.00 ATOM 726 CE2 PHE 91 9.236 1.166 57.690 1.00 0.00 ATOM 727 CZ PHE 91 9.929 -0.032 57.446 1.00 0.00 ATOM 728 O PHE 91 10.274 4.626 62.343 1.00 0.00 ATOM 729 C PHE 91 10.142 3.484 62.791 1.00 0.00 ATOM 730 N SER 92 9.763 3.227 64.045 1.00 0.00 ATOM 731 CA SER 92 9.320 4.269 64.958 1.00 0.00 ATOM 732 CB SER 92 8.809 3.660 66.260 1.00 0.00 ATOM 733 OG SER 92 8.274 4.659 67.112 1.00 0.00 ATOM 734 O SER 92 10.192 6.486 65.171 1.00 0.00 ATOM 735 C SER 92 10.437 5.282 65.242 1.00 0.00 ATOM 736 N GLN 93 11.665 4.790 65.471 1.00 0.00 ATOM 737 CA GLN 93 12.836 5.638 65.746 1.00 0.00 ATOM 738 CB GLN 93 14.081 4.808 66.070 1.00 0.00 ATOM 739 CG GLN 93 14.216 4.355 67.518 1.00 0.00 ATOM 740 CD GLN 93 15.568 3.702 67.835 1.00 0.00 ATOM 741 OE1 GLN 93 16.455 3.599 66.974 1.00 0.00 ATOM 742 NE2 GLN 93 15.731 3.275 69.085 1.00 0.00 ATOM 743 O GLN 93 13.605 7.670 64.735 1.00 0.00 ATOM 744 C GLN 93 13.184 6.522 64.563 1.00 0.00 ATOM 745 N TYR 94 13.007 5.973 63.361 1.00 0.00 ATOM 746 CA TYR 94 13.307 6.698 62.140 1.00 0.00 ATOM 747 CB TYR 94 13.482 5.749 60.951 1.00 0.00 ATOM 748 CG TYR 94 14.165 6.366 59.750 1.00 0.00 ATOM 749 CD1 TYR 94 13.990 5.825 58.473 1.00 0.00 ATOM 750 CD2 TYR 94 15.005 7.490 59.883 1.00 0.00 ATOM 751 CE1 TYR 94 14.643 6.377 57.354 1.00 0.00 ATOM 752 CE2 TYR 94 15.637 8.049 58.787 1.00 0.00 ATOM 753 CZ TYR 94 15.461 7.489 57.532 1.00 0.00 ATOM 754 OH TYR 94 16.114 8.053 56.477 1.00 0.00 ATOM 755 O TYR 94 12.499 8.791 61.375 1.00 0.00 ATOM 756 C TYR 94 12.217 7.702 61.868 1.00 0.00 ATOM 757 N TRP 95 10.981 7.338 62.209 1.00 0.00 ATOM 758 CA TRP 95 9.875 8.258 62.038 1.00 0.00 ATOM 759 CB TRP 95 8.504 7.613 62.283 1.00 0.00 ATOM 760 CG TRP 95 7.376 8.631 62.371 1.00 0.00 ATOM 761 CD1 TRP 95 6.512 8.797 63.416 1.00 0.00 ATOM 762 CD2 TRP 95 7.079 9.692 61.432 1.00 0.00 ATOM 763 CE2 TRP 95 6.018 10.445 62.009 1.00 0.00 ATOM 764 CE3 TRP 95 7.617 10.078 60.187 1.00 0.00 ATOM 765 NE1 TRP 95 5.700 9.884 63.199 1.00 0.00 ATOM 766 CZ2 TRP 95 5.486 11.583 61.357 1.00 0.00 ATOM 767 CZ3 TRP 95 7.093 11.213 59.552 1.00 0.00 ATOM 768 CH2 TRP 95 6.030 11.951 60.142 1.00 0.00 ATOM 769 O TRP 95 9.984 10.597 62.493 1.00 0.00 ATOM 770 C TRP 95 10.082 9.457 62.958 1.00 0.00 ATOM 771 N HIS 96 10.387 9.192 64.235 1.00 0.00 ATOM 772 CA HIS 96 10.650 10.251 65.212 1.00 0.00 ATOM 773 CB HIS 96 11.038 9.691 66.576 1.00 0.00 ATOM 774 CG HIS 96 9.877 9.208 67.392 1.00 0.00 ATOM 775 CD2 HIS 96 9.154 9.819 68.357 1.00 0.00 ATOM 776 ND1 HIS 96 9.375 7.932 67.282 1.00 0.00 ATOM 777 CE1 HIS 96 8.390 7.773 68.151 1.00 0.00 ATOM 778 NE2 HIS 96 8.235 8.901 68.816 1.00 0.00 ATOM 779 O HIS 96 11.642 12.338 64.697 1.00 0.00 ATOM 780 C HIS 96 11.780 11.127 64.704 1.00 0.00 ATOM 781 N TYR 97 12.823 10.504 64.145 1.00 0.00 ATOM 782 CA TYR 97 13.966 11.238 63.606 1.00 0.00 ATOM 783 CB TYR 97 15.083 10.286 63.119 1.00 0.00 ATOM 784 CG TYR 97 16.303 11.004 62.553 1.00 0.00 ATOM 785 CD1 TYR 97 16.403 11.293 61.169 1.00 0.00 ATOM 786 CD2 TYR 97 17.292 11.520 63.406 1.00 0.00 ATOM 787 CE1 TYR 97 17.453 12.103 60.658 1.00 0.00 ATOM 788 CE2 TYR 97 18.349 12.330 62.905 1.00 0.00 ATOM 789 CZ TYR 97 18.419 12.618 61.535 1.00 0.00 ATOM 790 OH TYR 97 19.425 13.422 61.035 1.00 0.00 ATOM 791 O TYR 97 13.978 13.325 62.445 1.00 0.00 ATOM 792 C TYR 97 13.549 12.171 62.472 1.00 0.00 ATOM 793 N LEU 98 12.757 11.657 61.528 1.00 0.00 ATOM 794 CA LEU 98 12.306 12.447 60.379 1.00 0.00 ATOM 795 CB LEU 98 11.684 11.544 59.317 1.00 0.00 ATOM 796 CG LEU 98 12.628 10.548 58.641 1.00 0.00 ATOM 797 CD1 LEU 98 11.834 9.377 58.183 1.00 0.00 ATOM 798 CD2 LEU 98 13.394 11.134 57.492 1.00 0.00 ATOM 799 O LEU 98 11.420 14.658 60.156 1.00 0.00 ATOM 800 C LEU 98 11.338 13.578 60.732 1.00 0.00 ATOM 801 N ASN 99 10.481 13.347 61.725 1.00 0.00 ATOM 802 CA ASN 99 9.492 14.336 62.148 1.00 0.00 ATOM 803 CB ASN 99 8.240 13.630 62.666 1.00 0.00 ATOM 804 CG ASN 99 7.024 14.557 62.779 1.00 0.00 ATOM 805 ND2 ASN 99 7.033 15.671 62.050 1.00 0.00 ATOM 806 OD1 ASN 99 6.078 14.247 63.496 1.00 0.00 ATOM 807 O ASN 99 9.552 16.485 63.221 1.00 0.00 ATOM 808 C ASN 99 9.981 15.328 63.206 1.00 0.00 ATOM 809 N GLU 100 10.856 14.865 64.095 1.00 0.00 ATOM 810 CA GLU 100 11.370 15.693 65.182 1.00 0.00 ATOM 811 CB GLU 100 11.320 14.908 66.500 1.00 0.00 ATOM 812 CG GLU 100 9.918 14.382 66.844 1.00 0.00 ATOM 813 CD GLU 100 9.883 13.349 67.965 1.00 0.00 ATOM 814 OE1 GLU 100 10.914 13.093 68.628 1.00 0.00 ATOM 815 OE2 GLU 100 8.795 12.775 68.185 1.00 0.00 ATOM 816 O GLU 100 13.137 17.191 65.712 1.00 0.00 ATOM 817 C GLU 100 12.756 16.289 64.974 1.00 0.00 ATOM 818 N GLN 101 13.495 15.820 63.964 1.00 0.00 ATOM 819 CA GLN 101 14.846 16.326 63.704 1.00 0.00 ATOM 820 CB GLN 101 15.908 15.412 64.341 1.00 0.00 ATOM 821 CG GLN 101 16.260 15.712 65.809 1.00 0.00 ATOM 822 CD GLN 101 16.019 14.517 66.733 1.00 0.00 ATOM 823 OE1 GLN 101 16.422 13.384 66.436 1.00 0.00 ATOM 824 NE2 GLN 101 15.361 14.768 67.862 1.00 0.00 ATOM 825 O GLN 101 16.046 17.624 62.122 1.00 0.00 ATOM 826 C GLN 101 15.285 16.669 62.278 1.00 0.00 ATOM 827 N ASP 102 14.884 15.907 61.247 1.00 0.00 ATOM 828 CA ASP 102 15.339 16.256 59.882 1.00 0.00 ATOM 829 CB ASP 102 16.743 15.680 59.598 1.00 0.00 ATOM 830 CG ASP 102 17.427 16.346 58.397 1.00 0.00 ATOM 831 OD1 ASP 102 17.659 17.573 58.417 1.00 0.00 ATOM 832 OD2 ASP 102 17.665 15.653 57.395 1.00 0.00 ATOM 833 O ASP 102 14.741 17.026 57.725 1.00 0.00 ATOM 834 C ASP 102 14.486 16.208 58.596 1.00 0.00 ATOM 835 N GLU 103 13.479 15.340 58.448 1.00 0.00 ATOM 836 CA GLU 103 12.625 15.273 57.211 1.00 0.00 ATOM 837 CB GLU 103 11.382 16.207 57.262 1.00 0.00 ATOM 838 CG GLU 103 11.359 17.439 58.178 1.00 0.00 ATOM 839 CD GLU 103 12.070 18.673 57.624 1.00 0.00 ATOM 840 OE1 GLU 103 12.034 18.911 56.397 1.00 0.00 ATOM 841 OE2 GLU 103 12.655 19.418 58.441 1.00 0.00 ATOM 842 O GLU 103 12.510 14.925 54.831 1.00 0.00 ATOM 843 C GLU 103 13.191 15.315 55.777 1.00 0.00 ATOM 844 N THR 104 14.446 15.739 55.635 1.00 0.00 ATOM 845 CA THR 104 15.148 15.854 54.350 1.00 0.00 ATOM 846 CB THR 104 16.375 16.817 54.447 1.00 0.00 ATOM 847 CG2 THR 104 16.473 17.708 53.216 1.00 0.00 ATOM 848 OG1 THR 104 16.263 17.637 55.614 1.00 0.00 ATOM 849 O THR 104 15.811 14.539 52.447 1.00 0.00 ATOM 850 C THR 104 15.653 14.556 53.683 1.00 0.00 ATOM 851 N PRO 105 15.964 13.480 54.466 1.00 0.00 ATOM 852 CA PRO 105 16.445 12.241 53.849 1.00 0.00 ATOM 853 CB PRO 105 16.633 11.335 55.053 1.00 0.00 ATOM 854 CG PRO 105 17.067 12.266 56.096 1.00 0.00 ATOM 855 CD PRO 105 16.044 13.323 55.934 1.00 0.00 ATOM 856 O PRO 105 14.317 11.429 53.134 1.00 0.00 ATOM 857 C PRO 105 15.497 11.604 52.843 1.00 0.00 ATOM 858 N GLY 106 16.019 11.316 51.649 1.00 0.00 ATOM 859 CA GLY 106 15.235 10.685 50.592 1.00 0.00 ATOM 860 O GLY 106 16.127 8.657 51.440 1.00 0.00 ATOM 861 C GLY 106 15.422 9.174 50.590 1.00 0.00 ATOM 862 N PHE 107 14.804 8.461 49.649 1.00 0.00 ATOM 863 CA PHE 107 14.934 6.997 49.578 1.00 0.00 ATOM 864 CB PHE 107 13.981 6.411 48.533 1.00 0.00 ATOM 865 CG PHE 107 12.530 6.506 48.893 1.00 0.00 ATOM 866 CD1 PHE 107 11.669 7.330 48.145 1.00 0.00 ATOM 867 CD2 PHE 107 11.995 5.739 49.949 1.00 0.00 ATOM 868 CE1 PHE 107 10.297 7.386 48.428 1.00 0.00 ATOM 869 CE2 PHE 107 10.623 5.784 50.247 1.00 0.00 ATOM 870 CZ PHE 107 9.771 6.614 49.485 1.00 0.00 ATOM 871 O PHE 107 16.697 5.361 49.624 1.00 0.00 ATOM 872 C PHE 107 16.342 6.484 49.261 1.00 0.00 ATOM 873 N ALA 108 17.145 7.333 48.627 1.00 0.00 ATOM 874 CA ALA 108 18.488 6.965 48.215 1.00 0.00 ATOM 875 CB ALA 108 18.643 7.263 46.743 1.00 0.00 ATOM 876 O ALA 108 20.801 7.532 48.520 1.00 0.00 ATOM 877 C ALA 108 19.666 7.545 49.008 1.00 0.00 ATOM 878 N ASP 109 19.419 8.013 50.232 1.00 0.00 ATOM 879 CA ASP 109 20.493 8.576 51.057 1.00 0.00 ATOM 880 CB ASP 109 19.973 9.740 51.912 1.00 0.00 ATOM 881 CG ASP 109 19.628 10.975 51.083 1.00 0.00 ATOM 882 OD1 ASP 109 20.241 11.197 50.011 1.00 0.00 ATOM 883 OD2 ASP 109 18.744 11.738 51.510 1.00 0.00 ATOM 884 O ASP 109 20.671 6.426 52.117 1.00 0.00 ATOM 885 C ASP 109 21.191 7.534 51.934 1.00 0.00 ATOM 886 N ASP 110 22.371 7.901 52.455 1.00 0.00 ATOM 887 CA ASP 110 23.196 7.053 53.327 1.00 0.00 ATOM 888 CB ASP 110 24.491 7.769 53.755 1.00 0.00 ATOM 889 CG ASP 110 25.445 8.073 52.597 1.00 0.00 ATOM 890 OD1 ASP 110 26.329 8.942 52.792 1.00 0.00 ATOM 891 OD2 ASP 110 25.344 7.451 51.516 1.00 0.00 ATOM 892 O ASP 110 22.436 5.538 55.020 1.00 0.00 ATOM 893 C ASP 110 22.453 6.699 54.606 1.00 0.00 ATOM 894 N ILE 111 21.809 7.710 55.193 1.00 0.00 ATOM 895 CA ILE 111 21.066 7.586 56.445 1.00 0.00 ATOM 896 CB ILE 111 20.578 9.009 56.923 1.00 0.00 ATOM 897 CG1 ILE 111 20.334 9.080 58.439 1.00 0.00 ATOM 898 CG2 ILE 111 19.445 9.491 56.102 1.00 0.00 ATOM 899 CD1 ILE 111 19.008 8.587 58.958 1.00 0.00 ATOM 900 O ILE 111 19.743 5.759 57.259 1.00 0.00 ATOM 901 C ILE 111 19.948 6.543 56.332 1.00 0.00 ATOM 902 N THR 112 19.288 6.480 55.177 1.00 0.00 ATOM 903 CA THR 112 18.223 5.500 54.992 1.00 0.00 ATOM 904 CB THR 112 17.040 6.010 54.113 1.00 0.00 ATOM 905 CG2 THR 112 17.277 7.408 53.676 1.00 0.00 ATOM 906 OG1 THR 112 16.810 5.150 52.996 1.00 0.00 ATOM 907 O THR 112 18.131 3.122 54.735 1.00 0.00 ATOM 908 C THR 112 18.779 4.157 54.548 1.00 0.00 ATOM 909 N TRP 113 20.010 4.175 54.033 1.00 0.00 ATOM 910 CA TRP 113 20.674 2.948 53.611 1.00 0.00 ATOM 911 CB TRP 113 21.907 3.234 52.732 1.00 0.00 ATOM 912 CG TRP 113 22.637 1.992 52.313 1.00 0.00 ATOM 913 CD1 TRP 113 23.859 1.585 52.761 1.00 0.00 ATOM 914 CD2 TRP 113 22.123 0.916 51.513 1.00 0.00 ATOM 915 CE2 TRP 113 23.084 -0.124 51.559 1.00 0.00 ATOM 916 CE3 TRP 113 20.935 0.722 50.773 1.00 0.00 ATOM 917 NE1 TRP 113 24.126 0.317 52.325 1.00 0.00 ATOM 918 CZ2 TRP 113 22.898 -1.361 50.885 1.00 0.00 ATOM 919 CZ3 TRP 113 20.742 -0.512 50.097 1.00 0.00 ATOM 920 CH2 TRP 113 21.723 -1.537 50.166 1.00 0.00 ATOM 921 O TRP 113 20.847 0.959 54.949 1.00 0.00 ATOM 922 C TRP 113 21.061 2.172 54.869 1.00 0.00 ATOM 923 N ASP 114 21.576 2.904 55.856 1.00 0.00 ATOM 924 CA ASP 114 21.976 2.338 57.143 1.00 0.00 ATOM 925 CB ASP 114 22.715 3.381 57.986 1.00 0.00 ATOM 926 CG ASP 114 24.002 3.886 57.323 1.00 0.00 ATOM 927 OD1 ASP 114 24.585 3.178 56.469 1.00 0.00 ATOM 928 OD2 ASP 114 24.437 5.012 57.659 1.00 0.00 ATOM 929 O ASP 114 20.752 0.767 58.495 1.00 0.00 ATOM 930 C ASP 114 20.726 1.834 57.871 1.00 0.00 ATOM 931 N PHE 115 19.616 2.562 57.707 1.00 0.00 ATOM 932 CA PHE 115 18.335 2.185 58.304 1.00 0.00 ATOM 933 CB PHE 115 17.258 3.268 58.068 1.00 0.00 ATOM 934 CG PHE 115 15.855 2.818 58.403 1.00 0.00 ATOM 935 CD1 PHE 115 14.930 2.549 57.384 1.00 0.00 ATOM 936 CD2 PHE 115 15.467 2.613 59.730 1.00 0.00 ATOM 937 CE1 PHE 115 13.636 2.053 57.678 1.00 0.00 ATOM 938 CE2 PHE 115 14.181 2.114 60.036 1.00 0.00 ATOM 939 CZ PHE 115 13.261 1.840 59.010 1.00 0.00 ATOM 940 O PHE 115 17.567 -0.067 58.558 1.00 0.00 ATOM 941 C PHE 115 17.856 0.830 57.766 1.00 0.00 ATOM 942 N ILE 116 17.778 0.687 56.439 1.00 0.00 ATOM 943 CA ILE 116 17.305 -0.565 55.851 1.00 0.00 ATOM 944 CB ILE 116 16.845 -0.439 54.363 1.00 0.00 ATOM 945 CG1 ILE 116 18.009 -0.285 53.395 1.00 0.00 ATOM 946 CG2 ILE 116 15.913 0.731 54.212 1.00 0.00 ATOM 947 CD1 ILE 116 17.573 -0.394 51.942 1.00 0.00 ATOM 948 O ILE 116 17.812 -2.904 56.053 1.00 0.00 ATOM 949 C ILE 116 18.242 -1.746 56.076 1.00 0.00 ATOM 950 N SER 117 19.500 -1.433 56.383 1.00 0.00 ATOM 951 CA SER 117 20.502 -2.449 56.679 1.00 0.00 ATOM 952 CB SER 117 21.915 -1.875 56.585 1.00 0.00 ATOM 953 OG SER 117 22.242 -1.565 55.238 1.00 0.00 ATOM 954 O SER 117 20.766 -4.120 58.387 1.00 0.00 ATOM 955 C SER 117 20.263 -3.041 58.075 1.00 0.00 ATOM 956 N ASN 118 19.467 -2.351 58.893 1.00 0.00 ATOM 957 CA ASN 118 19.145 -2.827 60.232 1.00 0.00 ATOM 958 CB ASN 118 19.505 -1.777 61.280 1.00 0.00 ATOM 959 CG ASN 118 21.005 -1.592 61.426 1.00 0.00 ATOM 960 ND2 ASN 118 21.419 -0.373 61.755 1.00 0.00 ATOM 961 OD1 ASN 118 21.784 -2.537 61.254 1.00 0.00 ATOM 962 O ASN 118 17.233 -3.562 61.495 1.00 0.00 ATOM 963 C ASN 118 17.698 -3.297 60.380 1.00 0.00 ATOM 964 N VAL 119 16.996 -3.414 59.252 1.00 0.00 ATOM 965 CA VAL 119 15.609 -3.886 59.250 1.00 0.00 ATOM 966 CB VAL 119 14.702 -3.074 58.272 1.00 0.00 ATOM 967 CG1 VAL 119 13.261 -3.553 58.336 1.00 0.00 ATOM 968 CG2 VAL 119 14.743 -1.605 58.606 1.00 0.00 ATOM 969 O VAL 119 15.807 -5.680 57.677 1.00 0.00 ATOM 970 C VAL 119 15.638 -5.355 58.849 1.00 0.00 ATOM 971 N ASN 120 15.447 -6.227 59.837 1.00 0.00 ATOM 972 CA ASN 120 15.457 -7.683 59.658 1.00 0.00 ATOM 973 CB ASN 120 15.118 -8.411 60.964 1.00 0.00 ATOM 974 CG ASN 120 16.201 -8.252 62.022 1.00 0.00 ATOM 975 ND2 ASN 120 17.422 -8.666 61.692 1.00 0.00 ATOM 976 OD1 ASN 120 15.940 -7.759 63.119 1.00 0.00 ATOM 977 O ASN 120 15.170 -9.002 57.726 1.00 0.00 ATOM 978 C ASN 120 14.629 -8.257 58.520 1.00 0.00 ATOM 979 N SER 121 13.367 -7.854 58.372 1.00 0.00 ATOM 980 CA SER 121 12.525 -8.374 57.285 1.00 0.00 ATOM 981 CB SER 121 11.106 -7.850 57.422 1.00 0.00 ATOM 982 OG SER 121 11.124 -6.447 57.554 1.00 0.00 ATOM 983 O SER 121 12.791 -8.809 54.913 1.00 0.00 ATOM 984 C SER 121 13.085 -8.082 55.878 1.00 0.00 ATOM 985 N ILE 122 13.908 -7.032 55.786 1.00 0.00 ATOM 986 CA ILE 122 14.565 -6.669 54.541 1.00 0.00 ATOM 987 CB ILE 122 14.841 -5.136 54.410 1.00 0.00 ATOM 988 CG1 ILE 122 13.523 -4.375 54.262 1.00 0.00 ATOM 989 CG2 ILE 122 15.745 -4.836 53.191 1.00 0.00 ATOM 990 CD1 ILE 122 13.663 -2.860 54.416 1.00 0.00 ATOM 991 O ILE 122 15.986 -8.285 53.527 1.00 0.00 ATOM 992 C ILE 122 15.869 -7.465 54.433 1.00 0.00 ATOM 993 N THR 123 16.818 -7.276 55.359 1.00 0.00 ATOM 994 CA THR 123 18.093 -8.002 55.271 1.00 0.00 ATOM 995 CB THR 123 19.184 -7.606 56.314 1.00 0.00 ATOM 996 CG2 THR 123 19.611 -6.187 56.165 1.00 0.00 ATOM 997 OG1 THR 123 18.737 -7.879 57.647 1.00 0.00 ATOM 998 O THR 123 18.861 -10.147 54.686 1.00 0.00 ATOM 999 C THR 123 18.024 -9.510 55.306 1.00 0.00 ATOM 1000 N ARG 124 17.044 -10.084 56.005 1.00 0.00 ATOM 1001 CA ARG 124 16.942 -11.540 56.080 1.00 0.00 ATOM 1002 CB ARG 124 16.093 -11.999 57.277 1.00 0.00 ATOM 1003 CG ARG 124 16.567 -11.417 58.644 1.00 0.00 ATOM 1004 CD ARG 124 17.119 -12.442 59.644 1.00 0.00 ATOM 1005 NE ARG 124 16.308 -12.736 60.847 1.00 0.00 ATOM 1006 CZ ARG 124 15.007 -13.050 60.881 1.00 0.00 ATOM 1007 NH1 ARG 124 14.260 -13.094 59.781 1.00 0.00 ATOM 1008 NH2 ARG 124 14.484 -13.497 62.012 1.00 0.00 ATOM 1009 O ARG 124 16.839 -13.294 54.480 1.00 0.00 ATOM 1010 C ARG 124 16.487 -12.154 54.759 1.00 0.00 ATOM 1011 N ASN 125 15.783 -11.374 53.927 1.00 0.00 ATOM 1012 CA ASN 125 15.344 -11.802 52.580 1.00 0.00 ATOM 1013 CB ASN 125 14.178 -10.919 52.063 1.00 0.00 ATOM 1014 CG ASN 125 13.700 -11.299 50.633 1.00 0.00 ATOM 1015 ND2 ASN 125 12.390 -11.291 50.435 1.00 0.00 ATOM 1016 OD1 ASN 125 14.499 -11.548 49.723 1.00 0.00 ATOM 1017 O ASN 125 16.848 -10.508 51.188 1.00 0.00 ATOM 1018 C ASN 125 16.599 -11.609 51.706 1.00 0.00 ATOM 1019 N ALA 126 17.346 -12.700 51.526 1.00 0.00 ATOM 1020 CA ALA 126 18.611 -12.726 50.783 1.00 0.00 ATOM 1021 CB ALA 126 19.195 -14.129 50.790 1.00 0.00 ATOM 1022 O ALA 126 19.440 -11.285 49.067 1.00 0.00 ATOM 1023 C ALA 126 18.613 -12.155 49.372 1.00 0.00 ATOM 1024 N THR 127 17.651 -12.576 48.548 1.00 0.00 ATOM 1025 CA THR 127 17.571 -12.106 47.168 1.00 0.00 ATOM 1026 CB THR 127 16.692 -13.000 46.289 1.00 0.00 ATOM 1027 CG2 THR 127 17.319 -14.382 46.138 1.00 0.00 ATOM 1028 OG1 THR 127 15.376 -13.106 46.856 1.00 0.00 ATOM 1029 O THR 127 17.654 -10.039 46.012 1.00 0.00 ATOM 1030 C THR 127 17.179 -10.652 46.966 1.00 0.00 ATOM 1031 N LEU 128 16.356 -10.092 47.861 1.00 0.00 ATOM 1032 CA LEU 128 15.939 -8.680 47.763 1.00 0.00 ATOM 1033 CB LEU 128 14.759 -8.368 48.693 1.00 0.00 ATOM 1034 CG LEU 128 13.741 -7.214 48.551 1.00 0.00 ATOM 1035 CD1 LEU 128 13.320 -6.874 49.962 1.00 0.00 ATOM 1036 CD2 LEU 128 14.232 -5.935 47.852 1.00 0.00 ATOM 1037 O LEU 128 17.331 -6.738 47.548 1.00 0.00 ATOM 1038 C LEU 128 17.106 -7.786 48.164 1.00 0.00 ATOM 1039 N TYR 129 17.840 -8.218 49.188 1.00 0.00 ATOM 1040 CA TYR 129 18.978 -7.469 49.705 1.00 0.00 ATOM 1041 CB TYR 129 19.314 -7.899 51.148 1.00 0.00 ATOM 1042 CG TYR 129 20.211 -6.938 51.899 1.00 0.00 ATOM 1043 CD1 TYR 129 21.345 -7.407 52.573 1.00 0.00 ATOM 1044 CD2 TYR 129 19.967 -5.543 51.898 1.00 0.00 ATOM 1045 CE1 TYR 129 22.235 -6.517 53.228 1.00 0.00 ATOM 1046 CE2 TYR 129 20.853 -4.640 52.550 1.00 0.00 ATOM 1047 CZ TYR 129 21.984 -5.141 53.206 1.00 0.00 ATOM 1048 OH TYR 129 22.883 -4.290 53.814 1.00 0.00 ATOM 1049 O TYR 129 20.822 -6.438 48.596 1.00 0.00 ATOM 1050 C TYR 129 20.195 -7.485 48.772 1.00 0.00 ATOM 1051 N ASP 130 20.492 -8.637 48.144 1.00 0.00 ATOM 1052 CA ASP 130 21.611 -8.749 47.172 1.00 0.00 ATOM 1053 CB ASP 130 21.778 -10.166 46.596 1.00 0.00 ATOM 1054 CG ASP 130 22.079 -11.221 47.652 1.00 0.00 ATOM 1055 OD1 ASP 130 22.805 -10.942 48.630 1.00 0.00 ATOM 1056 OD2 ASP 130 21.576 -12.356 47.492 1.00 0.00 ATOM 1057 O ASP 130 22.084 -7.024 45.571 1.00 0.00 ATOM 1058 C ASP 130 21.258 -7.830 46.008 1.00 0.00 ATOM 1059 N ALA 131 19.989 -7.908 45.594 1.00 0.00 ATOM 1060 CA ALA 131 19.445 -7.081 44.526 1.00 0.00 ATOM 1061 CB ALA 131 17.994 -7.407 44.300 1.00 0.00 ATOM 1062 O ALA 131 20.089 -4.840 43.955 1.00 0.00 ATOM 1063 C ALA 131 19.626 -5.591 44.813 1.00 0.00 ATOM 1064 N LEU 132 19.396 -5.224 46.073 1.00 0.00 ATOM 1065 CA LEU 132 19.515 -3.863 46.566 1.00 0.00 ATOM 1066 CB LEU 132 18.859 -3.787 47.937 1.00 0.00 ATOM 1067 CG LEU 132 17.812 -2.754 48.335 1.00 0.00 ATOM 1068 CD1 LEU 132 17.048 -2.181 47.171 1.00 0.00 ATOM 1069 CD2 LEU 132 16.880 -3.459 49.286 1.00 0.00 ATOM 1070 O LEU 132 21.283 -2.255 46.345 1.00 0.00 ATOM 1071 C LEU 132 20.973 -3.413 46.651 1.00 0.00 ATOM 1072 N LYS 133 21.855 -4.328 47.073 1.00 0.00 ATOM 1073 CA LYS 133 23.300 -4.061 47.181 1.00 0.00 ATOM 1074 CB LYS 133 24.025 -5.180 47.937 1.00 0.00 ATOM 1075 CG LYS 133 23.991 -5.060 49.455 1.00 0.00 ATOM 1076 CD LYS 133 25.045 -5.949 50.097 1.00 0.00 ATOM 1077 CE LYS 133 24.525 -7.350 50.354 1.00 0.00 ATOM 1078 NZ LYS 133 25.589 -8.262 50.852 1.00 0.00 ATOM 1079 O LYS 133 24.671 -2.998 45.527 1.00 0.00 ATOM 1080 C LYS 133 23.922 -3.942 45.795 1.00 0.00 ATOM 1081 N ALA 134 23.568 -4.884 44.915 1.00 0.00 ATOM 1082 CA ALA 134 24.055 -4.928 43.536 1.00 0.00 ATOM 1083 CB ALA 134 23.463 -6.091 42.821 1.00 0.00 ATOM 1084 O ALA 134 24.523 -3.022 42.193 1.00 0.00 ATOM 1085 C ALA 134 23.681 -3.658 42.822 1.00 0.00 ATOM 1086 N MET 135 22.433 -3.244 43.039 1.00 0.00 ATOM 1087 CA MET 135 21.874 -2.036 42.456 1.00 0.00 ATOM 1088 CB MET 135 20.379 -1.958 42.771 1.00 0.00 ATOM 1089 CG MET 135 19.582 -0.926 41.996 1.00 0.00 ATOM 1090 SD MET 135 17.805 -1.586 41.765 1.00 0.00 ATOM 1091 CE MET 135 18.151 -2.601 40.141 1.00 0.00 ATOM 1092 O MET 135 22.923 0.089 42.163 1.00 0.00 ATOM 1093 C MET 135 22.615 -0.794 42.958 1.00 0.00 ATOM 1094 N LYS 136 22.983 -0.774 44.241 1.00 0.00 ATOM 1095 CA LYS 136 23.698 0.371 44.816 1.00 0.00 ATOM 1096 CB LYS 136 23.585 0.390 46.353 1.00 0.00 ATOM 1097 CG LYS 136 24.126 1.694 46.953 1.00 0.00 ATOM 1098 CD LYS 136 23.842 1.938 48.400 1.00 0.00 ATOM 1099 CE LYS 136 24.349 3.333 48.785 1.00 0.00 ATOM 1100 NZ LYS 136 23.337 4.165 49.506 1.00 0.00 ATOM 1101 O LYS 136 25.711 1.628 44.371 1.00 0.00 ATOM 1102 C LYS 136 25.178 0.508 44.430 1.00 0.00 ATOM 1103 N PHE 137 25.827 -0.615 44.131 1.00 0.00 ATOM 1104 CA PHE 137 27.262 -0.599 43.844 1.00 0.00 ATOM 1105 CB PHE 137 27.981 -1.510 44.848 1.00 0.00 ATOM 1106 CG PHE 137 27.645 -1.196 46.284 1.00 0.00 ATOM 1107 CD1 PHE 137 27.138 -2.199 47.123 1.00 0.00 ATOM 1108 CD2 PHE 137 27.903 0.077 46.829 1.00 0.00 ATOM 1109 CE1 PHE 137 26.807 -1.925 48.472 1.00 0.00 ATOM 1110 CE2 PHE 137 27.582 0.373 48.180 1.00 0.00 ATOM 1111 CZ PHE 137 27.067 -0.641 49.013 1.00 0.00 ATOM 1112 O PHE 137 27.870 -2.053 42.035 1.00 0.00 ATOM 1113 C PHE 137 27.765 -0.870 42.427 1.00 0.00 ATOM 1114 N VAL 142 24.915 0.306 36.595 1.00 0.00 ATOM 1115 CA VAL 142 24.964 1.716 36.014 1.00 0.00 ATOM 1116 CB VAL 142 25.382 1.700 34.637 1.00 0.00 ATOM 1117 CG1 VAL 142 24.277 1.474 33.845 1.00 0.00 ATOM 1118 CG2 VAL 142 26.190 3.029 34.203 1.00 0.00 ATOM 1119 O VAL 142 22.862 0.939 35.665 1.00 0.00 ATOM 1120 C VAL 142 23.444 1.786 36.197 1.00 0.00 ATOM 1121 N TRP 143 23.131 3.054 36.481 1.00 0.00 ATOM 1122 CA TRP 143 22.456 3.236 37.832 1.00 0.00 ATOM 1123 CB TRP 143 23.656 3.686 38.747 1.00 0.00 ATOM 1124 CG TRP 143 23.486 4.928 39.537 1.00 0.00 ATOM 1125 CD1 TRP 143 23.708 6.159 39.147 1.00 0.00 ATOM 1126 CD2 TRP 143 23.078 4.995 40.826 1.00 0.00 ATOM 1127 CE2 TRP 143 23.107 6.293 41.196 1.00 0.00 ATOM 1128 CE3 TRP 143 22.736 4.073 41.742 1.00 0.00 ATOM 1129 NE1 TRP 143 23.489 7.009 40.131 1.00 0.00 ATOM 1130 CZ2 TRP 143 22.753 6.677 42.359 1.00 0.00 ATOM 1131 CZ3 TRP 143 22.390 4.459 42.860 1.00 0.00 ATOM 1132 CH2 TRP 143 22.409 5.730 43.203 1.00 0.00 ATOM 1133 O TRP 143 21.955 5.217 36.995 1.00 0.00 ATOM 1134 C TRP 143 21.670 4.394 37.717 1.00 0.00 ATOM 1135 N SER 144 20.710 4.537 38.544 1.00 0.00 ATOM 1136 CA SER 144 19.829 5.546 38.219 1.00 0.00 ATOM 1137 CB SER 144 18.849 4.812 37.424 1.00 0.00 ATOM 1138 OG SER 144 17.716 5.567 37.347 1.00 0.00 ATOM 1139 O SER 144 19.128 4.930 40.190 1.00 0.00 ATOM 1140 C SER 144 19.328 5.788 39.496 1.00 0.00 ATOM 1141 N GLU 145 19.195 7.025 39.873 1.00 0.00 ATOM 1142 CA GLU 145 18.744 7.329 41.212 1.00 0.00 ATOM 1143 CB GLU 145 18.863 8.825 41.486 1.00 0.00 ATOM 1144 CG GLU 145 19.431 9.118 42.870 1.00 0.00 ATOM 1145 CD GLU 145 19.195 10.541 43.339 1.00 0.00 ATOM 1146 OE1 GLU 145 18.108 11.100 43.069 1.00 0.00 ATOM 1147 OE2 GLU 145 20.092 11.096 44.008 1.00 0.00 ATOM 1148 O GLU 145 17.015 6.118 42.311 1.00 0.00 ATOM 1149 C GLU 145 17.311 6.852 41.376 1.00 0.00 ATOM 1150 N ALA 146 16.499 7.111 40.348 1.00 0.00 ATOM 1151 CA ALA 146 15.086 6.733 40.303 1.00 0.00 ATOM 1152 CB ALA 146 14.459 7.245 39.013 1.00 0.00 ATOM 1153 O ALA 146 13.886 4.869 41.250 1.00 0.00 ATOM 1154 C ALA 146 14.790 5.230 40.488 1.00 0.00 ATOM 1155 N ARG 147 15.574 4.365 39.841 1.00 0.00 ATOM 1156 CA ARG 147 15.382 2.909 39.943 1.00 0.00 ATOM 1157 CB ARG 147 16.227 2.162 38.915 1.00 0.00 ATOM 1158 CG ARG 147 15.711 0.755 38.557 1.00 0.00 ATOM 1159 CD ARG 147 16.659 -0.046 37.634 1.00 0.00 ATOM 1160 NE ARG 147 17.441 0.760 36.683 1.00 0.00 ATOM 1161 CZ ARG 147 16.946 1.506 35.687 1.00 0.00 ATOM 1162 NH1 ARG 147 15.634 1.577 35.469 1.00 0.00 ATOM 1163 NH2 ARG 147 17.768 2.261 34.971 1.00 0.00 ATOM 1164 O ARG 147 15.013 1.554 41.882 1.00 0.00 ATOM 1165 C ARG 147 15.738 2.383 41.329 1.00 0.00 ATOM 1166 N PHE 148 16.874 2.850 41.858 1.00 0.00 ATOM 1167 CA PHE 148 17.344 2.463 43.187 1.00 0.00 ATOM 1168 CB PHE 148 18.751 3.021 43.460 1.00 0.00 ATOM 1169 CG PHE 148 19.286 2.679 44.822 1.00 0.00 ATOM 1170 CD1 PHE 148 19.555 3.698 45.758 1.00 0.00 ATOM 1171 CD2 PHE 148 19.464 1.335 45.208 1.00 0.00 ATOM 1172 CE1 PHE 148 19.994 3.389 47.070 1.00 0.00 ATOM 1173 CE2 PHE 148 19.900 1.007 46.513 1.00 0.00 ATOM 1174 CZ PHE 148 20.163 2.042 47.446 1.00 0.00 ATOM 1175 O PHE 148 15.955 2.246 45.119 1.00 0.00 ATOM 1176 C PHE 148 16.346 2.980 44.224 1.00 0.00 ATOM 1177 N SER 149 15.904 4.223 44.029 1.00 0.00 ATOM 1178 CA SER 149 14.934 4.899 44.884 1.00 0.00 ATOM 1179 CB SER 149 14.615 6.281 44.314 1.00 0.00 ATOM 1180 OG SER 149 14.745 7.295 45.285 1.00 0.00 ATOM 1181 O SER 149 13.172 3.746 46.039 1.00 0.00 ATOM 1182 C SER 149 13.648 4.080 44.948 1.00 0.00 ATOM 1183 N GLY 150 13.163 3.686 43.767 1.00 0.00 ATOM 1184 CA GLY 150 11.949 2.895 43.649 1.00 0.00 ATOM 1185 O GLY 150 11.127 0.882 44.637 1.00 0.00 ATOM 1186 C GLY 150 12.106 1.499 44.217 1.00 0.00 ATOM 1187 N MET 151 13.351 1.024 44.267 1.00 0.00 ATOM 1188 CA MET 151 13.644 -0.295 44.802 1.00 0.00 ATOM 1189 CB MET 151 14.875 -0.909 44.130 1.00 0.00 ATOM 1190 CG MET 151 14.957 -2.438 44.243 1.00 0.00 ATOM 1191 SD MET 151 13.931 -3.611 43.070 1.00 0.00 ATOM 1192 CE MET 151 12.344 -2.552 42.522 1.00 0.00 ATOM 1193 O MET 151 13.330 -1.226 46.979 1.00 0.00 ATOM 1194 C MET 151 13.750 -0.275 46.318 1.00 0.00 ATOM 1195 N VAL 152 14.251 0.835 46.863 1.00 0.00 ATOM 1196 CA VAL 152 14.354 1.022 48.309 1.00 0.00 ATOM 1197 CB VAL 152 15.152 2.310 48.660 1.00 0.00 ATOM 1198 CG1 VAL 152 14.989 2.701 50.143 1.00 0.00 ATOM 1199 CG2 VAL 152 16.617 2.095 48.355 1.00 0.00 ATOM 1200 O VAL 152 12.583 0.451 49.838 1.00 0.00 ATOM 1201 C VAL 152 12.918 1.104 48.844 1.00 0.00 ATOM 1202 N LYS 153 12.066 1.821 48.105 1.00 0.00 ATOM 1203 CA LYS 153 10.656 1.988 48.443 1.00 0.00 ATOM 1204 CB LYS 153 10.003 3.036 47.528 1.00 0.00 ATOM 1205 CG LYS 153 8.516 3.299 47.747 1.00 0.00 ATOM 1206 CD LYS 153 8.098 4.537 46.998 1.00 0.00 ATOM 1207 CE LYS 153 6.823 4.339 46.215 1.00 0.00 ATOM 1208 NZ LYS 153 6.626 5.492 45.285 1.00 0.00 ATOM 1209 O LYS 153 9.103 0.365 49.260 1.00 0.00 ATOM 1210 C LYS 153 9.936 0.632 48.394 1.00 0.00 ATOM 1211 N THR 154 10.330 -0.244 47.458 1.00 0.00 ATOM 1212 CA THR 154 9.750 -1.591 47.334 1.00 0.00 ATOM 1213 CB THR 154 10.259 -2.325 46.034 1.00 0.00 ATOM 1214 CG2 THR 154 9.842 -3.806 45.979 1.00 0.00 ATOM 1215 OG1 THR 154 9.734 -1.669 44.881 1.00 0.00 ATOM 1216 O THR 154 9.214 -2.999 49.210 1.00 0.00 ATOM 1217 C THR 154 10.100 -2.410 48.592 1.00 0.00 ATOM 1218 N ALA 155 11.377 -2.382 48.979 1.00 0.00 ATOM 1219 CA ALA 155 11.893 -3.083 50.160 1.00 0.00 ATOM 1220 CB ALA 155 13.396 -2.883 50.265 1.00 0.00 ATOM 1221 O ALA 155 10.846 -3.428 52.305 1.00 0.00 ATOM 1222 C ALA 155 11.228 -2.615 51.463 1.00 0.00 ATOM 1223 N LEU 156 11.113 -1.294 51.603 1.00 0.00 ATOM 1224 CA LEU 156 10.508 -0.631 52.752 1.00 0.00 ATOM 1225 CB LEU 156 10.653 0.876 52.562 1.00 0.00 ATOM 1226 CG LEU 156 11.475 1.757 53.494 1.00 0.00 ATOM 1227 CD1 LEU 156 12.519 0.971 54.249 1.00 0.00 ATOM 1228 CD2 LEU 156 12.084 2.867 52.675 1.00 0.00 ATOM 1229 O LEU 156 8.549 -1.341 53.938 1.00 0.00 ATOM 1230 C LEU 156 9.033 -1.018 52.859 1.00 0.00 ATOM 1231 N THR 157 8.355 -1.059 51.712 1.00 0.00 ATOM 1232 CA THR 157 6.949 -1.453 51.642 1.00 0.00 ATOM 1233 CB THR 157 6.360 -1.196 50.236 1.00 0.00 ATOM 1234 CG2 THR 157 4.879 -1.458 50.192 1.00 0.00 ATOM 1235 OG1 THR 157 6.567 0.174 49.894 1.00 0.00 ATOM 1236 O THR 157 5.891 -3.373 52.590 1.00 0.00 ATOM 1237 C THR 157 6.870 -2.937 51.984 1.00 0.00 ATOM 1238 N LEU 158 7.930 -3.686 51.649 1.00 0.00 ATOM 1239 CA LEU 158 7.974 -5.107 51.953 1.00 0.00 ATOM 1240 CB LEU 158 9.078 -5.859 51.180 1.00 0.00 ATOM 1241 CG LEU 158 9.270 -7.408 51.166 1.00 0.00 ATOM 1242 CD1 LEU 158 10.147 -7.900 52.327 1.00 0.00 ATOM 1243 CD2 LEU 158 7.942 -8.184 51.098 1.00 0.00 ATOM 1244 O LEU 158 7.354 -6.006 54.042 1.00 0.00 ATOM 1245 C LEU 158 8.121 -5.260 53.455 1.00 0.00 ATOM 1246 N ALA 159 8.998 -4.474 54.082 1.00 0.00 ATOM 1247 CA ALA 159 9.197 -4.549 55.534 1.00 0.00 ATOM 1248 CB ALA 159 10.225 -3.565 55.993 1.00 0.00 ATOM 1249 O ALA 159 7.593 -5.210 57.143 1.00 0.00 ATOM 1250 C ALA 159 7.912 -4.359 56.330 1.00 0.00 ATOM 1251 N VAL 160 7.126 -3.328 55.991 1.00 0.00 ATOM 1252 CA VAL 160 5.870 -3.043 56.690 1.00 0.00 ATOM 1253 CB VAL 160 5.306 -1.545 56.508 1.00 0.00 ATOM 1254 CG1 VAL 160 6.372 -0.566 56.106 1.00 0.00 ATOM 1255 CG2 VAL 160 4.145 -1.478 55.575 1.00 0.00 ATOM 1256 O VAL 160 3.940 -4.341 57.180 1.00 0.00 ATOM 1257 C VAL 160 4.799 -4.062 56.353 1.00 0.00 ATOM 1258 N THR 161 4.850 -4.605 55.139 1.00 0.00 ATOM 1259 CA THR 161 3.862 -5.594 54.730 1.00 0.00 ATOM 1260 CB THR 161 3.764 -5.723 53.184 1.00 0.00 ATOM 1261 CG2 THR 161 4.686 -6.797 52.624 1.00 0.00 ATOM 1262 OG1 THR 161 2.425 -6.051 52.829 1.00 0.00 ATOM 1263 O THR 161 3.103 -7.536 55.906 1.00 0.00 ATOM 1264 C THR 161 4.080 -6.935 55.451 1.00 0.00 ATOM 1265 N THR 162 5.346 -7.369 55.591 1.00 0.00 ATOM 1266 CA THR 162 5.650 -8.622 56.300 1.00 0.00 ATOM 1267 CB THR 162 7.058 -9.312 55.945 1.00 0.00 ATOM 1268 CG2 THR 162 7.973 -8.420 55.224 1.00 0.00 ATOM 1269 OG1 THR 162 7.729 -9.764 57.134 1.00 0.00 ATOM 1270 O THR 162 5.093 -9.327 58.513 1.00 0.00 ATOM 1271 C THR 162 5.495 -8.405 57.800 1.00 0.00 ATOM 1272 N THR 163 5.765 -7.175 58.255 1.00 0.00 ATOM 1273 CA THR 163 5.620 -6.806 59.666 1.00 0.00 ATOM 1274 CB THR 163 6.219 -5.408 59.958 1.00 0.00 ATOM 1275 CG2 THR 163 5.794 -4.878 61.299 1.00 0.00 ATOM 1276 OG1 THR 163 7.654 -5.481 59.908 1.00 0.00 ATOM 1277 O THR 163 3.732 -7.410 61.016 1.00 0.00 ATOM 1278 C THR 163 4.129 -6.847 59.998 1.00 0.00 ATOM 1279 N LEU 164 3.314 -6.353 59.074 1.00 0.00 ATOM 1280 CA LEU 164 1.869 -6.356 59.240 1.00 0.00 ATOM 1281 CB LEU 164 1.221 -5.563 58.123 1.00 0.00 ATOM 1282 CG LEU 164 0.487 -4.259 58.401 1.00 0.00 ATOM 1283 CD1 LEU 164 0.958 -3.483 59.646 1.00 0.00 ATOM 1284 CD2 LEU 164 0.669 -3.467 57.139 1.00 0.00 ATOM 1285 O LEU 164 0.300 -8.035 59.905 1.00 0.00 ATOM 1286 C LEU 164 1.300 -7.765 59.236 1.00 0.00 ATOM 1287 N LYS 165 1.979 -8.665 58.522 1.00 0.00 ATOM 1288 CA LYS 165 1.546 -10.052 58.420 1.00 0.00 ATOM 1289 CB LYS 165 2.138 -10.732 57.179 1.00 0.00 ATOM 1290 CG LYS 165 1.466 -12.069 56.778 1.00 0.00 ATOM 1291 CD LYS 165 0.331 -11.932 55.741 1.00 0.00 ATOM 1292 CE LYS 165 -1.083 -11.695 56.311 1.00 0.00 ATOM 1293 NZ LYS 165 -1.411 -10.246 56.530 1.00 0.00 ATOM 1294 O LYS 165 1.079 -11.780 59.993 1.00 0.00 ATOM 1295 C LYS 165 1.835 -10.870 59.670 1.00 0.00 ATOM 1296 N GLU 166 2.885 -10.499 60.402 1.00 0.00 ATOM 1297 CA GLU 166 3.265 -11.200 61.631 1.00 0.00 ATOM 1298 CB GLU 166 4.714 -10.888 62.012 1.00 0.00 ATOM 1299 CG GLU 166 5.768 -11.401 61.040 1.00 0.00 ATOM 1300 CD GLU 166 5.678 -12.898 60.749 1.00 0.00 ATOM 1301 OE1 GLU 166 5.849 -13.712 61.684 1.00 0.00 ATOM 1302 OE2 GLU 166 5.445 -13.254 59.573 1.00 0.00 ATOM 1303 O GLU 166 2.418 -11.583 63.849 1.00 0.00 ATOM 1304 C GLU 166 2.343 -10.914 62.815 1.00 0.00 ATOM 1305 N LEU 167 1.463 -9.929 62.639 1.00 0.00 ATOM 1306 CA LEU 167 0.500 -9.531 63.658 1.00 0.00 ATOM 1307 CB LEU 167 0.445 -7.996 63.768 1.00 0.00 ATOM 1308 CG LEU 167 1.782 -7.258 63.960 1.00 0.00 ATOM 1309 CD1 LEU 167 1.617 -5.775 63.745 1.00 0.00 ATOM 1310 CD2 LEU 167 2.378 -7.536 65.317 1.00 0.00 ATOM 1311 O LEU 167 -1.809 -9.922 64.194 1.00 0.00 ATOM 1312 C LEU 167 -0.896 -10.133 63.402 1.00 0.00 ATOM 1313 N THR 168 -1.055 -10.827 62.268 1.00 0.00 ATOM 1314 CA THR 168 -2.285 -11.536 61.837 1.00 0.00 ATOM 1315 CB THR 168 -3.490 -10.610 61.355 1.00 0.00 ATOM 1316 CG2 THR 168 -4.338 -10.077 62.524 1.00 0.00 ATOM 1317 OG1 THR 168 -3.006 -9.537 60.541 1.00 0.00 ATOM 1318 O THR 168 -1.735 -13.658 60.854 1.00 0.00 ATOM 1319 C THR 168 -1.896 -12.435 60.653 1.00 0.00 ENDMDL # command:# Prefix for output files set to decoys/ # command:# request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_951657961.pdb -s /var/tmp/to_scwrl_951657961.seq -o /var/tmp/from_scwrl_951657961.pdb > /var/tmp/scwrl_951657961.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_951657961.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 129 # copying to AlignedFragments data structure # command:# fraction of real conformation used = 1.000 # GDT_score = -19.055 # GDT_score(maxd=8.000,maxw=2.900)= -17.718 # GDT_score(maxd=8.000,maxw=3.200)= -17.361 # GDT_score(maxd=8.000,maxw=3.500)= -16.937 # GDT_score(maxd=10.000,maxw=3.800)= -18.488 # GDT_score(maxd=10.000,maxw=4.000)= -18.111 # GDT_score(maxd=10.000,maxw=4.200)= -17.711 # GDT_score(maxd=12.000,maxw=4.300)= -19.393 # GDT_score(maxd=12.000,maxw=4.500)= -18.954 # GDT_score(maxd=12.000,maxw=4.700)= -18.533 # GDT_score(maxd=14.000,maxw=5.200)= -19.109 # GDT_score(maxd=14.000,maxw=5.500)= -18.450 # command:# request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_274173250.pdb -s /var/tmp/to_scwrl_274173250.seq -o /var/tmp/from_scwrl_274173250.pdb > /var/tmp/scwrl_274173250.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_274173250.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 137 # copying to AlignedFragments data structure # command:# fraction of real conformation used = 1.000 # GDT_score = -18.598 # GDT_score(maxd=8.000,maxw=2.900)= -17.578 # GDT_score(maxd=8.000,maxw=3.200)= -16.970 # GDT_score(maxd=8.000,maxw=3.500)= -16.365 # GDT_score(maxd=10.000,maxw=3.800)= -18.166 # GDT_score(maxd=10.000,maxw=4.000)= -17.730 # GDT_score(maxd=10.000,maxw=4.200)= -17.287 # GDT_score(maxd=12.000,maxw=4.300)= -19.609 # GDT_score(maxd=12.000,maxw=4.500)= -19.107 # GDT_score(maxd=12.000,maxw=4.700)= -18.626 # GDT_score(maxd=14.000,maxw=5.200)= -19.684 # GDT_score(maxd=14.000,maxw=5.500)= -18.910 # command:# request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_433205611.pdb -s /var/tmp/to_scwrl_433205611.seq -o /var/tmp/from_scwrl_433205611.pdb > /var/tmp/scwrl_433205611.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_433205611.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 136 # copying to AlignedFragments data structure # command:# fraction of real conformation used = 1.000 # GDT_score = -17.530 # GDT_score(maxd=8.000,maxw=2.900)= -16.908 # GDT_score(maxd=8.000,maxw=3.200)= -16.496 # GDT_score(maxd=8.000,maxw=3.500)= -16.030 # GDT_score(maxd=10.000,maxw=3.800)= -17.097 # GDT_score(maxd=10.000,maxw=4.000)= -16.713 # GDT_score(maxd=10.000,maxw=4.200)= -16.347 # GDT_score(maxd=12.000,maxw=4.300)= -17.856 # GDT_score(maxd=12.000,maxw=4.500)= -17.459 # GDT_score(maxd=12.000,maxw=4.700)= -17.079 # GDT_score(maxd=14.000,maxw=5.200)= -17.769 # GDT_score(maxd=14.000,maxw=5.500)= -17.154 # command:# request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_897120439.pdb -s /var/tmp/to_scwrl_897120439.seq -o /var/tmp/from_scwrl_897120439.pdb > /var/tmp/scwrl_897120439.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_897120439.pdb # conformation set from SCWRL output # command:# naming current conformation model4-scwrl # command:# ReadConformPDB reading from PDB file model5.ts-submitted looking for model 1 # Found a chain break before 136 # copying to AlignedFragments data structure # command:# fraction of real conformation used = 1.000 # GDT_score = -21.341 # GDT_score(maxd=8.000,maxw=2.900)= -19.993 # GDT_score(maxd=8.000,maxw=3.200)= -19.495 # GDT_score(maxd=8.000,maxw=3.500)= -18.921 # GDT_score(maxd=10.000,maxw=3.800)= -20.779 # GDT_score(maxd=10.000,maxw=4.000)= -20.306 # GDT_score(maxd=10.000,maxw=4.200)= -19.843 # GDT_score(maxd=12.000,maxw=4.300)= -21.899 # GDT_score(maxd=12.000,maxw=4.500)= -21.386 # GDT_score(maxd=12.000,maxw=4.700)= -20.891 # GDT_score(maxd=14.000,maxw=5.200)= -21.766 # GDT_score(maxd=14.000,maxw=5.500)= -21.037 # command:# request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1545896496.pdb -s /var/tmp/to_scwrl_1545896496.seq -o /var/tmp/from_scwrl_1545896496.pdb > /var/tmp/scwrl_1545896496.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1545896496.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 T0361.try1-opt2.pdb looking for model 1 # Found a chain break before 167 # copying to AlignedFragments data structure # command:# fraction of real conformation used = 1.000 # GDT_score = -19.055 # GDT_score(maxd=8.000,maxw=2.900)= -17.710 # GDT_score(maxd=8.000,maxw=3.200)= -17.359 # GDT_score(maxd=8.000,maxw=3.500)= -16.966 # GDT_score(maxd=10.000,maxw=3.800)= -18.508 # GDT_score(maxd=10.000,maxw=4.000)= -18.136 # GDT_score(maxd=10.000,maxw=4.200)= -17.731 # GDT_score(maxd=12.000,maxw=4.300)= -19.392 # GDT_score(maxd=12.000,maxw=4.500)= -18.949 # GDT_score(maxd=12.000,maxw=4.700)= -18.532 # GDT_score(maxd=14.000,maxw=5.200)= -19.100 # GDT_score(maxd=14.000,maxw=5.500)= -18.420 # command:# Prefix for output files set to # command:EXPDTA T0361.try1-opt2.pdb MODEL 1 REMARK 44 REMARK 44 model 1 is called T0361.try1-opt2.pdb ATOM 1 N MET A 1 26.309 4.405 30.922 1.00 0.00 ATOM 2 CA MET A 1 25.494 3.330 31.483 1.00 0.00 ATOM 3 CB MET A 1 24.800 2.546 30.366 1.00 0.00 ATOM 4 CG MET A 1 23.710 3.323 29.646 1.00 0.00 ATOM 5 SD MET A 1 22.368 3.818 30.744 1.00 0.00 ATOM 6 CE MET A 1 21.628 2.229 31.111 1.00 0.00 ATOM 7 O MET A 1 25.994 1.921 33.364 1.00 0.00 ATOM 8 C MET A 1 26.370 2.370 32.280 1.00 0.00 ATOM 9 N ALA A 2 27.565 2.002 31.818 1.00 0.00 ATOM 10 CA ALA A 2 28.454 1.154 32.600 1.00 0.00 ATOM 11 CB ALA A 2 29.751 0.909 31.845 1.00 0.00 ATOM 12 O ALA A 2 28.755 1.149 34.977 1.00 0.00 ATOM 13 C ALA A 2 28.808 1.799 33.935 1.00 0.00 ATOM 14 N THR A 3 29.165 3.085 33.900 1.00 0.00 ATOM 15 CA THR A 3 29.533 3.794 35.116 1.00 0.00 ATOM 16 CB THR A 3 29.995 5.215 34.774 1.00 0.00 ATOM 17 CG2 THR A 3 30.392 5.948 36.050 1.00 0.00 ATOM 18 OG1 THR A 3 31.148 5.177 33.916 1.00 0.00 ATOM 19 O THR A 3 28.480 3.574 37.284 1.00 0.00 ATOM 20 C THR A 3 28.348 3.864 36.095 1.00 0.00 ATOM 21 N LEU A 4 27.189 4.311 35.590 1.00 0.00 ATOM 22 CA LEU A 4 25.997 4.365 36.417 1.00 0.00 ATOM 23 CB LEU A 4 24.838 4.915 35.587 1.00 0.00 ATOM 24 CG LEU A 4 24.934 6.381 35.189 1.00 0.00 ATOM 25 CD1 LEU A 4 23.900 6.684 34.092 1.00 0.00 ATOM 26 CD2 LEU A 4 24.764 7.329 36.368 1.00 0.00 ATOM 27 O LEU A 4 25.242 2.871 38.133 1.00 0.00 ATOM 28 C LEU A 4 25.639 3.001 36.987 1.00 0.00 ATOM 29 N THR A 5 25.744 1.974 36.145 1.00 0.00 ATOM 30 CA THR A 5 25.408 0.632 36.565 1.00 0.00 ATOM 31 CB THR A 5 25.465 -0.316 35.361 1.00 0.00 ATOM 32 CG2 THR A 5 25.159 -1.751 35.751 1.00 0.00 ATOM 33 OG1 THR A 5 24.504 0.113 34.395 1.00 0.00 ATOM 34 O THR A 5 25.869 -0.434 38.672 1.00 0.00 ATOM 35 C THR A 5 26.329 0.172 37.709 1.00 0.00 ATOM 36 N GLU A 6 27.629 0.443 37.602 1.00 0.00 ATOM 37 CA GLU A 6 28.546 0.051 38.669 1.00 0.00 ATOM 38 CB GLU A 6 30.003 0.261 38.236 1.00 0.00 ATOM 39 CG GLU A 6 30.585 -0.937 37.473 1.00 0.00 ATOM 40 CD GLU A 6 31.944 -0.650 36.843 1.00 0.00 ATOM 41 OE1 GLU A 6 32.842 -0.128 37.546 1.00 0.00 ATOM 42 OE2 GLU A 6 32.115 -0.961 35.640 1.00 0.00 ATOM 43 O GLU A 6 28.443 0.266 41.066 1.00 0.00 ATOM 44 C GLU A 6 28.270 0.810 39.970 1.00 0.00 ATOM 45 N ASP A 7 27.853 2.064 39.859 1.00 0.00 ATOM 46 CA ASP A 7 27.561 2.854 41.054 1.00 0.00 ATOM 47 CB ASP A 7 27.109 4.264 40.667 1.00 0.00 ATOM 48 CG ASP A 7 28.248 5.118 40.145 1.00 0.00 ATOM 49 OD1 ASP A 7 29.418 4.710 40.305 1.00 0.00 ATOM 50 OD2 ASP A 7 27.970 6.196 39.579 1.00 0.00 ATOM 51 O ASP A 7 26.603 1.873 43.031 1.00 0.00 ATOM 52 C ASP A 7 26.449 2.177 41.848 1.00 0.00 ATOM 53 N ASP A 8 25.342 1.915 41.120 1.00 0.00 ATOM 54 CA ASP A 8 24.182 1.298 41.767 1.00 0.00 ATOM 55 CB ASP A 8 23.030 1.195 40.712 1.00 0.00 ATOM 56 CG ASP A 8 22.538 2.555 40.262 1.00 0.00 ATOM 57 OD1 ASP A 8 22.905 3.568 40.903 1.00 0.00 ATOM 58 OD2 ASP A 8 21.774 2.600 39.274 1.00 0.00 ATOM 59 O ASP A 8 23.930 -0.493 43.351 1.00 0.00 ATOM 60 C ASP A 8 24.498 -0.089 42.334 1.00 0.00 ATOM 61 N VAL A 9 25.417 -0.807 41.700 1.00 0.00 ATOM 62 CA VAL A 9 25.770 -2.135 42.192 1.00 0.00 ATOM 63 CB VAL A 9 26.679 -2.875 41.203 1.00 0.00 ATOM 64 CG1 VAL A 9 27.247 -4.143 41.809 1.00 0.00 ATOM 65 CG2 VAL A 9 25.849 -3.213 39.958 1.00 0.00 ATOM 66 O VAL A 9 26.153 -2.779 44.468 1.00 0.00 ATOM 67 C VAL A 9 26.466 -2.033 43.547 1.00 0.00 ATOM 68 N LEU A 10 27.411 -1.109 43.666 1.00 0.00 ATOM 69 CA LEU A 10 28.134 -0.938 44.927 1.00 0.00 ATOM 70 CB LEU A 10 29.283 0.070 44.802 1.00 0.00 ATOM 71 CG LEU A 10 30.542 -0.387 44.044 1.00 0.00 ATOM 72 CD1 LEU A 10 31.438 0.800 43.762 1.00 0.00 ATOM 73 CD2 LEU A 10 31.290 -1.430 44.858 1.00 0.00 ATOM 74 O LEU A 10 27.344 -0.864 47.199 1.00 0.00 ATOM 75 C LEU A 10 27.154 -0.520 46.034 1.00 0.00 ATOM 76 N GLU A 11 26.107 0.215 45.670 1.00 0.00 ATOM 77 CA GLU A 11 25.107 0.644 46.645 1.00 0.00 ATOM 78 CB GLU A 11 24.233 1.753 46.043 1.00 0.00 ATOM 79 CG GLU A 11 24.966 3.059 45.785 1.00 0.00 ATOM 80 CD GLU A 11 24.964 4.001 46.967 1.00 0.00 ATOM 81 OE1 GLU A 11 25.023 5.225 46.728 1.00 0.00 ATOM 82 OE2 GLU A 11 24.920 3.531 48.122 1.00 0.00 ATOM 83 O GLU A 11 23.948 -0.709 48.250 1.00 0.00 ATOM 84 C GLU A 11 24.258 -0.556 47.073 1.00 0.00 ATOM 85 N GLN A 12 23.918 -1.424 46.123 1.00 0.00 ATOM 86 CA GLN A 12 23.101 -2.591 46.449 1.00 0.00 ATOM 87 CB GLN A 12 22.655 -3.320 45.222 1.00 0.00 ATOM 88 CG GLN A 12 21.503 -2.535 44.528 1.00 0.00 ATOM 89 CD GLN A 12 21.177 -3.010 43.124 1.00 0.00 ATOM 90 OE1 GLN A 12 20.047 -2.828 42.645 1.00 0.00 ATOM 91 NE2 GLN A 12 22.155 -3.598 42.446 1.00 0.00 ATOM 92 O GLN A 12 23.394 -4.066 48.329 1.00 0.00 ATOM 93 C GLN A 12 23.916 -3.509 47.364 1.00 0.00 ATOM 94 N LEU A 13 25.198 -3.670 47.057 1.00 0.00 ATOM 95 CA LEU A 13 26.049 -4.530 47.870 1.00 0.00 ATOM 96 CB LEU A 13 27.390 -4.768 47.174 1.00 0.00 ATOM 97 CG LEU A 13 27.326 -5.569 45.867 1.00 0.00 ATOM 98 CD1 LEU A 13 28.731 -5.691 45.281 1.00 0.00 ATOM 99 CD2 LEU A 13 26.734 -6.962 46.141 1.00 0.00 ATOM 100 O LEU A 13 26.309 -4.759 50.240 1.00 0.00 ATOM 101 C LEU A 13 26.214 -3.977 49.272 1.00 0.00 ATOM 102 N ASP A 14 26.239 -2.640 49.400 1.00 0.00 ATOM 103 CA ASP A 14 26.362 -2.022 50.709 1.00 0.00 ATOM 104 CB ASP A 14 26.519 -0.501 50.637 1.00 0.00 ATOM 105 CG ASP A 14 27.876 -0.092 50.115 1.00 0.00 ATOM 106 OD1 ASP A 14 28.846 -0.839 50.361 1.00 0.00 ATOM 107 OD2 ASP A 14 27.988 0.968 49.462 1.00 0.00 ATOM 108 O ASP A 14 25.293 -2.680 52.758 1.00 0.00 ATOM 109 C ASP A 14 25.150 -2.351 51.578 1.00 0.00 ATOM 110 N ALA A 15 23.950 -2.268 51.004 1.00 0.00 ATOM 111 CA ALA A 15 22.730 -2.629 51.711 1.00 0.00 ATOM 112 CB ALA A 15 21.513 -2.236 50.893 1.00 0.00 ATOM 113 O ALA A 15 22.308 -4.477 53.116 1.00 0.00 ATOM 114 C ALA A 15 22.724 -4.115 52.022 1.00 0.00 ATOM 115 N GLN A 16 23.321 -4.978 51.163 1.00 0.00 ATOM 116 CA GLN A 16 23.437 -6.395 51.506 1.00 0.00 ATOM 117 CB GLN A 16 24.034 -7.142 50.254 1.00 0.00 ATOM 118 CG GLN A 16 23.092 -7.131 49.072 1.00 0.00 ATOM 119 CD GLN A 16 23.784 -7.696 47.819 1.00 0.00 ATOM 120 OE1 GLN A 16 24.321 -8.814 47.792 1.00 0.00 ATOM 121 NE2 GLN A 16 23.752 -6.961 46.707 1.00 0.00 ATOM 122 O GLN A 16 23.890 -7.474 53.582 1.00 0.00 ATOM 123 C GLN A 16 24.248 -6.609 52.781 1.00 0.00 ATOM 124 N ASP A 17 25.309 -5.779 53.009 1.00 0.00 ATOM 125 CA ASP A 17 26.125 -5.871 54.182 1.00 0.00 ATOM 126 CB ASP A 17 27.267 -4.848 54.142 1.00 0.00 ATOM 127 CG ASP A 17 28.281 -5.133 53.046 1.00 0.00 ATOM 128 OD1 ASP A 17 28.361 -6.293 52.582 1.00 0.00 ATOM 129 OD2 ASP A 17 29.011 -4.195 52.660 1.00 0.00 ATOM 130 O ASP A 17 25.678 -6.138 56.515 1.00 0.00 ATOM 131 C ASP A 17 25.327 -5.627 55.450 1.00 0.00 ATOM 132 N ASN A 18 24.258 -4.844 55.344 1.00 0.00 ATOM 133 CA ASN A 18 23.455 -4.520 56.511 1.00 0.00 ATOM 134 CB ASN A 18 23.200 -3.008 56.549 1.00 0.00 ATOM 135 CG ASN A 18 24.492 -2.203 56.564 1.00 0.00 ATOM 136 ND2 ASN A 18 25.244 -2.323 57.651 1.00 0.00 ATOM 137 OD1 ASN A 18 24.816 -1.495 55.605 1.00 0.00 ATOM 138 O ASN A 18 21.276 -4.912 57.421 1.00 0.00 ATOM 139 C ASN A 18 22.140 -5.279 56.627 1.00 0.00 ATOM 140 N LEU A 19 21.972 -6.321 55.832 1.00 0.00 ATOM 141 CA LEU A 19 20.739 -7.106 55.866 1.00 0.00 ATOM 142 CB LEU A 19 20.829 -8.287 54.899 1.00 0.00 ATOM 143 CG LEU A 19 19.611 -9.211 54.840 1.00 0.00 ATOM 144 CD1 LEU A 19 18.379 -8.448 54.375 1.00 0.00 ATOM 145 CD2 LEU A 19 19.851 -10.360 53.874 1.00 0.00 ATOM 146 O LEU A 19 19.382 -7.610 57.782 1.00 0.00 ATOM 147 C LEU A 19 20.486 -7.665 57.264 1.00 0.00 ATOM 148 N PHE A 20 21.531 -8.223 57.880 1.00 0.00 ATOM 149 CA PHE A 20 21.402 -8.814 59.219 1.00 0.00 ATOM 150 CB PHE A 20 22.712 -9.419 59.671 1.00 0.00 ATOM 151 CG PHE A 20 23.187 -10.546 58.767 1.00 0.00 ATOM 152 CD1 PHE A 20 22.289 -11.223 57.934 1.00 0.00 ATOM 153 CD2 PHE A 20 24.521 -10.949 58.772 1.00 0.00 ATOM 154 CE1 PHE A 20 22.711 -12.279 57.123 1.00 0.00 ATOM 155 CE2 PHE A 20 24.955 -12.010 57.962 1.00 0.00 ATOM 156 CZ PHE A 20 24.047 -12.674 57.138 1.00 0.00 ATOM 157 O PHE A 20 20.040 -7.914 61.035 1.00 0.00 ATOM 158 C PHE A 20 20.970 -7.704 60.212 1.00 0.00 ATOM 159 N SER A 21 21.657 -6.555 60.168 1.00 0.00 ATOM 160 CA SER A 21 21.332 -5.425 61.040 1.00 0.00 ATOM 161 CB SER A 21 22.318 -4.244 60.816 1.00 0.00 ATOM 162 OG SER A 21 23.643 -4.595 61.235 1.00 0.00 ATOM 163 O SER A 21 19.157 -4.719 61.795 1.00 0.00 ATOM 164 C SER A 21 19.881 -4.961 60.825 1.00 0.00 ATOM 165 N PHE A 22 19.421 -4.868 59.539 1.00 0.00 ATOM 166 CA PHE A 22 18.048 -4.465 59.205 1.00 0.00 ATOM 167 CB PHE A 22 17.896 -4.335 57.688 1.00 0.00 ATOM 168 CG PHE A 22 18.651 -3.177 57.100 1.00 0.00 ATOM 169 CD1 PHE A 22 19.131 -2.163 57.910 1.00 0.00 ATOM 170 CD2 PHE A 22 18.879 -3.101 55.737 1.00 0.00 ATOM 171 CE1 PHE A 22 19.825 -1.097 57.369 1.00 0.00 ATOM 172 CE2 PHE A 22 19.573 -2.035 55.197 1.00 0.00 ATOM 173 CZ PHE A 22 20.045 -1.036 56.007 1.00 0.00 ATOM 174 O PHE A 22 15.942 -5.115 60.138 1.00 0.00 ATOM 175 C PHE A 22 17.019 -5.487 59.694 1.00 0.00 ATOM 176 N MET A 23 17.322 -6.777 59.569 1.00 0.00 ATOM 177 CA MET A 23 16.413 -7.840 60.060 1.00 0.00 ATOM 178 CB MET A 23 16.940 -9.221 59.663 1.00 0.00 ATOM 179 CG MET A 23 16.868 -9.508 58.172 1.00 0.00 ATOM 180 SD MET A 23 17.562 -11.114 57.740 1.00 0.00 ATOM 181 CE MET A 23 16.330 -12.213 58.434 1.00 0.00 ATOM 182 O MET A 23 15.218 -7.835 62.152 1.00 0.00 ATOM 183 C MET A 23 16.307 -7.749 61.604 1.00 0.00 ATOM 184 N LYS A 24 17.436 -7.547 62.288 1.00 0.00 ATOM 185 CA LYS A 24 17.402 -7.407 63.749 1.00 0.00 ATOM 186 CB LYS A 24 18.821 -7.281 64.306 1.00 0.00 ATOM 187 CG LYS A 24 19.641 -8.557 64.210 1.00 0.00 ATOM 188 CD LYS A 24 21.035 -8.362 64.784 1.00 0.00 ATOM 189 CE LYS A 24 21.868 -9.627 64.656 1.00 0.00 ATOM 190 NZ LYS A 24 23.244 -9.444 65.195 1.00 0.00 ATOM 191 O LYS A 24 15.876 -6.181 65.141 1.00 0.00 ATOM 192 C LYS A 24 16.605 -6.169 64.150 1.00 0.00 ATOM 193 N THR A 25 16.730 -5.073 63.367 1.00 0.00 ATOM 194 CA THR A 25 16.010 -3.838 63.648 1.00 0.00 ATOM 195 CB THR A 25 16.430 -2.745 62.645 1.00 0.00 ATOM 196 CG2 THR A 25 15.651 -1.463 62.898 1.00 0.00 ATOM 197 OG1 THR A 25 17.830 -2.474 62.789 1.00 0.00 ATOM 198 O THR A 25 13.754 -3.708 64.473 1.00 0.00 ATOM 199 C THR A 25 14.498 -4.072 63.565 1.00 0.00 ATOM 200 N ALA A 26 14.011 -4.699 62.466 1.00 0.00 ATOM 201 CA ALA A 26 12.591 -4.988 62.252 1.00 0.00 ATOM 202 CB ALA A 26 12.301 -5.518 60.856 1.00 0.00 ATOM 203 O ALA A 26 10.922 -5.906 63.716 1.00 0.00 ATOM 204 C ALA A 26 12.077 -6.012 63.259 1.00 0.00 ATOM 205 N HIS A 27 12.932 -6.958 63.645 1.00 0.00 ATOM 206 CA HIS A 27 12.560 -7.948 64.666 1.00 0.00 ATOM 207 CB HIS A 27 13.660 -8.975 64.860 1.00 0.00 ATOM 208 CG HIS A 27 13.435 -9.913 66.009 1.00 0.00 ATOM 209 CD2 HIS A 27 12.645 -11.009 66.130 1.00 0.00 ATOM 210 ND1 HIS A 27 14.083 -9.774 67.219 1.00 0.00 ATOM 211 CE1 HIS A 27 13.698 -10.740 68.036 1.00 0.00 ATOM 212 NE2 HIS A 27 12.827 -11.503 67.401 1.00 0.00 ATOM 213 O HIS A 27 11.273 -7.461 66.650 1.00 0.00 ATOM 214 C HIS A 27 12.273 -7.189 65.968 1.00 0.00 ATOM 215 N SER A 28 13.123 -6.251 66.302 1.00 0.00 ATOM 216 CA SER A 28 12.912 -5.485 67.531 1.00 0.00 ATOM 217 CB SER A 28 14.066 -4.498 67.724 1.00 0.00 ATOM 218 OG SER A 28 13.855 -3.685 68.865 1.00 0.00 ATOM 219 O SER A 28 10.882 -4.548 68.407 1.00 0.00 ATOM 220 C SER A 28 11.614 -4.689 67.429 1.00 0.00 ATOM 221 N ILE A 29 11.319 -4.167 66.224 1.00 0.00 ATOM 222 CA ILE A 29 10.107 -3.391 65.995 1.00 0.00 ATOM 223 CB ILE A 29 10.239 -2.692 64.609 1.00 0.00 ATOM 224 CG1 ILE A 29 11.407 -1.669 64.597 1.00 0.00 ATOM 225 CG2 ILE A 29 8.958 -2.063 64.128 1.00 0.00 ATOM 226 CD1 ILE A 29 11.649 -1.041 63.249 1.00 0.00 ATOM 227 O ILE A 29 7.896 -3.851 66.827 1.00 0.00 ATOM 228 C ILE A 29 8.855 -4.265 66.165 1.00 0.00 ATOM 229 N LEU A 30 8.873 -5.465 65.570 1.00 0.00 ATOM 230 CA LEU A 30 7.740 -6.379 65.738 1.00 0.00 ATOM 231 CB LEU A 30 7.977 -7.702 65.059 1.00 0.00 ATOM 232 CG LEU A 30 8.366 -7.559 63.586 1.00 0.00 ATOM 233 CD1 LEU A 30 8.468 -8.937 62.953 1.00 0.00 ATOM 234 CD2 LEU A 30 7.323 -6.710 62.846 1.00 0.00 ATOM 235 O LEU A 30 6.356 -6.689 67.691 1.00 0.00 ATOM 236 C LEU A 30 7.495 -6.670 67.221 1.00 0.00 ATOM 237 N LEU A 31 8.571 -6.908 67.957 1.00 0.00 ATOM 238 CA LEU A 31 8.437 -7.165 69.382 1.00 0.00 ATOM 239 CB LEU A 31 9.723 -7.535 70.054 1.00 0.00 ATOM 240 CG LEU A 31 10.438 -8.767 69.510 1.00 0.00 ATOM 241 CD1 LEU A 31 11.735 -8.954 70.287 1.00 0.00 ATOM 242 CD2 LEU A 31 9.564 -10.011 69.623 1.00 0.00 ATOM 243 O LEU A 31 6.898 -6.136 70.952 1.00 0.00 ATOM 244 C LEU A 31 7.816 -5.973 70.108 1.00 0.00 ATOM 245 N GLN A 32 8.268 -4.775 69.774 1.00 0.00 ATOM 246 CA GLN A 32 7.712 -3.574 70.408 1.00 0.00 ATOM 247 CB GLN A 32 8.527 -2.335 69.996 1.00 0.00 ATOM 248 CG GLN A 32 9.918 -2.317 70.609 1.00 0.00 ATOM 249 CD GLN A 32 10.709 -1.144 70.112 1.00 0.00 ATOM 250 OE1 GLN A 32 10.669 -0.064 70.704 1.00 0.00 ATOM 251 NE2 GLN A 32 11.400 -1.324 68.996 1.00 0.00 ATOM 252 O GLN A 32 5.439 -2.962 70.947 1.00 0.00 ATOM 253 C GLN A 32 6.246 -3.380 70.070 1.00 0.00 ATOM 254 N GLY A 33 5.900 -3.703 68.831 1.00 0.00 ATOM 255 CA GLY A 33 4.525 -3.619 68.373 1.00 0.00 ATOM 256 O GLY A 33 2.501 -4.234 69.464 1.00 0.00 ATOM 257 C GLY A 33 3.637 -4.568 69.136 1.00 0.00 ATOM 258 N ILE A 34 4.118 -5.791 69.464 1.00 0.00 ATOM 259 CA ILE A 34 3.377 -6.737 70.309 1.00 0.00 ATOM 260 CB ILE A 34 4.085 -8.097 70.455 1.00 0.00 ATOM 261 CG1 ILE A 34 4.146 -8.814 69.104 1.00 0.00 ATOM 262 CG2 ILE A 34 3.337 -8.984 71.438 1.00 0.00 ATOM 263 CD1 ILE A 34 5.031 -10.041 69.104 1.00 0.00 ATOM 264 O ILE A 34 2.173 -6.614 72.374 1.00 0.00 ATOM 265 C ILE A 34 3.147 -6.221 71.721 1.00 0.00 ATOM 266 N ARG A 35 4.002 -5.300 72.168 1.00 0.00 ATOM 267 CA ARG A 35 3.850 -4.701 73.514 1.00 0.00 ATOM 268 CB ARG A 35 5.204 -4.240 74.057 1.00 0.00 ATOM 269 CG ARG A 35 6.178 -5.372 74.342 1.00 0.00 ATOM 270 CD ARG A 35 7.492 -4.846 74.893 1.00 0.00 ATOM 271 NE ARG A 35 8.437 -5.923 75.180 1.00 0.00 ATOM 272 CZ ARG A 35 9.696 -5.730 75.557 1.00 0.00 ATOM 273 NH1 ARG A 35 10.482 -6.771 75.798 1.00 0.00 ATOM 274 NH2 ARG A 35 10.167 -4.499 75.694 1.00 0.00 ATOM 275 O ARG A 35 2.577 -2.955 74.561 1.00 0.00 ATOM 276 C ARG A 35 3.052 -3.417 73.493 1.00 0.00 ATOM 277 N GLN A 36 2.871 -2.831 72.306 1.00 0.00 ATOM 278 CA GLN A 36 2.173 -1.547 72.175 1.00 0.00 ATOM 279 CB GLN A 36 2.949 -0.499 71.266 1.00 0.00 ATOM 280 CG GLN A 36 2.333 0.896 71.321 1.00 0.00 ATOM 281 CD GLN A 36 2.321 1.509 72.729 1.00 0.00 ATOM 282 OE1 GLN A 36 1.275 1.947 73.218 1.00 0.00 ATOM 283 NE2 GLN A 36 3.467 1.512 73.386 1.00 0.00 ATOM 284 O GLN A 36 -0.172 -0.919 72.004 1.00 0.00 ATOM 285 C GLN A 36 0.722 -1.732 71.751 1.00 0.00 ATOM 286 N PHE A 37 0.488 -2.885 71.063 1.00 0.00 ATOM 287 CA PHE A 37 -0.860 -3.118 70.537 1.00 0.00 ATOM 288 CB PHE A 37 -0.885 -4.368 69.656 1.00 0.00 ATOM 289 CG PHE A 37 -0.200 -4.191 68.332 1.00 0.00 ATOM 290 CD1 PHE A 37 0.103 -2.927 67.856 1.00 0.00 ATOM 291 CD2 PHE A 37 0.143 -5.289 67.561 1.00 0.00 ATOM 292 CE1 PHE A 37 0.734 -2.764 66.637 1.00 0.00 ATOM 293 CE2 PHE A 37 0.774 -5.125 66.342 1.00 0.00 ATOM 294 CZ PHE A 37 1.070 -3.870 65.880 1.00 0.00 ATOM 295 O PHE A 37 -3.059 -2.829 71.526 1.00 0.00 ATOM 296 C PHE A 37 -1.917 -3.290 71.657 1.00 0.00 ATOM 297 N LEU A 38 -1.569 -4.035 72.721 1.00 0.00 ATOM 298 CA LEU A 38 -2.503 -4.269 73.842 1.00 0.00 ATOM 299 CB LEU A 38 -1.897 -5.089 74.982 1.00 0.00 ATOM 300 CG LEU A 38 -1.653 -6.572 74.697 1.00 0.00 ATOM 301 CD1 LEU A 38 -0.901 -7.225 75.847 1.00 0.00 ATOM 302 CD2 LEU A 38 -2.972 -7.309 74.514 1.00 0.00 ATOM 303 O LEU A 38 -4.163 -2.749 74.717 1.00 0.00 ATOM 304 C LEU A 38 -2.957 -2.920 74.423 1.00 0.00 ATOM 305 N PRO A 39 -2.025 -1.953 74.522 1.00 0.00 ATOM 306 CA PRO A 39 -2.365 -0.599 75.002 1.00 0.00 ATOM 307 CB PRO A 39 -1.072 0.130 74.998 1.00 0.00 ATOM 308 CG PRO A 39 -0.056 -0.908 75.294 1.00 0.00 ATOM 309 CD PRO A 39 -0.553 -2.149 74.535 1.00 0.00 ATOM 310 O PRO A 39 -4.355 0.693 74.492 1.00 0.00 ATOM 311 C PRO A 39 -3.324 0.110 74.061 1.00 0.00 ATOM 312 N SER A 40 -3.036 0.039 72.760 1.00 0.00 ATOM 313 CA SER A 40 -3.923 0.663 71.777 1.00 0.00 ATOM 314 CB SER A 40 -3.314 0.574 70.375 1.00 0.00 ATOM 315 OG SER A 40 -2.123 1.337 70.289 1.00 0.00 ATOM 316 O SER A 40 -6.317 0.668 71.624 1.00 0.00 ATOM 317 C SER A 40 -5.293 -0.012 71.739 1.00 0.00 ATOM 318 N LEU A 41 -5.314 -1.322 71.889 1.00 0.00 ATOM 319 CA LEU A 41 -6.562 -2.094 71.949 1.00 0.00 ATOM 320 CB LEU A 41 -6.262 -3.585 72.119 1.00 0.00 ATOM 321 CG LEU A 41 -5.647 -4.294 70.911 1.00 0.00 ATOM 322 CD1 LEU A 41 -5.225 -5.710 71.276 1.00 0.00 ATOM 323 CD2 LEU A 41 -6.647 -4.376 69.768 1.00 0.00 ATOM 324 O LEU A 41 -8.622 -1.423 73.033 1.00 0.00 ATOM 325 C LEU A 41 -7.413 -1.634 73.148 1.00 0.00 ATOM 326 N PHE A 42 -6.785 -1.494 74.304 1.00 0.00 ATOM 327 CA PHE A 42 -7.482 -1.035 75.493 1.00 0.00 ATOM 328 CB PHE A 42 -6.539 -1.047 76.699 1.00 0.00 ATOM 329 CG PHE A 42 -7.179 -0.577 77.974 1.00 0.00 ATOM 330 CD1 PHE A 42 -8.002 -1.417 78.703 1.00 0.00 ATOM 331 CD2 PHE A 42 -6.958 0.706 78.442 1.00 0.00 ATOM 332 CE1 PHE A 42 -8.591 -0.983 79.876 1.00 0.00 ATOM 333 CE2 PHE A 42 -7.547 1.140 79.615 1.00 0.00 ATOM 334 CZ PHE A 42 -8.360 0.300 80.331 1.00 0.00 ATOM 335 O PHE A 42 -9.236 0.661 75.624 1.00 0.00 ATOM 336 C PHE A 42 -8.050 0.380 75.303 1.00 0.00 ATOM 337 N VAL A 43 -7.159 1.289 74.701 1.00 0.00 ATOM 338 CA VAL A 43 -7.560 2.673 74.479 1.00 0.00 ATOM 339 CB VAL A 43 -6.411 3.564 73.959 1.00 0.00 ATOM 340 CG1 VAL A 43 -5.321 3.676 75.029 1.00 0.00 ATOM 341 CG2 VAL A 43 -5.848 3.022 72.644 1.00 0.00 ATOM 342 O VAL A 43 -9.477 3.779 73.544 1.00 0.00 ATOM 343 C VAL A 43 -8.697 2.813 73.472 1.00 0.00 ATOM 344 N ASP A 44 -8.778 1.889 72.503 1.00 0.00 ATOM 345 CA ASP A 44 -9.747 2.015 71.395 1.00 0.00 ATOM 346 CB ASP A 44 -9.450 0.984 70.304 1.00 0.00 ATOM 347 CG ASP A 44 -8.216 1.330 69.496 1.00 0.00 ATOM 348 OD1 ASP A 44 -7.695 2.454 69.657 1.00 0.00 ATOM 349 OD2 ASP A 44 -7.767 0.475 68.702 1.00 0.00 ATOM 350 O ASP A 44 -11.397 0.816 72.644 1.00 0.00 ATOM 351 C ASP A 44 -11.163 1.777 71.910 1.00 0.00 ATOM 352 N ASN A 45 -12.088 2.657 71.563 1.00 0.00 ATOM 353 CA ASN A 45 -13.477 2.526 71.990 1.00 0.00 ATOM 354 CB ASN A 45 -14.100 3.907 72.203 1.00 0.00 ATOM 355 CG ASN A 45 -13.458 4.667 73.346 1.00 0.00 ATOM 356 ND2 ASN A 45 -13.942 4.427 74.560 1.00 0.00 ATOM 357 OD1 ASN A 45 -12.537 5.457 73.140 1.00 0.00 ATOM 358 O ASN A 45 -15.456 1.432 71.213 1.00 0.00 ATOM 359 C ASN A 45 -14.396 1.965 70.905 1.00 0.00 ATOM 360 N ASP A 46 -14.048 2.043 69.682 1.00 0.00 ATOM 361 CA ASP A 46 -14.871 1.505 68.602 1.00 0.00 ATOM 362 CB ASP A 46 -14.527 2.174 67.270 1.00 0.00 ATOM 363 CG ASP A 46 -15.139 3.554 67.135 1.00 0.00 ATOM 364 OD1 ASP A 46 -15.984 3.915 67.982 1.00 0.00 ATOM 365 OD2 ASP A 46 -14.774 4.275 66.183 1.00 0.00 ATOM 366 O ASP A 46 -13.332 -0.327 68.496 1.00 0.00 ATOM 367 C ASP A 46 -14.515 0.030 68.507 1.00 0.00 ATOM 368 N GLU A 47 -15.536 -0.827 68.502 1.00 0.00 ATOM 369 CA GLU A 47 -15.290 -2.272 68.576 1.00 0.00 ATOM 370 CB GLU A 47 -16.602 -3.026 68.799 1.00 0.00 ATOM 371 CG GLU A 47 -17.209 -2.821 70.178 1.00 0.00 ATOM 372 CD GLU A 47 -18.552 -3.507 70.330 1.00 0.00 ATOM 373 OE1 GLU A 47 -19.037 -4.092 69.339 1.00 0.00 ATOM 374 OE2 GLU A 47 -19.120 -3.460 71.442 1.00 0.00 ATOM 375 O GLU A 47 -13.787 -3.709 67.440 1.00 0.00 ATOM 376 C GLU A 47 -14.605 -2.800 67.317 1.00 0.00 ATOM 377 N GLU A 48 -14.915 -2.249 66.177 1.00 0.00 ATOM 378 CA GLU A 48 -14.220 -2.690 64.963 1.00 0.00 ATOM 379 CB GLU A 48 -14.814 -2.064 63.700 1.00 0.00 ATOM 380 CG GLU A 48 -16.211 -2.554 63.361 1.00 0.00 ATOM 381 CD GLU A 48 -16.802 -1.844 62.158 1.00 0.00 ATOM 382 OE1 GLU A 48 -16.144 -0.925 61.628 1.00 0.00 ATOM 383 OE2 GLU A 48 -17.923 -2.207 61.745 1.00 0.00 ATOM 384 O GLU A 48 -11.889 -3.202 64.660 1.00 0.00 ATOM 385 C GLU A 48 -12.728 -2.397 65.070 1.00 0.00 ATOM 386 N ILE A 49 -12.410 -1.243 65.608 1.00 0.00 ATOM 387 CA ILE A 49 -11.021 -0.859 65.775 1.00 0.00 ATOM 388 CB ILE A 49 -10.866 0.593 66.266 1.00 0.00 ATOM 389 CG1 ILE A 49 -11.270 1.574 65.165 1.00 0.00 ATOM 390 CG2 ILE A 49 -9.422 0.871 66.655 1.00 0.00 ATOM 391 CD1 ILE A 49 -11.402 3.004 65.641 1.00 0.00 ATOM 392 O ILE A 49 -9.235 -2.290 66.519 1.00 0.00 ATOM 393 C ILE A 49 -10.323 -1.778 66.781 1.00 0.00 ATOM 394 N VAL A 50 -10.961 -1.989 67.951 1.00 0.00 ATOM 395 CA VAL A 50 -10.403 -2.844 68.996 1.00 0.00 ATOM 396 CB VAL A 50 -11.285 -2.888 70.241 1.00 0.00 ATOM 397 CG1 VAL A 50 -10.815 -3.984 71.212 1.00 0.00 ATOM 398 CG2 VAL A 50 -11.279 -1.512 70.908 1.00 0.00 ATOM 399 O VAL A 50 -9.123 -4.867 68.699 1.00 0.00 ATOM 400 C VAL A 50 -10.211 -4.291 68.563 1.00 0.00 ATOM 401 N GLU A 51 -11.268 -4.889 68.031 1.00 0.00 ATOM 402 CA GLU A 51 -11.174 -6.251 67.539 1.00 0.00 ATOM 403 CB GLU A 51 -12.551 -6.761 67.108 1.00 0.00 ATOM 404 CG GLU A 51 -13.512 -7.002 68.259 1.00 0.00 ATOM 405 CD GLU A 51 -14.893 -7.418 67.790 1.00 0.00 ATOM 406 OE1 GLU A 51 -15.115 -7.456 66.561 1.00 0.00 ATOM 407 OE2 GLU A 51 -15.752 -7.704 68.649 1.00 0.00 ATOM 408 O GLU A 51 -9.428 -7.259 66.219 1.00 0.00 ATOM 409 C GLU A 51 -10.190 -6.292 66.360 1.00 0.00 ATOM 410 N TYR A 52 -10.196 -5.270 65.544 1.00 0.00 ATOM 411 CA TYR A 52 -9.253 -5.199 64.437 1.00 0.00 ATOM 412 CB TYR A 52 -9.472 -3.957 63.595 1.00 0.00 ATOM 413 CG TYR A 52 -8.347 -3.719 62.611 1.00 0.00 ATOM 414 CD1 TYR A 52 -8.121 -4.602 61.553 1.00 0.00 ATOM 415 CD2 TYR A 52 -7.469 -2.644 62.772 1.00 0.00 ATOM 416 CE1 TYR A 52 -7.045 -4.424 60.681 1.00 0.00 ATOM 417 CE2 TYR A 52 -6.390 -2.458 61.905 1.00 0.00 ATOM 418 CZ TYR A 52 -6.185 -3.352 60.862 1.00 0.00 ATOM 419 OH TYR A 52 -5.119 -3.178 60.008 1.00 0.00 ATOM 420 O TYR A 52 -6.993 -5.976 64.399 1.00 0.00 ATOM 421 C TYR A 52 -7.809 -5.206 64.917 1.00 0.00 ATOM 422 N ALA A 53 -7.447 -4.359 65.900 1.00 0.00 ATOM 423 CA ALA A 53 -6.092 -4.327 66.406 1.00 0.00 ATOM 424 CB ALA A 53 -5.876 -3.179 67.337 1.00 0.00 ATOM 425 O ALA A 53 -4.544 -6.073 67.038 1.00 0.00 ATOM 426 C ALA A 53 -5.709 -5.675 67.050 1.00 0.00 ATOM 427 N VAL A 54 -6.690 -6.371 67.630 1.00 0.00 ATOM 428 CA VAL A 54 -6.447 -7.706 68.167 1.00 0.00 ATOM 429 CB VAL A 54 -7.719 -8.300 68.801 1.00 0.00 ATOM 430 CG1 VAL A 54 -7.499 -9.758 69.172 1.00 0.00 ATOM 431 CG2 VAL A 54 -8.093 -7.534 70.060 1.00 0.00 ATOM 432 O VAL A 54 -5.018 -9.385 67.166 1.00 0.00 ATOM 433 C VAL A 54 -5.980 -8.612 67.008 1.00 0.00 ATOM 434 N LYS A 55 -6.638 -8.531 65.848 1.00 0.00 ATOM 435 CA LYS A 55 -6.167 -9.287 64.681 1.00 0.00 ATOM 436 CB LYS A 55 -7.099 -9.068 63.487 1.00 0.00 ATOM 437 CG LYS A 55 -8.466 -9.717 63.642 1.00 0.00 ATOM 438 CD LYS A 55 -9.337 -9.463 62.422 1.00 0.00 ATOM 439 CE LYS A 55 -10.712 -10.090 62.585 1.00 0.00 ATOM 440 NZ LYS A 55 -11.587 -9.821 61.412 1.00 0.00 ATOM 441 O LYS A 55 -3.872 -9.750 64.145 1.00 0.00 ATOM 442 C LYS A 55 -4.735 -8.887 64.329 1.00 0.00 ATOM 443 N PRO A 56 -4.487 -7.581 64.248 1.00 0.00 ATOM 444 CA PRO A 56 -3.107 -7.213 63.922 1.00 0.00 ATOM 445 CB PRO A 56 -3.124 -5.693 63.823 1.00 0.00 ATOM 446 CG PRO A 56 -4.503 -5.451 63.297 1.00 0.00 ATOM 447 CD PRO A 56 -5.405 -6.429 63.990 1.00 0.00 ATOM 448 O PRO A 56 -0.939 -8.057 64.547 1.00 0.00 ATOM 449 C PRO A 56 -2.073 -7.745 64.919 1.00 0.00 ATOM 450 N LEU A 57 -2.474 -7.856 66.188 1.00 0.00 ATOM 451 CA LEU A 57 -1.586 -8.384 67.215 1.00 0.00 ATOM 452 CB LEU A 57 -2.228 -8.368 68.603 1.00 0.00 ATOM 453 CG LEU A 57 -1.381 -8.928 69.747 1.00 0.00 ATOM 454 CD1 LEU A 57 -0.104 -8.120 69.917 1.00 0.00 ATOM 455 CD2 LEU A 57 -2.151 -8.880 71.059 1.00 0.00 ATOM 456 O LEU A 57 -0.082 -10.256 66.928 1.00 0.00 ATOM 457 C LEU A 57 -1.239 -9.848 66.860 1.00 0.00 ATOM 458 N LEU A 58 -2.254 -10.622 66.474 1.00 0.00 ATOM 459 CA LEU A 58 -2.044 -12.024 66.064 1.00 0.00 ATOM 460 CB LEU A 58 -3.378 -12.687 65.717 1.00 0.00 ATOM 461 CG LEU A 58 -4.330 -12.946 66.886 1.00 0.00 ATOM 462 CD1 LEU A 58 -5.679 -13.436 66.385 1.00 0.00 ATOM 463 CD2 LEU A 58 -3.759 -14.002 67.821 1.00 0.00 ATOM 464 O LEU A 58 -0.171 -12.874 64.810 1.00 0.00 ATOM 465 C LEU A 58 -1.101 -12.059 64.863 1.00 0.00 ATOM 466 N ALA A 59 -1.343 -11.170 63.902 1.00 0.00 ATOM 467 CA ALA A 59 -0.516 -11.101 62.705 1.00 0.00 ATOM 468 CB ALA A 59 -1.061 -10.096 61.700 1.00 0.00 ATOM 469 O ALA A 59 1.864 -11.288 62.477 1.00 0.00 ATOM 470 C ALA A 59 0.928 -10.730 63.044 1.00 0.00 ATOM 471 N GLN A 60 1.111 -9.786 63.971 1.00 0.00 ATOM 472 CA GLN A 60 2.455 -9.372 64.370 1.00 0.00 ATOM 473 CB GLN A 60 2.386 -8.260 65.417 1.00 0.00 ATOM 474 CG GLN A 60 1.866 -6.935 64.883 1.00 0.00 ATOM 475 CD GLN A 60 2.749 -6.358 63.793 1.00 0.00 ATOM 476 OE1 GLN A 60 3.973 -6.341 63.917 1.00 0.00 ATOM 477 NE2 GLN A 60 2.128 -5.884 62.720 1.00 0.00 ATOM 478 O GLN A 60 4.411 -10.720 64.693 1.00 0.00 ATOM 479 C GLN A 60 3.217 -10.564 64.943 1.00 0.00 ATOM 480 N SER A 61 2.524 -11.432 65.725 1.00 0.00 ATOM 481 CA SER A 61 3.150 -12.619 66.302 1.00 0.00 ATOM 482 CB SER A 61 2.167 -13.395 67.180 1.00 0.00 ATOM 483 OG SER A 61 1.839 -12.664 68.349 1.00 0.00 ATOM 484 O SER A 61 4.733 -14.077 65.200 1.00 0.00 ATOM 485 C SER A 61 3.618 -13.555 65.169 1.00 0.00 ATOM 486 N GLY A 62 2.782 -13.722 64.071 1.00 0.00 ATOM 487 CA GLY A 62 3.108 -14.572 62.936 1.00 0.00 ATOM 488 O GLY A 62 5.272 -14.736 62.004 1.00 0.00 ATOM 489 C GLY A 62 4.283 -13.978 62.192 1.00 0.00 ATOM 490 N PRO A 63 4.246 -12.649 62.001 1.00 0.00 ATOM 491 CA PRO A 63 5.405 -11.959 61.407 1.00 0.00 ATOM 492 CB PRO A 63 4.936 -10.532 61.242 1.00 0.00 ATOM 493 CG PRO A 63 3.471 -10.656 61.004 1.00 0.00 ATOM 494 CD PRO A 63 3.076 -11.812 61.908 1.00 0.00 ATOM 495 O PRO A 63 7.783 -12.271 61.541 1.00 0.00 ATOM 496 C PRO A 63 6.714 -12.143 62.161 1.00 0.00 ATOM 497 N LEU A 64 6.664 -12.168 63.493 1.00 0.00 ATOM 498 CA LEU A 64 7.842 -12.463 64.307 1.00 0.00 ATOM 499 CB LEU A 64 7.489 -12.424 65.797 1.00 0.00 ATOM 500 CG LEU A 64 8.648 -12.711 66.755 1.00 0.00 ATOM 501 CD1 LEU A 64 9.649 -11.567 66.703 1.00 0.00 ATOM 502 CD2 LEU A 64 8.119 -12.890 68.162 1.00 0.00 ATOM 503 O LEU A 64 9.619 -14.031 63.916 1.00 0.00 ATOM 504 C LEU A 64 8.405 -13.835 63.962 1.00 0.00 ATOM 505 N ASP A 65 7.501 -14.782 63.726 1.00 0.00 ATOM 506 CA ASP A 65 7.959 -16.137 63.392 1.00 0.00 ATOM 507 CB ASP A 65 6.744 -17.028 63.108 1.00 0.00 ATOM 508 CG ASP A 65 5.973 -17.433 64.307 1.00 0.00 ATOM 509 OD1 ASP A 65 6.452 -17.326 65.444 1.00 0.00 ATOM 510 OD2 ASP A 65 4.798 -17.929 64.224 1.00 0.00 ATOM 511 O ASP A 65 9.844 -16.803 62.110 1.00 0.00 ATOM 512 C ASP A 65 8.811 -16.138 62.159 1.00 0.00 ATOM 513 N ASP A 66 8.391 -15.459 61.109 1.00 0.00 ATOM 514 CA ASP A 66 9.116 -15.485 59.868 1.00 0.00 ATOM 515 CB ASP A 66 8.331 -14.808 58.754 1.00 0.00 ATOM 516 CG ASP A 66 7.109 -15.563 58.296 1.00 0.00 ATOM 517 OD1 ASP A 66 7.015 -16.774 58.618 1.00 0.00 ATOM 518 OD2 ASP A 66 6.225 -14.983 57.600 1.00 0.00 ATOM 519 O ASP A 66 11.540 -15.300 59.405 1.00 0.00 ATOM 520 C ASP A 66 10.499 -14.864 59.946 1.00 0.00 ATOM 521 N ILE A 67 10.587 -13.735 60.658 1.00 0.00 ATOM 522 CA ILE A 67 11.873 -13.080 60.840 1.00 0.00 ATOM 523 CB ILE A 67 11.764 -11.695 61.441 1.00 0.00 ATOM 524 CG1 ILE A 67 10.960 -10.775 60.535 1.00 0.00 ATOM 525 CG2 ILE A 67 13.161 -11.145 61.748 1.00 0.00 ATOM 526 CD1 ILE A 67 10.720 -9.428 61.157 1.00 0.00 ATOM 527 O ILE A 67 13.983 -14.120 61.341 1.00 0.00 ATOM 528 C ILE A 67 12.809 -13.926 61.669 1.00 0.00 ATOM 529 N ASP A 68 12.305 -14.490 62.769 1.00 0.00 ATOM 530 CA ASP A 68 13.129 -15.378 63.601 1.00 0.00 ATOM 531 CB ASP A 68 12.302 -15.950 64.755 1.00 0.00 ATOM 532 CG ASP A 68 13.136 -16.777 65.714 1.00 0.00 ATOM 533 OD1 ASP A 68 14.065 -16.214 66.330 1.00 0.00 ATOM 534 OD2 ASP A 68 12.859 -17.987 65.851 1.00 0.00 ATOM 535 O ASP A 68 14.824 -16.925 62.895 1.00 0.00 ATOM 536 C ASP A 68 13.652 -16.539 62.767 1.00 0.00 ATOM 537 N VAL A 69 12.819 -17.060 61.861 1.00 0.00 ATOM 538 CA VAL A 69 13.265 -18.150 60.951 1.00 0.00 ATOM 539 CB VAL A 69 12.079 -18.746 60.201 1.00 0.00 ATOM 540 CG1 VAL A 69 12.595 -19.874 59.324 1.00 0.00 ATOM 541 CG2 VAL A 69 11.039 -19.245 61.165 1.00 0.00 ATOM 542 O VAL A 69 15.303 -18.350 59.725 1.00 0.00 ATOM 543 C VAL A 69 14.338 -17.651 59.989 1.00 0.00 ATOM 544 N ALA A 70 14.178 -16.431 59.459 1.00 0.00 ATOM 545 CA ALA A 70 15.159 -15.864 58.548 1.00 0.00 ATOM 546 CB ALA A 70 14.657 -14.557 57.961 1.00 0.00 ATOM 547 O ALA A 70 17.558 -16.034 58.722 1.00 0.00 ATOM 548 C ALA A 70 16.490 -15.669 59.268 1.00 0.00 ATOM 549 N LEU A 71 16.501 -15.095 60.464 1.00 0.00 ATOM 550 CA LEU A 71 17.706 -14.906 61.257 1.00 0.00 ATOM 551 CB LEU A 71 17.412 -14.097 62.522 1.00 0.00 ATOM 552 CG LEU A 71 17.070 -12.622 62.286 1.00 0.00 ATOM 553 CD1 LEU A 71 16.545 -12.000 63.568 1.00 0.00 ATOM 554 CD2 LEU A 71 18.310 -11.880 61.799 1.00 0.00 ATOM 555 O LEU A 71 19.552 -16.419 61.540 1.00 0.00 ATOM 556 C LEU A 71 18.324 -16.272 61.547 1.00 0.00 ATOM 557 N ARG A 72 17.478 -17.321 61.784 1.00 0.00 ATOM 558 CA ARG A 72 17.973 -18.681 62.013 1.00 0.00 ATOM 559 CB ARG A 72 16.802 -19.614 62.304 1.00 0.00 ATOM 560 CG ARG A 72 17.104 -21.087 62.444 1.00 0.00 ATOM 561 CD ARG A 72 15.946 -21.851 63.077 1.00 0.00 ATOM 562 NE ARG A 72 14.681 -21.819 62.337 1.00 0.00 ATOM 563 CZ ARG A 72 14.418 -22.611 61.314 1.00 0.00 ATOM 564 NH1 ARG A 72 15.258 -23.487 60.781 1.00 0.00 ATOM 565 NH2 ARG A 72 13.169 -22.527 60.800 1.00 0.00 ATOM 566 O ARG A 72 19.971 -19.655 61.083 1.00 0.00 ATOM 567 C ARG A 72 18.834 -19.207 60.867 1.00 0.00 ATOM 568 N LEU A 73 18.312 -19.124 59.653 1.00 0.00 ATOM 569 CA LEU A 73 19.025 -19.612 58.489 1.00 0.00 ATOM 570 CB LEU A 73 18.157 -19.480 57.235 1.00 0.00 ATOM 571 CG LEU A 73 16.933 -20.395 57.161 1.00 0.00 ATOM 572 CD1 LEU A 73 16.074 -20.044 55.953 1.00 0.00 ATOM 573 CD2 LEU A 73 17.355 -21.850 57.037 1.00 0.00 ATOM 574 O LEU A 73 21.289 -19.413 57.722 1.00 0.00 ATOM 575 C LEU A 73 20.320 -18.847 58.240 1.00 0.00 ATOM 576 N ILE A 74 20.349 -17.553 58.614 1.00 0.00 ATOM 577 CA ILE A 74 21.582 -16.739 58.494 1.00 0.00 ATOM 578 CB ILE A 74 21.246 -15.263 58.184 1.00 0.00 ATOM 579 CG1 ILE A 74 20.316 -14.698 59.262 1.00 0.00 ATOM 580 CG2 ILE A 74 20.591 -15.165 56.809 1.00 0.00 ATOM 581 CD1 ILE A 74 20.107 -13.201 59.170 1.00 0.00 ATOM 582 O ILE A 74 23.679 -16.382 59.659 1.00 0.00 ATOM 583 C ILE A 74 22.537 -16.889 59.687 1.00 0.00 ATOM 584 N TYR A 75 22.050 -17.551 60.734 1.00 0.00 ATOM 585 CA TYR A 75 22.807 -17.688 61.974 1.00 0.00 ATOM 586 CB TYR A 75 24.147 -18.368 61.690 1.00 0.00 ATOM 587 CG TYR A 75 24.017 -19.727 61.039 1.00 0.00 ATOM 588 CD1 TYR A 75 24.285 -19.896 59.686 1.00 0.00 ATOM 589 CD2 TYR A 75 23.629 -20.837 61.780 1.00 0.00 ATOM 590 CE1 TYR A 75 24.170 -21.135 59.084 1.00 0.00 ATOM 591 CE2 TYR A 75 23.507 -22.081 61.194 1.00 0.00 ATOM 592 CZ TYR A 75 23.782 -22.224 59.834 1.00 0.00 ATOM 593 OH TYR A 75 23.667 -23.458 59.236 1.00 0.00 ATOM 594 O TYR A 75 24.235 -16.127 63.085 1.00 0.00 ATOM 595 C TYR A 75 23.103 -16.346 62.610 1.00 0.00 ATOM 596 N ALA A 76 22.130 -15.436 62.629 1.00 0.00 ATOM 597 CA ALA A 76 22.257 -14.083 63.120 1.00 0.00 ATOM 598 CB ALA A 76 22.037 -13.139 61.985 1.00 0.00 ATOM 599 O ALA A 76 19.957 -13.913 63.725 1.00 0.00 ATOM 600 C ALA A 76 21.118 -13.846 64.079 1.00 0.00 ATOM 601 N LEU A 77 21.451 -13.561 65.357 1.00 0.00 ATOM 602 CA LEU A 77 20.465 -13.406 66.405 1.00 0.00 ATOM 603 CB LEU A 77 20.591 -14.601 67.378 1.00 0.00 ATOM 604 CG LEU A 77 20.320 -15.978 66.739 1.00 0.00 ATOM 605 CD1 LEU A 77 20.656 -17.080 67.680 1.00 0.00 ATOM 606 CD2 LEU A 77 18.858 -16.110 66.289 1.00 0.00 ATOM 607 O LEU A 77 21.822 -11.636 67.321 1.00 0.00 ATOM 608 C LEU A 77 20.716 -12.121 67.191 1.00 0.00 ATOM 609 N GLY A 78 19.639 -11.558 67.732 1.00 0.00 ATOM 610 CA GLY A 78 19.758 -10.479 68.675 1.00 0.00 ATOM 611 O GLY A 78 20.582 -8.265 68.810 1.00 0.00 ATOM 612 C GLY A 78 20.108 -9.128 68.086 1.00 0.00 ATOM 613 N LYS A 79 20.424 -7.376 68.182 1.00 0.00 ATOM 614 CA LYS A 79 21.642 -6.636 67.964 1.00 0.00 ATOM 615 CB LYS A 79 22.648 -7.856 67.501 1.00 0.00 ATOM 616 CG LYS A 79 22.943 -8.872 68.653 1.00 0.00 ATOM 617 CD LYS A 79 23.938 -9.917 68.250 1.00 0.00 ATOM 618 CE LYS A 79 24.432 -10.683 69.501 1.00 0.00 ATOM 619 NZ LYS A 79 25.151 -11.883 69.082 1.00 0.00 ATOM 620 O LYS A 79 21.558 -4.289 68.462 1.00 0.00 ATOM 621 C LYS A 79 21.256 -5.198 67.685 1.00 0.00 ATOM 622 N MET A 80 20.635 -4.929 66.545 1.00 0.00 ATOM 623 CA MET A 80 20.269 -3.557 66.203 1.00 0.00 ATOM 624 CB MET A 80 20.218 -3.478 64.677 1.00 0.00 ATOM 625 CG MET A 80 21.521 -3.857 63.991 1.00 0.00 ATOM 626 SD MET A 80 22.860 -2.708 64.361 1.00 0.00 ATOM 627 CE MET A 80 22.322 -1.258 63.457 1.00 0.00 ATOM 628 O MET A 80 17.959 -3.677 66.735 1.00 0.00 ATOM 629 C MET A 80 18.991 -2.999 66.800 1.00 0.00 ATOM 630 N ASP A 81 19.057 -1.815 67.424 1.00 0.00 ATOM 631 CA ASP A 81 17.858 -1.097 67.831 1.00 0.00 ATOM 632 CB ASP A 81 18.070 -0.417 69.185 1.00 0.00 ATOM 633 CG ASP A 81 18.130 -1.406 70.331 1.00 0.00 ATOM 634 OD1 ASP A 81 17.792 -2.589 70.115 1.00 0.00 ATOM 635 OD2 ASP A 81 18.514 -0.998 71.449 1.00 0.00 ATOM 636 O ASP A 81 18.344 0.588 66.200 1.00 0.00 ATOM 637 C ASP A 81 17.468 -0.010 66.812 1.00 0.00 ATOM 638 N LYS A 82 16.211 0.185 66.610 1.00 0.00 ATOM 639 CA LYS A 82 15.716 1.230 65.695 1.00 0.00 ATOM 640 CB LYS A 82 15.183 1.024 64.514 1.00 0.00 ATOM 641 CG LYS A 82 14.324 2.193 64.041 1.00 0.00 ATOM 642 CD LYS A 82 14.249 2.309 62.525 1.00 0.00 ATOM 643 CE LYS A 82 15.578 2.775 61.927 1.00 0.00 ATOM 644 NZ LYS A 82 15.428 3.139 60.506 1.00 0.00 ATOM 645 O LYS A 82 14.227 2.420 67.158 1.00 0.00 ATOM 646 C LYS A 82 15.209 2.475 66.413 1.00 0.00 ATOM 647 N TRP A 83 15.950 3.646 66.172 1.00 0.00 ATOM 648 CA TRP A 83 15.652 4.918 66.821 1.00 0.00 ATOM 649 CB TRP A 83 16.835 5.936 66.232 1.00 0.00 ATOM 650 CG TRP A 83 18.215 5.391 66.037 1.00 0.00 ATOM 651 CD1 TRP A 83 19.178 5.255 66.994 1.00 0.00 ATOM 652 CD2 TRP A 83 18.827 4.948 64.809 1.00 0.00 ATOM 653 CE2 TRP A 83 20.121 4.504 65.123 1.00 0.00 ATOM 654 CE3 TRP A 83 18.381 4.790 63.495 1.00 0.00 ATOM 655 NE1 TRP A 83 20.316 4.722 66.456 1.00 0.00 ATOM 656 CZ2 TRP A 83 20.986 4.019 64.166 1.00 0.00 ATOM 657 CZ3 TRP A 83 19.236 4.283 62.565 1.00 0.00 ATOM 658 CH2 TRP A 83 20.530 3.933 62.889 1.00 0.00 ATOM 659 O TRP A 83 13.610 6.192 66.727 1.00 0.00 ATOM 660 C TRP A 83 14.401 5.487 66.103 1.00 0.00 ATOM 661 N LEU A 84 14.199 5.149 64.833 1.00 0.00 ATOM 662 CA LEU A 84 13.013 5.623 64.119 1.00 0.00 ATOM 663 CB LEU A 84 13.061 5.191 62.653 1.00 0.00 ATOM 664 CG LEU A 84 11.871 5.603 61.784 1.00 0.00 ATOM 665 CD1 LEU A 84 11.755 7.117 61.716 1.00 0.00 ATOM 666 CD2 LEU A 84 12.030 5.074 60.367 1.00 0.00 ATOM 667 O LEU A 84 10.828 5.890 65.102 1.00 0.00 ATOM 668 C LEU A 84 11.733 5.100 64.775 1.00 0.00 ATOM 669 N TYR A 85 11.617 3.769 64.979 1.00 0.00 ATOM 670 CA TYR A 85 10.399 3.211 65.559 1.00 0.00 ATOM 671 CB TYR A 85 10.419 1.681 65.561 1.00 0.00 ATOM 672 CG TYR A 85 9.164 1.052 66.123 1.00 0.00 ATOM 673 CD1 TYR A 85 7.989 1.028 65.382 1.00 0.00 ATOM 674 CD2 TYR A 85 9.157 0.486 67.391 1.00 0.00 ATOM 675 CE1 TYR A 85 6.836 0.456 65.886 1.00 0.00 ATOM 676 CE2 TYR A 85 8.014 -0.092 67.912 1.00 0.00 ATOM 677 CZ TYR A 85 6.849 -0.102 67.146 1.00 0.00 ATOM 678 OH TYR A 85 5.702 -0.671 67.651 1.00 0.00 ATOM 679 O TYR A 85 9.156 3.999 67.442 1.00 0.00 ATOM 680 C TYR A 85 10.254 3.708 66.998 1.00 0.00 ATOM 681 N ALA A 86 11.370 3.804 67.697 1.00 0.00 ATOM 682 CA ALA A 86 11.325 4.259 69.080 1.00 0.00 ATOM 683 CB ALA A 86 12.728 4.182 69.668 1.00 0.00 ATOM 684 O ALA A 86 9.965 5.923 70.100 1.00 0.00 ATOM 685 C ALA A 86 10.733 5.657 69.196 1.00 0.00 ATOM 686 N ASP A 87 11.103 6.528 68.285 1.00 0.00 ATOM 687 CA ASP A 87 10.592 7.893 68.289 1.00 0.00 ATOM 688 CB ASP A 87 11.411 8.784 67.368 1.00 0.00 ATOM 689 CG ASP A 87 12.736 9.222 67.935 1.00 0.00 ATOM 690 OD1 ASP A 87 13.091 8.845 69.070 1.00 0.00 ATOM 691 OD2 ASP A 87 13.415 9.974 67.207 1.00 0.00 ATOM 692 O ASP A 87 8.336 8.677 68.584 1.00 0.00 ATOM 693 C ASP A 87 9.113 7.946 67.942 1.00 0.00 ATOM 694 N ILE A 88 8.677 7.147 66.967 1.00 0.00 ATOM 695 CA ILE A 88 7.250 7.073 66.663 1.00 0.00 ATOM 696 CB ILE A 88 6.989 6.158 65.449 1.00 0.00 ATOM 697 CG1 ILE A 88 7.524 6.789 64.168 1.00 0.00 ATOM 698 CG2 ILE A 88 5.512 5.847 65.320 1.00 0.00 ATOM 699 CD1 ILE A 88 6.766 8.000 63.637 1.00 0.00 ATOM 700 O ILE A 88 5.397 7.034 68.212 1.00 0.00 ATOM 701 C ILE A 88 6.462 6.540 67.852 1.00 0.00 ATOM 702 N THR A 89 7.016 5.526 68.537 1.00 0.00 ATOM 703 CA THR A 89 6.363 4.915 69.682 1.00 0.00 ATOM 704 CB THR A 89 7.214 3.746 70.210 1.00 0.00 ATOM 705 CG2 THR A 89 6.732 3.209 71.539 1.00 0.00 ATOM 706 OG1 THR A 89 7.152 2.712 69.209 1.00 0.00 ATOM 707 O THR A 89 5.047 6.028 71.348 1.00 0.00 ATOM 708 C THR A 89 6.119 5.952 70.767 1.00 0.00 ATOM 709 N HIS A 90 7.158 6.736 71.096 1.00 0.00 ATOM 710 CA HIS A 90 7.005 7.782 72.108 1.00 0.00 ATOM 711 CB HIS A 90 8.342 8.436 72.458 1.00 0.00 ATOM 712 CG HIS A 90 9.278 7.537 73.204 1.00 0.00 ATOM 713 CD2 HIS A 90 9.159 6.266 73.905 1.00 0.00 ATOM 714 ND1 HIS A 90 10.617 7.823 73.366 1.00 0.00 ATOM 715 CE1 HIS A 90 11.194 6.836 74.075 1.00 0.00 ATOM 716 NE2 HIS A 90 10.324 5.898 74.401 1.00 0.00 ATOM 717 O HIS A 90 5.271 9.394 72.441 1.00 0.00 ATOM 718 C HIS A 90 6.028 8.887 71.639 1.00 0.00 ATOM 719 N PHE A 91 6.054 9.248 70.361 1.00 0.00 ATOM 720 CA PHE A 91 5.053 10.192 69.818 1.00 0.00 ATOM 721 CB PHE A 91 5.293 10.432 68.326 1.00 0.00 ATOM 722 CG PHE A 91 6.551 11.197 68.029 1.00 0.00 ATOM 723 CD1 PHE A 91 7.210 11.889 69.031 1.00 0.00 ATOM 724 CD2 PHE A 91 7.077 11.222 66.750 1.00 0.00 ATOM 725 CE1 PHE A 91 8.369 12.592 68.758 1.00 0.00 ATOM 726 CE2 PHE A 91 8.235 11.926 66.477 1.00 0.00 ATOM 727 CZ PHE A 91 8.881 12.609 67.474 1.00 0.00 ATOM 728 O PHE A 91 2.726 10.354 70.438 1.00 0.00 ATOM 729 C PHE A 91 3.640 9.617 70.016 1.00 0.00 ATOM 730 N SER A 92 3.453 8.331 69.725 1.00 0.00 ATOM 731 CA SER A 92 2.142 7.702 69.890 1.00 0.00 ATOM 732 CB SER A 92 2.198 6.230 69.476 1.00 0.00 ATOM 733 OG SER A 92 2.454 6.099 68.089 1.00 0.00 ATOM 734 O SER A 92 0.542 8.015 71.663 1.00 0.00 ATOM 735 C SER A 92 1.707 7.755 71.357 1.00 0.00 ATOM 736 N GLN A 93 2.652 7.497 72.289 1.00 0.00 ATOM 737 CA GLN A 93 2.361 7.532 73.717 1.00 0.00 ATOM 738 CB GLN A 93 3.607 7.122 74.505 1.00 0.00 ATOM 739 CG GLN A 93 3.932 5.639 74.426 1.00 0.00 ATOM 740 CD GLN A 93 5.240 5.292 75.106 1.00 0.00 ATOM 741 OE1 GLN A 93 5.959 6.173 75.579 1.00 0.00 ATOM 742 NE2 GLN A 93 5.555 4.002 75.159 1.00 0.00 ATOM 743 O GLN A 93 0.980 9.176 74.845 1.00 0.00 ATOM 744 C GLN A 93 1.985 8.943 74.127 1.00 0.00 ATOM 745 N TYR A 94 2.777 9.917 73.700 1.00 0.00 ATOM 746 CA TYR A 94 2.576 11.336 74.062 1.00 0.00 ATOM 747 CB TYR A 94 3.626 12.217 73.382 1.00 0.00 ATOM 748 CG TYR A 94 3.467 13.693 73.668 1.00 0.00 ATOM 749 CD1 TYR A 94 3.918 14.238 74.863 1.00 0.00 ATOM 750 CD2 TYR A 94 2.867 14.536 72.742 1.00 0.00 ATOM 751 CE1 TYR A 94 3.777 15.585 75.134 1.00 0.00 ATOM 752 CE2 TYR A 94 2.716 15.886 72.996 1.00 0.00 ATOM 753 CZ TYR A 94 3.179 16.408 74.204 1.00 0.00 ATOM 754 OH TYR A 94 3.036 17.750 74.471 1.00 0.00 ATOM 755 O TYR A 94 0.428 12.499 74.334 1.00 0.00 ATOM 756 C TYR A 94 1.183 11.820 73.615 1.00 0.00 ATOM 757 N TRP A 95 0.877 11.498 72.366 1.00 0.00 ATOM 758 CA TRP A 95 -0.366 11.973 71.781 1.00 0.00 ATOM 759 CB TRP A 95 -0.384 11.755 70.248 1.00 0.00 ATOM 760 CG TRP A 95 0.306 12.944 69.652 1.00 0.00 ATOM 761 CD1 TRP A 95 1.634 13.220 69.648 1.00 0.00 ATOM 762 CD2 TRP A 95 -0.352 14.020 68.971 1.00 0.00 ATOM 763 CE2 TRP A 95 0.651 14.923 68.580 1.00 0.00 ATOM 764 CE3 TRP A 95 -1.672 14.277 68.656 1.00 0.00 ATOM 765 NE1 TRP A 95 1.868 14.426 69.008 1.00 0.00 ATOM 766 CZ2 TRP A 95 0.371 16.101 67.891 1.00 0.00 ATOM 767 CZ3 TRP A 95 -1.957 15.460 67.963 1.00 0.00 ATOM 768 CH2 TRP A 95 -0.928 16.336 67.595 1.00 0.00 ATOM 769 O TRP A 95 -2.523 12.011 72.857 1.00 0.00 ATOM 770 C TRP A 95 -1.541 11.332 72.515 1.00 0.00 ATOM 771 N HIS A 96 -1.461 10.035 72.760 1.00 0.00 ATOM 772 CA HIS A 96 -2.551 9.369 73.510 1.00 0.00 ATOM 773 CB HIS A 96 -2.253 7.846 73.667 1.00 0.00 ATOM 774 CG HIS A 96 -3.221 7.128 74.566 1.00 0.00 ATOM 775 CD2 HIS A 96 -3.179 6.865 75.894 1.00 0.00 ATOM 776 ND1 HIS A 96 -4.414 6.607 74.110 1.00 0.00 ATOM 777 CE1 HIS A 96 -5.061 6.046 75.120 1.00 0.00 ATOM 778 NE2 HIS A 96 -4.338 6.194 76.215 1.00 0.00 ATOM 779 O HIS A 96 -3.949 10.185 75.305 1.00 0.00 ATOM 780 C HIS A 96 -2.798 10.044 74.870 1.00 0.00 ATOM 781 N TYR A 97 -1.722 10.475 75.512 1.00 0.00 ATOM 782 CA TYR A 97 -1.828 11.145 76.820 1.00 0.00 ATOM 783 CB TYR A 97 -0.440 11.346 77.433 1.00 0.00 ATOM 784 CG TYR A 97 0.245 10.059 77.833 1.00 0.00 ATOM 785 CD1 TYR A 97 -0.460 8.863 77.881 1.00 0.00 ATOM 786 CD2 TYR A 97 1.594 10.045 78.162 1.00 0.00 ATOM 787 CE1 TYR A 97 0.158 7.683 78.247 1.00 0.00 ATOM 788 CE2 TYR A 97 2.228 8.872 78.529 1.00 0.00 ATOM 789 CZ TYR A 97 1.498 7.687 78.570 1.00 0.00 ATOM 790 OH TYR A 97 2.115 6.513 78.934 1.00 0.00 ATOM 791 O TYR A 97 -2.825 13.097 77.798 1.00 0.00 ATOM 792 C TYR A 97 -2.482 12.519 76.754 1.00 0.00 ATOM 793 N LEU A 98 -2.592 13.095 75.556 1.00 0.00 ATOM 794 CA LEU A 98 -3.165 14.441 75.379 1.00 0.00 ATOM 795 CB LEU A 98 -2.426 15.196 74.271 1.00 0.00 ATOM 796 CG LEU A 98 -0.937 15.456 74.503 1.00 0.00 ATOM 797 CD1 LEU A 98 -0.310 16.117 73.286 1.00 0.00 ATOM 798 CD2 LEU A 98 -0.731 16.371 75.700 1.00 0.00 ATOM 799 O LEU A 98 -5.174 15.505 74.688 1.00 0.00 ATOM 800 C LEU A 98 -4.579 14.450 74.862 1.00 0.00 ATOM 801 N ASN A 99 -5.170 13.160 74.657 1.00 0.00 ATOM 802 CA ASN A 99 -6.545 13.045 74.215 1.00 0.00 ATOM 803 CB ASN A 99 -6.553 11.915 73.182 1.00 0.00 ATOM 804 CG ASN A 99 -5.719 12.238 71.958 1.00 0.00 ATOM 805 ND2 ASN A 99 -5.182 11.205 71.320 1.00 0.00 ATOM 806 OD1 ASN A 99 -5.560 13.404 71.594 1.00 0.00 ATOM 807 O ASN A 99 -7.379 11.941 76.167 1.00 0.00 ATOM 808 C ASN A 99 -7.585 12.806 75.287 1.00 0.00 ATOM 809 N GLU A 100 -8.674 13.551 75.207 1.00 0.00 ATOM 810 CA GLU A 100 -9.748 13.362 76.199 1.00 0.00 ATOM 811 CB GLU A 100 -10.735 14.516 76.017 1.00 0.00 ATOM 812 CG GLU A 100 -10.119 15.909 76.137 1.00 0.00 ATOM 813 CD GLU A 100 -9.503 16.511 74.889 1.00 0.00 ATOM 814 OE1 GLU A 100 -9.201 17.737 74.905 1.00 0.00 ATOM 815 OE2 GLU A 100 -9.290 15.817 73.866 1.00 0.00 ATOM 816 O GLU A 100 -10.891 11.505 77.167 1.00 0.00 ATOM 817 C GLU A 100 -10.387 12.002 76.178 1.00 0.00 ATOM 818 N GLN A 101 -10.411 11.314 75.055 1.00 0.00 ATOM 819 CA GLN A 101 -10.960 9.998 74.935 1.00 0.00 ATOM 820 CB GLN A 101 -11.919 9.956 73.732 1.00 0.00 ATOM 821 CG GLN A 101 -12.946 11.090 73.798 1.00 0.00 ATOM 822 CD GLN A 101 -13.971 10.800 74.869 1.00 0.00 ATOM 823 OE1 GLN A 101 -14.647 9.776 74.764 1.00 0.00 ATOM 824 NE2 GLN A 101 -14.099 11.668 75.861 1.00 0.00 ATOM 825 O GLN A 101 -10.313 7.796 74.548 1.00 0.00 ATOM 826 C GLN A 101 -9.881 8.945 74.665 1.00 0.00 ATOM 827 N ASP A 102 -8.606 9.337 74.623 1.00 0.00 ATOM 828 CA ASP A 102 -7.515 8.416 74.308 1.00 0.00 ATOM 829 CB ASP A 102 -6.803 8.550 75.955 1.00 0.00 ATOM 830 CG ASP A 102 -7.507 7.496 76.796 1.00 0.00 ATOM 831 OD1 ASP A 102 -8.030 6.468 76.274 1.00 0.00 ATOM 832 OD2 ASP A 102 -7.554 7.625 78.043 1.00 0.00 ATOM 833 O ASP A 102 -7.567 6.437 72.948 1.00 0.00 ATOM 834 C ASP A 102 -7.813 7.644 73.038 1.00 0.00 ATOM 835 N GLU A 103 -8.434 8.446 71.887 1.00 0.00 ATOM 836 CA GLU A 103 -8.568 7.939 70.533 1.00 0.00 ATOM 837 CB GLU A 103 -9.828 8.513 69.871 1.00 0.00 ATOM 838 CG GLU A 103 -11.130 8.242 70.635 1.00 0.00 ATOM 839 CD GLU A 103 -12.376 8.644 69.858 1.00 0.00 ATOM 840 OE1 GLU A 103 -12.300 9.597 69.048 1.00 0.00 ATOM 841 OE2 GLU A 103 -13.444 8.018 70.064 1.00 0.00 ATOM 842 O GLU A 103 -7.125 9.282 69.169 1.00 0.00 ATOM 843 C GLU A 103 -7.342 8.172 69.654 1.00 0.00 ATOM 844 N THR A 104 -6.516 7.131 69.525 1.00 0.00 ATOM 845 CA THR A 104 -5.296 7.236 68.730 1.00 0.00 ATOM 846 CB THR A 104 -4.098 6.822 69.584 1.00 0.00 ATOM 847 CG2 THR A 104 -2.823 6.829 68.736 1.00 0.00 ATOM 848 OG1 THR A 104 -3.944 7.755 70.654 1.00 0.00 ATOM 849 O THR A 104 -5.390 5.135 67.539 1.00 0.00 ATOM 850 C THR A 104 -5.370 6.359 67.479 1.00 0.00 ATOM 851 N PRO A 105 -5.395 7.017 66.319 1.00 0.00 ATOM 852 CA PRO A 105 -5.372 6.295 65.046 1.00 0.00 ATOM 853 CB PRO A 105 -5.689 7.391 64.030 1.00 0.00 ATOM 854 CG PRO A 105 -5.053 8.604 64.643 1.00 0.00 ATOM 855 CD PRO A 105 -5.460 8.474 66.098 1.00 0.00 ATOM 856 O PRO A 105 -3.968 4.751 63.854 1.00 0.00 ATOM 857 C PRO A 105 -4.047 5.580 64.759 1.00 0.00 ATOM 858 N GLY A 106 -4.138 7.156 62.780 1.00 0.00 ATOM 859 CA GLY A 106 -3.055 7.835 62.067 1.00 0.00 ATOM 860 O GLY A 106 -0.793 7.075 61.756 1.00 0.00 ATOM 861 C GLY A 106 -1.717 7.304 62.556 1.00 0.00 ATOM 862 N PHE A 107 -1.581 7.088 63.858 1.00 0.00 ATOM 863 CA PHE A 107 -0.283 6.623 64.353 1.00 0.00 ATOM 864 CB PHE A 107 -0.226 6.715 65.879 1.00 0.00 ATOM 865 CG PHE A 107 -0.057 8.117 66.396 1.00 0.00 ATOM 866 CD1 PHE A 107 -1.133 8.813 66.917 1.00 0.00 ATOM 867 CD2 PHE A 107 1.180 8.737 66.361 1.00 0.00 ATOM 868 CE1 PHE A 107 -0.977 10.101 67.392 1.00 0.00 ATOM 869 CE2 PHE A 107 1.336 10.025 66.836 1.00 0.00 ATOM 870 CZ PHE A 107 0.264 10.706 67.351 1.00 0.00 ATOM 871 O PHE A 107 1.141 4.788 63.644 1.00 0.00 ATOM 872 C PHE A 107 -0.008 5.167 63.966 1.00 0.00 ATOM 873 N ALA A 108 -1.065 4.369 63.925 1.00 0.00 ATOM 874 CA ALA A 108 -0.928 2.990 63.459 1.00 0.00 ATOM 875 CB ALA A 108 -2.238 2.238 63.636 1.00 0.00 ATOM 876 O ALA A 108 0.355 2.196 61.604 1.00 0.00 ATOM 877 C ALA A 108 -0.502 2.992 61.993 1.00 0.00 ATOM 878 N ASP A 109 -1.082 3.878 61.191 1.00 0.00 ATOM 879 CA ASP A 109 -0.718 3.964 59.770 1.00 0.00 ATOM 880 CB ASP A 109 -1.580 4.990 59.030 1.00 0.00 ATOM 881 CG ASP A 109 -2.988 4.494 58.776 1.00 0.00 ATOM 882 OD1 ASP A 109 -3.233 3.283 58.955 1.00 0.00 ATOM 883 OD2 ASP A 109 -3.849 5.317 58.398 1.00 0.00 ATOM 884 O ASP A 109 1.460 3.888 58.740 1.00 0.00 ATOM 885 C ASP A 109 0.752 4.400 59.617 1.00 0.00 ATOM 886 N ASP A 110 1.224 5.303 60.471 1.00 0.00 ATOM 887 CA ASP A 110 2.620 5.715 60.398 1.00 0.00 ATOM 888 CB ASP A 110 2.905 6.822 61.414 1.00 0.00 ATOM 889 CG ASP A 110 2.297 8.152 61.013 1.00 0.00 ATOM 890 OD1 ASP A 110 1.863 8.280 59.849 1.00 0.00 ATOM 891 OD2 ASP A 110 2.255 9.066 61.863 1.00 0.00 ATOM 892 O ASP A 110 4.537 4.296 60.043 1.00 0.00 ATOM 893 C ASP A 110 3.516 4.506 60.703 1.00 0.00 ATOM 894 N ILE A 111 3.151 3.726 61.716 1.00 0.00 ATOM 895 CA ILE A 111 3.912 2.485 62.011 1.00 0.00 ATOM 896 CB ILE A 111 3.330 1.743 63.230 1.00 0.00 ATOM 897 CG1 ILE A 111 3.551 2.560 64.504 1.00 0.00 ATOM 898 CG2 ILE A 111 4.005 0.390 63.401 1.00 0.00 ATOM 899 CD1 ILE A 111 2.780 2.042 65.701 1.00 0.00 ATOM 900 O ILE A 111 4.949 0.910 60.484 1.00 0.00 ATOM 901 C ILE A 111 3.911 1.497 60.834 1.00 0.00 ATOM 902 N THR A 112 2.720 1.293 60.198 1.00 0.00 ATOM 903 CA THR A 112 2.668 0.374 59.056 1.00 0.00 ATOM 904 CB THR A 112 1.243 0.270 58.479 1.00 0.00 ATOM 905 CG2 THR A 112 1.227 -0.648 57.266 1.00 0.00 ATOM 906 OG1 THR A 112 0.360 -0.260 59.475 1.00 0.00 ATOM 907 O THR A 112 4.299 0.097 57.298 1.00 0.00 ATOM 908 C THR A 112 3.596 0.880 57.947 1.00 0.00 ATOM 909 N TRP A 113 3.583 2.184 57.732 1.00 0.00 ATOM 910 CA TRP A 113 4.472 2.766 56.675 1.00 0.00 ATOM 911 CB TRP A 113 4.241 4.272 56.548 1.00 0.00 ATOM 912 CG TRP A 113 5.086 4.923 55.496 1.00 0.00 ATOM 913 CD1 TRP A 113 4.805 5.022 54.164 1.00 0.00 ATOM 914 CD2 TRP A 113 6.351 5.567 55.689 1.00 0.00 ATOM 915 CE2 TRP A 113 6.778 6.032 54.429 1.00 0.00 ATOM 916 CE3 TRP A 113 7.165 5.795 56.802 1.00 0.00 ATOM 917 NE1 TRP A 113 5.815 5.687 53.514 1.00 0.00 ATOM 918 CZ2 TRP A 113 7.982 6.711 54.252 1.00 0.00 ATOM 919 CZ3 TRP A 113 8.358 6.469 56.621 1.00 0.00 ATOM 920 CH2 TRP A 113 8.758 6.920 55.359 1.00 0.00 ATOM 921 O TRP A 113 6.721 2.254 56.032 1.00 0.00 ATOM 922 C TRP A 113 5.956 2.570 56.953 1.00 0.00 ATOM 923 N ASP A 114 6.363 2.688 58.220 1.00 0.00 ATOM 924 CA ASP A 114 7.762 2.362 58.599 1.00 0.00 ATOM 925 CB ASP A 114 7.627 2.056 60.241 1.00 0.00 ATOM 926 CG ASP A 114 8.809 2.421 61.121 1.00 0.00 ATOM 927 OD1 ASP A 114 8.872 3.603 61.542 1.00 0.00 ATOM 928 OD2 ASP A 114 9.654 1.554 61.345 1.00 0.00 ATOM 929 O ASP A 114 9.131 0.613 57.673 1.00 0.00 ATOM 930 C ASP A 114 8.075 0.905 58.273 1.00 0.00 ATOM 931 N PHE A 115 7.194 0.015 58.717 1.00 0.00 ATOM 932 CA PHE A 115 7.418 -1.407 58.481 1.00 0.00 ATOM 933 CB PHE A 115 6.308 -2.239 59.126 1.00 0.00 ATOM 934 CG PHE A 115 6.340 -2.232 60.627 1.00 0.00 ATOM 935 CD1 PHE A 115 7.464 -1.800 61.308 1.00 0.00 ATOM 936 CD2 PHE A 115 5.246 -2.660 61.358 1.00 0.00 ATOM 937 CE1 PHE A 115 7.493 -1.794 62.690 1.00 0.00 ATOM 938 CE2 PHE A 115 5.274 -2.654 62.740 1.00 0.00 ATOM 939 CZ PHE A 115 6.391 -2.224 63.406 1.00 0.00 ATOM 940 O PHE A 115 8.245 -2.523 56.545 1.00 0.00 ATOM 941 C PHE A 115 7.437 -1.708 56.983 1.00 0.00 ATOM 942 N ILE A 116 6.556 -1.086 56.208 1.00 0.00 ATOM 943 CA ILE A 116 6.547 -1.280 54.749 1.00 0.00 ATOM 944 CB ILE A 116 5.416 -0.476 54.080 1.00 0.00 ATOM 945 CG1 ILE A 116 4.051 -1.043 54.478 1.00 0.00 ATOM 946 CG2 ILE A 116 5.542 -0.538 52.566 1.00 0.00 ATOM 947 CD1 ILE A 116 2.886 -0.161 54.085 1.00 0.00 ATOM 948 O ILE A 116 8.441 -1.526 53.310 1.00 0.00 ATOM 949 C ILE A 116 7.874 -0.819 54.156 1.00 0.00 ATOM 950 N SER A 117 8.384 0.329 54.607 1.00 0.00 ATOM 951 CA SER A 117 9.697 0.802 54.112 1.00 0.00 ATOM 952 CB SER A 117 10.085 2.117 54.793 1.00 0.00 ATOM 953 OG SER A 117 9.208 3.164 54.414 1.00 0.00 ATOM 954 O SER A 117 11.561 -0.671 53.529 1.00 0.00 ATOM 955 C SER A 117 10.790 -0.250 54.413 1.00 0.00 ATOM 956 N ASN A 118 10.852 -0.706 55.662 1.00 0.00 ATOM 957 CA ASN A 118 11.915 -1.628 56.076 1.00 0.00 ATOM 958 CB ASN A 118 11.876 -1.845 57.589 1.00 0.00 ATOM 959 CG ASN A 118 12.362 -0.638 58.364 1.00 0.00 ATOM 960 ND2 ASN A 118 11.980 -0.557 59.633 1.00 0.00 ATOM 961 OD1 ASN A 118 13.074 0.211 57.828 1.00 0.00 ATOM 962 O ASN A 118 12.839 -3.553 55.067 1.00 0.00 ATOM 963 C ASN A 118 11.827 -2.998 55.489 1.00 0.00 ATOM 964 N VAL A 119 10.579 -3.568 55.336 1.00 0.00 ATOM 965 CA VAL A 119 10.415 -4.875 54.727 1.00 0.00 ATOM 966 CB VAL A 119 9.039 -5.473 54.982 1.00 0.00 ATOM 967 CG1 VAL A 119 8.918 -6.816 54.243 1.00 0.00 ATOM 968 CG2 VAL A 119 8.845 -5.687 56.453 1.00 0.00 ATOM 969 O VAL A 119 11.447 -5.723 52.732 1.00 0.00 ATOM 970 C VAL A 119 10.798 -4.823 53.248 1.00 0.00 ATOM 971 N ASN A 120 10.401 -3.742 52.579 1.00 0.00 ATOM 972 CA ASN A 120 10.721 -3.589 51.166 1.00 0.00 ATOM 973 CB ASN A 120 10.172 -2.270 50.620 1.00 0.00 ATOM 974 CG ASN A 120 8.667 -2.295 50.440 1.00 0.00 ATOM 975 ND2 ASN A 120 8.061 -1.116 50.361 1.00 0.00 ATOM 976 OD1 ASN A 120 8.058 -3.363 50.373 1.00 0.00 ATOM 977 O ASN A 120 12.791 -4.287 50.057 1.00 0.00 ATOM 978 C ASN A 120 12.236 -3.590 50.960 1.00 0.00 ATOM 979 N SER A 121 12.931 -2.815 51.785 1.00 0.00 ATOM 980 CA SER A 121 14.404 -2.763 51.742 1.00 0.00 ATOM 981 CB SER A 121 14.936 -1.791 52.797 1.00 0.00 ATOM 982 OG SER A 121 14.564 -0.457 52.497 1.00 0.00 ATOM 983 O SER A 121 15.910 -4.601 51.251 1.00 0.00 ATOM 984 C SER A 121 15.026 -4.133 52.011 1.00 0.00 ATOM 985 N ILE A 122 14.556 -4.813 53.059 1.00 0.00 ATOM 986 CA ILE A 122 15.163 -6.080 53.467 1.00 0.00 ATOM 987 CB ILE A 122 14.578 -6.583 54.799 1.00 0.00 ATOM 988 CG1 ILE A 122 14.983 -5.653 55.946 1.00 0.00 ATOM 989 CG2 ILE A 122 15.087 -7.982 55.112 1.00 0.00 ATOM 990 CD1 ILE A 122 14.243 -5.918 57.238 1.00 0.00 ATOM 991 O ILE A 122 15.868 -7.919 52.128 1.00 0.00 ATOM 992 C ILE A 122 14.973 -7.124 52.410 1.00 0.00 ATOM 993 N THR A 123 13.782 -7.153 51.789 1.00 0.00 ATOM 994 CA THR A 123 13.457 -8.099 50.730 1.00 0.00 ATOM 995 CB THR A 123 12.042 -7.876 50.165 1.00 0.00 ATOM 996 CG2 THR A 123 11.776 -8.823 49.006 1.00 0.00 ATOM 997 OG1 THR A 123 11.072 -8.115 51.191 1.00 0.00 ATOM 998 O THR A 123 15.007 -8.899 49.031 1.00 0.00 ATOM 999 C THR A 123 14.467 -7.898 49.593 1.00 0.00 ATOM 1000 N ARG A 124 14.675 -6.655 49.192 1.00 0.00 ATOM 1001 CA ARG A 124 15.597 -6.394 48.066 1.00 0.00 ATOM 1002 CB ARG A 124 15.657 -4.897 47.758 1.00 0.00 ATOM 1003 CG ARG A 124 14.391 -4.343 47.123 1.00 0.00 ATOM 1004 CD ARG A 124 14.492 -2.841 46.912 1.00 0.00 ATOM 1005 NE ARG A 124 13.272 -2.288 46.328 1.00 0.00 ATOM 1006 CZ ARG A 124 13.069 -0.994 46.108 1.00 0.00 ATOM 1007 NH1 ARG A 124 11.929 -0.581 45.574 1.00 0.00 ATOM 1008 NH2 ARG A 124 14.008 -0.112 46.427 1.00 0.00 ATOM 1009 O ARG A 124 17.621 -7.559 47.550 1.00 0.00 ATOM 1010 C ARG A 124 17.005 -6.894 48.392 1.00 0.00 ATOM 1011 N ASN A 125 17.494 -6.637 49.601 1.00 0.00 ATOM 1012 CA ASN A 125 18.808 -7.109 50.036 1.00 0.00 ATOM 1013 CB ASN A 125 19.154 -6.573 51.429 1.00 0.00 ATOM 1014 CG ASN A 125 19.601 -5.149 51.537 1.00 0.00 ATOM 1015 ND2 ASN A 125 19.622 -4.477 50.438 1.00 0.00 ATOM 1016 OD1 ASN A 125 19.940 -4.661 52.661 1.00 0.00 ATOM 1017 O ASN A 125 19.903 -9.217 49.651 1.00 0.00 ATOM 1018 C ASN A 125 18.906 -8.631 50.104 1.00 0.00 ATOM 1019 N ALA A 126 17.860 -9.256 50.645 1.00 0.00 ATOM 1020 CA ALA A 126 17.820 -10.719 50.762 1.00 0.00 ATOM 1021 CB ALA A 126 16.578 -11.180 51.509 1.00 0.00 ATOM 1022 O ALA A 126 18.501 -12.371 49.173 1.00 0.00 ATOM 1023 C ALA A 126 17.809 -11.369 49.371 1.00 0.00 ATOM 1024 N THR A 127 17.081 -10.775 48.432 1.00 0.00 ATOM 1025 CA THR A 127 17.044 -11.274 47.040 1.00 0.00 ATOM 1026 CB THR A 127 16.071 -10.455 46.173 1.00 0.00 ATOM 1027 CG2 THR A 127 16.081 -10.960 44.738 1.00 0.00 ATOM 1028 OG1 THR A 127 14.742 -10.575 46.698 1.00 0.00 ATOM 1029 O THR A 127 18.934 -12.149 45.827 1.00 0.00 ATOM 1030 C THR A 127 18.458 -11.170 46.425 1.00 0.00 ATOM 1031 N LEU A 128 19.096 -9.996 46.577 1.00 0.00 ATOM 1032 CA LEU A 128 20.431 -9.784 46.035 1.00 0.00 ATOM 1033 CB LEU A 128 20.924 -8.374 46.364 1.00 0.00 ATOM 1034 CG LEU A 128 20.202 -7.221 45.662 1.00 0.00 ATOM 1035 CD1 LEU A 128 20.677 -5.881 46.203 1.00 0.00 ATOM 1036 CD2 LEU A 128 20.468 -7.253 44.166 1.00 0.00 ATOM 1037 O LEU A 128 22.405 -11.165 45.936 1.00 0.00 ATOM 1038 C LEU A 128 21.446 -10.774 46.611 1.00 0.00 ATOM 1039 N TYR A 129 21.235 -11.177 47.871 1.00 0.00 ATOM 1040 CA TYR A 129 22.124 -12.113 48.548 1.00 0.00 ATOM 1041 CB TYR A 129 22.621 -11.444 49.926 1.00 0.00 ATOM 1042 CG TYR A 129 23.951 -11.891 50.501 1.00 0.00 ATOM 1043 CD1 TYR A 129 25.087 -11.865 49.728 1.00 0.00 ATOM 1044 CD2 TYR A 129 24.125 -12.305 51.829 1.00 0.00 ATOM 1045 CE1 TYR A 129 26.304 -12.253 50.237 1.00 0.00 ATOM 1046 CE2 TYR A 129 25.338 -12.691 52.346 1.00 0.00 ATOM 1047 CZ TYR A 129 26.447 -12.662 51.545 1.00 0.00 ATOM 1048 OH TYR A 129 27.665 -13.056 52.055 1.00 0.00 ATOM 1049 O TYR A 129 22.105 -14.415 49.247 1.00 0.00 ATOM 1050 C TYR A 129 21.627 -13.557 48.497 1.00 0.00 ATOM 1051 N ASP A 130 20.721 -13.825 47.552 1.00 0.00 ATOM 1052 CA ASP A 130 20.316 -15.203 47.270 1.00 0.00 ATOM 1053 CB ASP A 130 21.592 -15.993 46.971 1.00 0.00 ATOM 1054 CG ASP A 130 22.381 -15.411 45.814 1.00 0.00 ATOM 1055 OD1 ASP A 130 21.768 -15.117 44.766 1.00 0.00 ATOM 1056 OD2 ASP A 130 23.611 -15.249 45.956 1.00 0.00 ATOM 1057 O ASP A 130 19.506 -17.208 48.264 1.00 0.00 ATOM 1058 C ASP A 130 19.572 -15.994 48.337 1.00 0.00 ATOM 1059 N ALA A 131 18.963 -15.310 49.302 1.00 0.00 ATOM 1060 CA ALA A 131 18.280 -15.975 50.408 1.00 0.00 ATOM 1061 CB ALA A 131 18.393 -15.109 51.638 1.00 0.00 ATOM 1062 O ALA A 131 15.988 -15.308 50.447 1.00 0.00 ATOM 1063 C ALA A 131 16.788 -16.150 50.072 1.00 0.00 ATOM 1064 N LEU A 132 16.438 -17.173 49.379 1.00 0.00 ATOM 1065 CA LEU A 132 15.094 -17.349 48.807 1.00 0.00 ATOM 1066 CB LEU A 132 14.983 -18.622 47.966 1.00 0.00 ATOM 1067 CG LEU A 132 15.680 -18.599 46.605 1.00 0.00 ATOM 1068 CD1 LEU A 132 15.645 -19.976 45.960 1.00 0.00 ATOM 1069 CD2 LEU A 132 14.996 -17.617 45.667 1.00 0.00 ATOM 1070 O LEU A 132 13.025 -16.784 49.878 1.00 0.00 ATOM 1071 C LEU A 132 14.082 -17.453 49.932 1.00 0.00 ATOM 1072 N LYS A 133 14.367 -18.265 50.959 1.00 0.00 ATOM 1073 CA LYS A 133 13.381 -18.436 52.014 1.00 0.00 ATOM 1074 CB LYS A 133 13.834 -19.521 52.994 1.00 0.00 ATOM 1075 CG LYS A 133 13.819 -20.926 52.416 1.00 0.00 ATOM 1076 CD LYS A 133 14.275 -21.951 53.441 1.00 0.00 ATOM 1077 CE LYS A 133 14.292 -23.352 52.852 1.00 0.00 ATOM 1078 NZ LYS A 133 14.759 -24.363 53.840 1.00 0.00 ATOM 1079 O LYS A 133 12.071 -16.852 53.219 1.00 0.00 ATOM 1080 C LYS A 133 13.183 -17.135 52.781 1.00 0.00 ATOM 1081 N ALA A 134 14.290 -16.453 53.077 1.00 0.00 ATOM 1082 CA ALA A 134 14.196 -15.188 53.778 1.00 0.00 ATOM 1083 CB ALA A 134 15.580 -14.587 53.976 1.00 0.00 ATOM 1084 O ALA A 134 12.553 -13.447 53.611 1.00 0.00 ATOM 1085 C ALA A 134 13.315 -14.203 53.013 1.00 0.00 ATOM 1086 N MET A 135 13.442 -14.194 51.676 1.00 0.00 ATOM 1087 CA MET A 135 12.641 -13.310 50.834 1.00 0.00 ATOM 1088 CB MET A 135 12.973 -13.507 49.353 1.00 0.00 ATOM 1089 CG MET A 135 12.091 -12.708 48.408 1.00 0.00 ATOM 1090 SD MET A 135 12.469 -13.020 46.673 1.00 0.00 ATOM 1091 CE MET A 135 11.808 -14.673 46.475 1.00 0.00 ATOM 1092 O MET A 135 10.343 -12.775 51.219 1.00 0.00 ATOM 1093 C MET A 135 11.165 -13.678 51.051 1.00 0.00 ATOM 1094 N LYS A 136 10.825 -14.981 51.043 1.00 0.00 ATOM 1095 CA LYS A 136 9.452 -15.395 51.257 1.00 0.00 ATOM 1096 CB LYS A 136 9.335 -16.919 51.188 1.00 0.00 ATOM 1097 CG LYS A 136 7.916 -17.440 51.350 1.00 0.00 ATOM 1098 CD LYS A 136 7.863 -18.953 51.199 1.00 0.00 ATOM 1099 CE LYS A 136 6.453 -19.479 51.410 1.00 0.00 ATOM 1100 NZ LYS A 136 6.390 -20.963 51.290 1.00 0.00 ATOM 1101 O LYS A 136 7.816 -14.421 52.684 1.00 0.00 ATOM 1102 C LYS A 136 8.907 -14.957 52.611 1.00 0.00 ATOM 1103 N PHE A 137 9.662 -15.218 53.684 1.00 0.00 ATOM 1104 CA PHE A 137 9.225 -14.867 55.042 1.00 0.00 ATOM 1105 CB PHE A 137 10.263 -15.245 56.081 1.00 0.00 ATOM 1106 CG PHE A 137 10.484 -16.732 56.210 1.00 0.00 ATOM 1107 CD1 PHE A 137 9.490 -17.642 55.846 1.00 0.00 ATOM 1108 CD2 PHE A 137 11.669 -17.222 56.750 1.00 0.00 ATOM 1109 CE1 PHE A 137 9.675 -19.016 56.023 1.00 0.00 ATOM 1110 CE2 PHE A 137 11.865 -18.593 56.931 1.00 0.00 ATOM 1111 CZ PHE A 137 10.864 -19.491 56.568 1.00 0.00 ATOM 1112 O PHE A 137 7.959 -12.914 55.630 1.00 0.00 ATOM 1113 C PHE A 137 8.991 -13.356 55.131 1.00 0.00 ATOM 1114 N ALA A 138 9.956 -12.583 54.640 1.00 0.00 ATOM 1115 CA ALA A 138 9.838 -11.115 54.694 1.00 0.00 ATOM 1116 CB ALA A 138 11.112 -10.460 54.183 1.00 0.00 ATOM 1117 O ALA A 138 7.976 -9.641 54.243 1.00 0.00 ATOM 1118 C ALA A 138 8.678 -10.594 53.842 1.00 0.00 ATOM 1119 N ASP A 139 8.447 -11.250 52.700 1.00 0.00 ATOM 1120 CA ASP A 139 7.314 -10.872 51.842 1.00 0.00 ATOM 1121 CB ASP A 139 7.339 -11.670 50.538 1.00 0.00 ATOM 1122 CG ASP A 139 8.441 -11.217 49.598 1.00 0.00 ATOM 1123 OD1 ASP A 139 9.022 -10.137 49.841 1.00 0.00 ATOM 1124 OD2 ASP A 139 8.721 -11.940 48.620 1.00 0.00 ATOM 1125 O ASP A 139 5.069 -10.276 52.451 1.00 0.00 ATOM 1126 C ASP A 139 5.978 -11.105 52.546 1.00 0.00 ATOM 1127 N PHE A 140 5.871 -12.237 53.248 1.00 0.00 ATOM 1128 CA PHE A 140 4.686 -12.553 54.043 1.00 0.00 ATOM 1129 CB PHE A 140 4.836 -13.892 54.769 1.00 0.00 ATOM 1130 CG PHE A 140 3.687 -14.220 55.679 1.00 0.00 ATOM 1131 CD1 PHE A 140 2.503 -14.723 55.169 1.00 0.00 ATOM 1132 CD2 PHE A 140 3.790 -14.026 57.045 1.00 0.00 ATOM 1133 CE1 PHE A 140 1.445 -15.024 56.008 1.00 0.00 ATOM 1134 CE2 PHE A 140 2.734 -14.328 57.883 1.00 0.00 ATOM 1135 CZ PHE A 140 1.565 -14.825 57.369 1.00 0.00 ATOM 1136 O PHE A 140 3.369 -10.955 55.248 1.00 0.00 ATOM 1137 C PHE A 140 4.486 -11.472 55.102 1.00 0.00 ATOM 1138 N ALA A 141 5.542 -11.113 55.831 1.00 0.00 ATOM 1139 CA ALA A 141 5.414 -10.020 56.804 1.00 0.00 ATOM 1140 CB ALA A 141 6.747 -9.762 57.488 1.00 0.00 ATOM 1141 O ALA A 141 4.188 -7.976 56.658 1.00 0.00 ATOM 1142 C ALA A 141 5.024 -8.700 56.138 1.00 0.00 ATOM 1143 N VAL A 142 5.630 -8.397 54.973 1.00 0.00 ATOM 1144 CA VAL A 142 5.326 -7.161 54.260 1.00 0.00 ATOM 1145 CB VAL A 142 5.997 -7.110 52.922 1.00 0.00 ATOM 1146 CG1 VAL A 142 5.495 -5.931 52.112 1.00 0.00 ATOM 1147 CG2 VAL A 142 7.501 -7.018 53.114 1.00 0.00 ATOM 1148 O VAL A 142 3.198 -6.072 54.043 1.00 0.00 ATOM 1149 C VAL A 142 3.855 -7.099 53.865 1.00 0.00 ATOM 1150 N TRP A 143 3.324 -8.210 53.363 1.00 0.00 ATOM 1151 CA TRP A 143 1.925 -8.270 52.978 1.00 0.00 ATOM 1152 CB TRP A 143 1.606 -9.608 52.310 1.00 0.00 ATOM 1153 CG TRP A 143 2.288 -9.798 50.990 1.00 0.00 ATOM 1154 CD1 TRP A 143 2.994 -8.861 50.290 1.00 0.00 ATOM 1155 CD2 TRP A 143 2.332 -11.000 50.210 1.00 0.00 ATOM 1156 CE2 TRP A 143 3.080 -10.717 49.050 1.00 0.00 ATOM 1157 CE3 TRP A 143 1.813 -12.286 50.379 1.00 0.00 ATOM 1158 NE1 TRP A 143 3.472 -9.403 49.121 1.00 0.00 ATOM 1159 CZ2 TRP A 143 3.320 -11.673 48.064 1.00 0.00 ATOM 1160 CZ3 TRP A 143 2.053 -13.232 49.399 1.00 0.00 ATOM 1161 CH2 TRP A 143 2.799 -12.923 48.257 1.00 0.00 ATOM 1162 O TRP A 143 -0.096 -7.469 53.941 1.00 0.00 ATOM 1163 C TRP A 143 0.950 -8.095 54.120 1.00 0.00 ATOM 1164 N SER A 144 1.307 -8.581 55.310 1.00 0.00 ATOM 1165 CA SER A 144 0.463 -8.336 56.479 1.00 0.00 ATOM 1166 CB SER A 144 0.941 -9.171 57.669 1.00 0.00 ATOM 1167 OG SER A 144 0.768 -10.556 57.423 1.00 0.00 ATOM 1168 O SER A 144 -0.559 -6.336 57.289 1.00 0.00 ATOM 1169 C SER A 144 0.470 -6.857 56.881 1.00 0.00 ATOM 1170 N GLU A 145 1.616 -6.193 56.752 1.00 0.00 ATOM 1171 CA GLU A 145 1.703 -4.775 57.107 1.00 0.00 ATOM 1172 CB GLU A 145 3.147 -4.270 57.092 1.00 0.00 ATOM 1173 CG GLU A 145 4.007 -4.813 58.221 1.00 0.00 ATOM 1174 CD GLU A 145 3.448 -4.480 59.591 1.00 0.00 ATOM 1175 OE1 GLU A 145 3.174 -3.289 59.846 1.00 0.00 ATOM 1176 OE2 GLU A 145 3.285 -5.410 60.409 1.00 0.00 ATOM 1177 O GLU A 145 0.158 -3.029 56.519 1.00 0.00 ATOM 1178 C GLU A 145 0.867 -3.956 56.125 1.00 0.00 ATOM 1179 N ALA A 146 0.941 -4.302 54.825 1.00 0.00 ATOM 1180 CA ALA A 146 0.186 -3.592 53.802 1.00 0.00 ATOM 1181 CB ALA A 146 0.503 -4.126 52.414 1.00 0.00 ATOM 1182 O ALA A 146 -2.084 -2.839 53.983 1.00 0.00 ATOM 1183 C ALA A 146 -1.313 -3.791 54.047 1.00 0.00 ATOM 1184 N ARG A 147 -1.728 -5.015 54.361 1.00 0.00 ATOM 1185 CA ARG A 147 -3.144 -5.286 54.637 1.00 0.00 ATOM 1186 CB ARG A 147 -3.371 -6.781 54.870 1.00 0.00 ATOM 1187 CG ARG A 147 -3.251 -7.630 53.615 1.00 0.00 ATOM 1188 CD ARG A 147 -3.415 -9.107 53.930 1.00 0.00 ATOM 1189 NE ARG A 147 -3.272 -9.941 52.737 1.00 0.00 ATOM 1190 CZ ARG A 147 -3.299 -11.270 52.747 1.00 0.00 ATOM 1191 NH1 ARG A 147 -3.163 -11.944 51.614 1.00 0.00 ATOM 1192 NH2 ARG A 147 -3.464 -11.920 53.890 1.00 0.00 ATOM 1193 O ARG A 147 -4.698 -3.936 55.885 1.00 0.00 ATOM 1194 C ARG A 147 -3.601 -4.520 55.889 1.00 0.00 ATOM 1195 N PHE A 148 -2.770 -4.469 56.935 1.00 0.00 ATOM 1196 CA PHE A 148 -3.105 -3.766 58.167 1.00 0.00 ATOM 1197 CB PHE A 148 -2.008 -3.968 59.215 1.00 0.00 ATOM 1198 CG PHE A 148 -1.905 -5.379 59.718 1.00 0.00 ATOM 1199 CD1 PHE A 148 -2.942 -6.275 59.530 1.00 0.00 ATOM 1200 CD2 PHE A 148 -0.768 -5.812 60.380 1.00 0.00 ATOM 1201 CE1 PHE A 148 -2.847 -7.573 59.994 1.00 0.00 ATOM 1202 CE2 PHE A 148 -0.672 -7.110 60.844 1.00 0.00 ATOM 1203 CZ PHE A 148 -1.706 -7.989 60.653 1.00 0.00 ATOM 1204 O PHE A 148 -4.162 -1.635 58.411 1.00 0.00 ATOM 1205 C PHE A 148 -3.257 -2.269 57.902 1.00 0.00 ATOM 1206 N SER A 149 -2.358 -1.707 57.102 1.00 0.00 ATOM 1207 CA SER A 149 -2.417 -0.285 56.792 1.00 0.00 ATOM 1208 CB SER A 149 -1.267 0.109 55.863 1.00 0.00 ATOM 1209 OG SER A 149 -1.320 1.486 55.540 1.00 0.00 ATOM 1210 O SER A 149 -4.456 0.972 56.547 1.00 0.00 ATOM 1211 C SER A 149 -3.761 0.036 56.139 1.00 0.00 ATOM 1212 N GLY A 150 -4.149 -0.771 55.146 1.00 0.00 ATOM 1213 CA GLY A 150 -5.400 -0.561 54.438 1.00 0.00 ATOM 1214 O GLY A 150 -7.559 0.060 55.254 1.00 0.00 ATOM 1215 C GLY A 150 -6.629 -0.743 55.308 1.00 0.00 ATOM 1216 N MET A 151 -6.650 -1.798 56.119 1.00 0.00 ATOM 1217 CA MET A 151 -7.809 -2.019 56.969 1.00 0.00 ATOM 1218 CB MET A 151 -7.687 -3.297 57.782 1.00 0.00 ATOM 1219 CG MET A 151 -8.003 -4.562 57.020 1.00 0.00 ATOM 1220 SD MET A 151 -7.842 -6.013 58.074 1.00 0.00 ATOM 1221 CE MET A 151 -6.124 -6.305 57.900 1.00 0.00 ATOM 1222 O MET A 151 -8.955 -0.347 58.270 1.00 0.00 ATOM 1223 C MET A 151 -7.880 -0.866 57.980 1.00 0.00 ATOM 1224 N VAL A 152 -6.714 -0.486 58.540 1.00 0.00 ATOM 1225 CA VAL A 152 -6.687 0.547 59.555 1.00 0.00 ATOM 1226 CB VAL A 152 -5.274 0.816 60.075 1.00 0.00 ATOM 1227 CG1 VAL A 152 -5.312 2.014 61.012 1.00 0.00 ATOM 1228 CG2 VAL A 152 -4.745 -0.408 60.841 1.00 0.00 ATOM 1229 O VAL A 152 -8.104 2.480 59.501 1.00 0.00 ATOM 1230 C VAL A 152 -7.206 1.848 58.962 1.00 0.00 ATOM 1231 N LYS A 153 -6.646 2.246 57.804 1.00 0.00 ATOM 1232 CA LYS A 153 -7.123 3.497 57.205 1.00 0.00 ATOM 1233 CB LYS A 153 -6.368 3.790 55.908 1.00 0.00 ATOM 1234 CG LYS A 153 -4.914 4.182 56.111 1.00 0.00 ATOM 1235 CD LYS A 153 -4.227 4.462 54.784 1.00 0.00 ATOM 1236 CE LYS A 153 -2.766 4.830 54.986 1.00 0.00 ATOM 1237 NZ LYS A 153 -2.071 5.075 53.691 1.00 0.00 ATOM 1238 O LYS A 153 -9.345 4.442 56.987 1.00 0.00 ATOM 1239 C LYS A 153 -8.588 3.486 56.873 1.00 0.00 ATOM 1240 N THR A 154 -9.110 2.346 56.404 1.00 0.00 ATOM 1241 CA THR A 154 -10.534 2.227 56.114 1.00 0.00 ATOM 1242 CB THR A 154 -10.878 0.839 55.522 1.00 0.00 ATOM 1243 CG2 THR A 154 -12.381 0.745 55.249 1.00 0.00 ATOM 1244 OG1 THR A 154 -10.166 0.660 54.271 1.00 0.00 ATOM 1245 O THR A 154 -12.360 3.156 57.372 1.00 0.00 ATOM 1246 C THR A 154 -11.358 2.451 57.390 1.00 0.00 ATOM 1247 N ALA A 155 -10.922 1.884 58.510 1.00 0.00 ATOM 1248 CA ALA A 155 -11.646 2.078 59.758 1.00 0.00 ATOM 1249 CB ALA A 155 -11.147 1.091 60.820 1.00 0.00 ATOM 1250 O ALA A 155 -12.566 4.074 60.731 1.00 0.00 ATOM 1251 C ALA A 155 -11.584 3.531 60.220 1.00 0.00 ATOM 1252 N LEU A 156 -10.428 4.167 60.015 1.00 0.00 ATOM 1253 CA LEU A 156 -10.262 5.559 60.409 1.00 0.00 ATOM 1254 CB LEU A 156 -8.816 6.002 60.201 1.00 0.00 ATOM 1255 CG LEU A 156 -8.518 7.477 60.485 1.00 0.00 ATOM 1256 CD1 LEU A 156 -8.987 7.834 61.887 1.00 0.00 ATOM 1257 CD2 LEU A 156 -7.033 7.736 60.334 1.00 0.00 ATOM 1258 O LEU A 156 -11.838 7.345 60.156 1.00 0.00 ATOM 1259 C LEU A 156 -11.176 6.467 59.599 1.00 0.00 ATOM 1260 N THR A 157 -11.202 6.258 58.272 1.00 0.00 ATOM 1261 CA THR A 157 -12.047 7.080 57.410 1.00 0.00 ATOM 1262 CB THR A 157 -11.877 6.638 55.944 1.00 0.00 ATOM 1263 CG2 THR A 157 -12.709 7.517 55.018 1.00 0.00 ATOM 1264 OG1 THR A 157 -10.498 6.744 55.574 1.00 0.00 ATOM 1265 O THR A 157 -14.260 7.908 57.902 1.00 0.00 ATOM 1266 C THR A 157 -13.517 6.924 57.823 1.00 0.00 ATOM 1267 N LEU A 158 -13.865 5.711 58.149 1.00 0.00 ATOM 1268 CA LEU A 158 -15.226 5.417 58.586 1.00 0.00 ATOM 1269 CB LEU A 158 -15.385 3.889 58.725 1.00 0.00 ATOM 1270 CG LEU A 158 -16.758 3.384 59.180 1.00 0.00 ATOM 1271 CD1 LEU A 158 -17.831 3.866 58.213 1.00 0.00 ATOM 1272 CD2 LEU A 158 -16.746 1.863 59.253 1.00 0.00 ATOM 1273 O LEU A 158 -16.650 6.671 60.056 1.00 0.00 ATOM 1274 C LEU A 158 -15.556 6.116 59.901 1.00 0.00 ATOM 1275 N ALA A 159 -14.651 6.049 60.862 1.00 0.00 ATOM 1276 CA ALA A 159 -14.883 6.673 62.159 1.00 0.00 ATOM 1277 CB ALA A 159 -13.786 6.337 63.173 1.00 0.00 ATOM 1278 O ALA A 159 -15.895 8.786 62.669 1.00 0.00 ATOM 1279 C ALA A 159 -15.010 8.195 62.049 1.00 0.00 ATOM 1280 N VAL A 160 -14.120 8.807 61.317 1.00 0.00 ATOM 1281 CA VAL A 160 -14.170 10.258 61.117 1.00 0.00 ATOM 1282 CB VAL A 160 -12.908 10.647 60.241 1.00 0.00 ATOM 1283 CG1 VAL A 160 -13.010 12.096 59.779 1.00 0.00 ATOM 1284 CG2 VAL A 160 -11.643 10.438 61.066 1.00 0.00 ATOM 1285 O VAL A 160 -16.071 11.667 60.786 1.00 0.00 ATOM 1286 C VAL A 160 -15.449 10.651 60.406 1.00 0.00 ATOM 1287 N THR A 161 -15.916 9.791 59.533 1.00 0.00 ATOM 1288 CA THR A 161 -17.184 10.046 58.821 1.00 0.00 ATOM 1289 CB THR A 161 -17.378 9.078 57.656 1.00 0.00 ATOM 1290 CG2 THR A 161 -18.709 9.337 56.992 1.00 0.00 ATOM 1291 OG1 THR A 161 -16.324 9.289 56.718 1.00 0.00 ATOM 1292 O THR A 161 -19.222 10.874 59.787 1.00 0.00 ATOM 1293 C THR A 161 -18.359 9.992 59.791 1.00 0.00 ATOM 1294 N THR A 162 -18.366 8.973 60.646 1.00 0.00 ATOM 1295 CA THR A 162 -19.432 8.808 61.629 1.00 0.00 ATOM 1296 CB THR A 162 -19.247 7.419 62.337 1.00 0.00 ATOM 1297 CG2 THR A 162 -20.278 7.262 63.429 1.00 0.00 ATOM 1298 OG1 THR A 162 -19.423 6.393 61.360 1.00 0.00 ATOM 1299 O THR A 162 -20.469 10.426 63.064 1.00 0.00 ATOM 1300 C THR A 162 -19.414 9.954 62.634 1.00 0.00 ATOM 1301 N THR A 163 -18.218 10.409 63.001 1.00 0.00 ATOM 1302 CA THR A 163 -18.105 11.510 63.949 1.00 0.00 ATOM 1303 CB THR A 163 -16.640 11.669 64.446 1.00 0.00 ATOM 1304 CG2 THR A 163 -16.502 12.849 65.416 1.00 0.00 ATOM 1305 OG1 THR A 163 -16.235 10.466 65.110 1.00 0.00 ATOM 1306 O THR A 163 -19.321 13.583 63.963 1.00 0.00 ATOM 1307 C THR A 163 -18.626 12.798 63.315 1.00 0.00 ATOM 1308 N LEU A 164 -18.317 12.995 62.037 1.00 0.00 ATOM 1309 CA LEU A 164 -18.760 14.190 61.324 1.00 0.00 ATOM 1310 CB LEU A 164 -18.222 14.208 59.905 1.00 0.00 ATOM 1311 CG LEU A 164 -18.623 15.405 59.037 1.00 0.00 ATOM 1312 CD1 LEU A 164 -18.179 16.699 59.706 1.00 0.00 ATOM 1313 CD2 LEU A 164 -17.995 15.270 57.657 1.00 0.00 ATOM 1314 O LEU A 164 -20.876 15.311 61.555 1.00 0.00 ATOM 1315 C LEU A 164 -20.285 14.256 61.305 1.00 0.00 ATOM 1316 N LYS A 165 -20.908 13.105 61.026 1.00 0.00 ATOM 1317 CA LYS A 165 -22.363 13.037 60.971 1.00 0.00 ATOM 1318 CB LYS A 165 -22.772 11.633 60.481 1.00 0.00 ATOM 1319 CG LYS A 165 -24.267 11.421 60.353 1.00 0.00 ATOM 1320 CD LYS A 165 -24.882 12.353 59.321 1.00 0.00 ATOM 1321 CE LYS A 165 -26.375 12.109 59.200 1.00 0.00 ATOM 1322 NZ LYS A 165 -27.009 13.006 58.197 1.00 0.00 ATOM 1323 O LYS A 165 -24.007 14.016 62.422 1.00 0.00 ATOM 1324 C LYS A 165 -22.998 13.314 62.332 1.00 0.00 ATOM 1325 N GLU A 166 -22.405 12.753 63.380 1.00 0.00 ATOM 1326 CA GLU A 166 -22.908 12.937 64.737 1.00 0.00 ATOM 1327 CB GLU A 166 -22.099 11.983 65.672 1.00 0.00 ATOM 1328 CG GLU A 166 -22.531 12.058 67.114 1.00 0.00 ATOM 1329 CD GLU A 166 -24.021 11.824 67.293 1.00 0.00 ATOM 1330 OE1 GLU A 166 -24.669 11.152 66.432 1.00 0.00 ATOM 1331 OE2 GLU A 166 -24.546 12.319 68.318 1.00 0.00 ATOM 1332 O GLU A 166 -23.672 14.880 65.925 1.00 0.00 ATOM 1333 C GLU A 166 -22.801 14.400 65.202 1.00 0.00 ATOM 1334 N LEU A 167 -21.708 15.004 64.850 1.00 0.00 ATOM 1335 CA LEU A 167 -21.445 16.381 65.243 1.00 0.00 ATOM 1336 CB LEU A 167 -20.015 16.812 64.904 1.00 0.00 ATOM 1337 CG LEU A 167 -19.673 18.284 65.169 1.00 0.00 ATOM 1338 CD1 LEU A 167 -19.987 18.637 66.619 1.00 0.00 ATOM 1339 CD2 LEU A 167 -18.202 18.534 64.856 1.00 0.00 ATOM 1340 O LEU A 167 -22.975 18.265 65.222 1.00 0.00 ATOM 1341 C LEU A 167 -22.394 17.369 64.549 1.00 0.00 ATOM 1342 N THR A 168 -22.474 17.148 63.179 1.00 0.00 ATOM 1343 CA THR A 168 -23.502 17.894 62.403 1.00 0.00 ATOM 1344 CB THR A 168 -22.746 18.943 61.566 1.00 0.00 ATOM 1345 CG2 THR A 168 -21.884 19.818 62.463 1.00 0.00 ATOM 1346 OG1 THR A 168 -21.905 18.284 60.613 1.00 0.00 ATOM 1347 O THR A 168 -23.890 15.871 61.187 1.00 0.00 ATOM 1348 C THR A 168 -24.276 17.014 61.429 1.00 0.00 ATOM 1349 N PRO A 169 -25.337 17.533 60.816 1.00 0.00 ATOM 1350 CA PRO A 169 -26.027 16.770 59.767 1.00 0.00 ATOM 1351 CB PRO A 169 -27.135 17.726 59.311 1.00 0.00 ATOM 1352 CG PRO A 169 -27.341 18.632 60.503 1.00 0.00 ATOM 1353 CD PRO A 169 -25.943 18.869 61.008 1.00 0.00 ATOM 1354 O PRO A 169 -25.374 15.355 57.952 1.00 0.00 ATOM 1355 C PRO A 169 -25.107 16.374 58.600 1.00 0.00 ENDMDL EXPDTA 2hktA MODEL 2 REMARK 44 REMARK 44 model 2 is called 2hktA ATOM 1 N MET 1 -8.417 4.409 61.081 1.00 0.00 ATOM 2 CA MET 1 -8.574 3.220 61.973 1.00 0.00 ATOM 3 CB MET 1 -9.091 3.621 63.369 1.00 0.00 ATOM 4 CG MET 1 -9.175 5.111 63.646 1.00 0.00 ATOM 5 SD MET 1 -7.454 5.990 63.668 1.00 0.00 ATOM 6 CE MET 1 -7.611 6.856 65.375 1.00 0.00 ATOM 7 O MET 1 -10.263 1.504 62.068 1.00 0.00 ATOM 8 C MET 1 -9.503 2.177 61.358 1.00 0.00 ATOM 9 N ALA 2 -9.432 2.029 60.033 1.00 0.00 ATOM 10 CA ALA 2 -10.234 1.041 59.309 1.00 0.00 ATOM 11 CB ALA 2 -10.197 1.327 57.821 1.00 0.00 ATOM 12 O ALA 2 -9.252 -0.632 60.733 1.00 0.00 ATOM 13 C ALA 2 -9.608 -0.323 59.592 1.00 0.00 ATOM 14 N THR 3 -9.467 -1.139 58.559 1.00 0.00 ATOM 15 CA THR 3 -8.856 -2.440 58.730 1.00 0.00 ATOM 16 CB THR 3 -9.911 -3.563 58.789 1.00 0.00 ATOM 17 CG2 THR 3 -9.549 -4.551 59.892 1.00 0.00 ATOM 18 OG1 THR 3 -11.186 -2.997 59.126 1.00 0.00 ATOM 19 O THR 3 -7.933 -1.943 56.567 1.00 0.00 ATOM 20 C THR 3 -7.841 -2.600 57.611 1.00 0.00 ATOM 21 N LEU 4 -6.825 -3.408 57.872 1.00 0.00 ATOM 22 CA LEU 4 -5.752 -3.602 56.918 1.00 0.00 ATOM 23 CB LEU 4 -4.418 -3.669 57.666 1.00 0.00 ATOM 24 CG LEU 4 -3.638 -2.467 58.219 1.00 0.00 ATOM 25 CD1 LEU 4 -4.410 -1.160 58.344 1.00 0.00 ATOM 26 CD2 LEU 4 -3.091 -2.895 59.528 1.00 0.00 ATOM 27 O LEU 4 -5.685 -5.935 56.365 1.00 0.00 ATOM 28 C LEU 4 -5.843 -4.778 55.958 1.00 0.00 ATOM 29 N THR 5 -6.141 -4.482 54.691 1.00 0.00 ATOM 30 CA THR 5 -6.145 -5.518 53.652 1.00 0.00 ATOM 31 CB THR 5 -7.016 -5.203 52.402 1.00 0.00 ATOM 32 CG2 THR 5 -7.741 -6.467 51.920 1.00 0.00 ATOM 33 OG1 THR 5 -7.965 -4.171 52.694 1.00 0.00 ATOM 34 O THR 5 -4.153 -4.259 53.283 1.00 0.00 ATOM 35 C THR 5 -4.718 -5.363 53.178 1.00 0.00 ATOM 36 N GLU 6 -4.121 -6.438 52.671 1.00 0.00 ATOM 37 CA GLU 6 -2.762 -6.319 52.182 1.00 0.00 ATOM 38 CB GLU 6 -2.092 -7.667 51.905 1.00 0.00 ATOM 39 CG GLU 6 -0.556 -7.557 51.800 1.00 0.00 ATOM 40 CD GLU 6 0.186 -8.147 52.996 1.00 0.00 ATOM 41 OE1 GLU 6 -0.142 -7.818 54.164 1.00 0.00 ATOM 42 OE2 GLU 6 1.128 -8.930 52.754 1.00 0.00 ATOM 43 O GLU 6 -1.924 -4.591 50.798 1.00 0.00 ATOM 44 C GLU 6 -2.786 -5.463 50.929 1.00 0.00 ATOM 45 N ASP 7 -3.792 -5.611 50.055 1.00 0.00 ATOM 46 CA ASP 7 -3.700 -4.732 48.904 1.00 0.00 ATOM 47 CB ASP 7 -3.516 -5.373 47.484 1.00 0.00 ATOM 48 CG ASP 7 -4.668 -6.247 47.000 1.00 0.00 ATOM 49 OD1 ASP 7 -4.423 -7.456 46.769 1.00 0.00 ATOM 50 OD2 ASP 7 -5.756 -5.718 46.695 1.00 0.00 ATOM 51 O ASP 7 -3.576 -2.507 48.085 1.00 0.00 ATOM 52 C ASP 7 -4.029 -3.237 48.965 1.00 0.00 ATOM 53 N ASP 8 -4.665 -2.739 50.033 1.00 0.00 ATOM 54 CA ASP 8 -4.809 -1.281 50.096 1.00 0.00 ATOM 55 CB ASP 8 -6.243 -0.755 50.250 1.00 0.00 ATOM 56 CG ASP 8 -6.683 -0.651 51.676 1.00 0.00 ATOM 57 OD1 ASP 8 -6.557 0.447 52.268 1.00 0.00 ATOM 58 OD2 ASP 8 -7.153 -1.675 52.196 1.00 0.00 ATOM 59 O ASP 8 -3.670 0.641 51.005 1.00 0.00 ATOM 60 C ASP 8 -3.776 -0.588 51.013 1.00 0.00 ATOM 61 N VAL 9 -3.016 -1.376 51.789 1.00 0.00 ATOM 62 CA VAL 9 -1.920 -0.840 52.620 1.00 0.00 ATOM 63 CB VAL 9 -1.392 -1.878 53.658 1.00 0.00 ATOM 64 CG1 VAL 9 0.101 -1.658 53.992 1.00 0.00 ATOM 65 CG2 VAL 9 -2.175 -1.749 54.911 1.00 0.00 ATOM 66 O VAL 9 -0.192 0.449 51.543 1.00 0.00 ATOM 67 C VAL 9 -0.860 -0.588 51.559 1.00 0.00 ATOM 68 N LEU 10 -0.834 -1.525 50.614 1.00 0.00 ATOM 69 CA LEU 10 0.050 -1.527 49.471 1.00 0.00 ATOM 70 CB LEU 10 -0.105 -2.858 48.741 1.00 0.00 ATOM 71 CG LEU 10 0.968 -3.451 47.831 1.00 0.00 ATOM 72 CD1 LEU 10 2.359 -2.979 48.201 1.00 0.00 ATOM 73 CD2 LEU 10 0.883 -4.966 47.930 1.00 0.00 ATOM 74 O LEU 10 0.585 0.146 47.847 1.00 0.00 ATOM 75 C LEU 10 -0.287 -0.356 48.549 1.00 0.00 ATOM 76 N GLU 11 -1.540 0.100 48.589 1.00 0.00 ATOM 77 CA GLU 11 -1.985 1.237 47.779 1.00 0.00 ATOM 78 CB GLU 11 -3.520 1.242 47.632 1.00 0.00 ATOM 79 CG GLU 11 -4.136 2.520 47.048 1.00 0.00 ATOM 80 CD GLU 11 -5.647 2.529 47.115 1.00 0.00 ATOM 81 OE1 GLU 11 -6.272 2.173 46.092 1.00 0.00 ATOM 82 OE2 GLU 11 -6.207 2.885 48.182 1.00 0.00 ATOM 83 O GLU 11 -1.006 3.429 47.713 1.00 0.00 ATOM 84 C GLU 11 -1.510 2.547 48.412 1.00 0.00 ATOM 85 N GLN 12 -1.653 2.643 49.735 1.00 0.00 ATOM 86 CA GLN 12 -1.270 3.831 50.497 1.00 0.00 ATOM 87 CB GLN 12 -1.681 3.698 51.964 1.00 0.00 ATOM 88 CG GLN 12 -3.169 3.595 52.201 1.00 0.00 ATOM 89 CD GLN 12 -3.543 3.878 53.636 1.00 0.00 ATOM 90 OE1 GLN 12 -4.086 3.017 54.327 1.00 0.00 ATOM 91 NE2 GLN 12 -3.266 5.097 54.091 1.00 0.00 ATOM 92 O GLN 12 0.591 5.309 50.394 1.00 0.00 ATOM 93 C GLN 12 0.208 4.142 50.447 1.00 0.00 ATOM 94 N LEU 13 1.025 3.092 50.433 1.00 0.00 ATOM 95 CA LEU 13 2.474 3.249 50.419 1.00 0.00 ATOM 96 CB LEU 13 3.150 2.034 51.038 1.00 0.00 ATOM 97 CG LEU 13 2.906 1.930 52.540 1.00 0.00 ATOM 98 CD1 LEU 13 3.349 0.599 53.009 1.00 0.00 ATOM 99 CD2 LEU 13 3.617 3.032 53.293 1.00 0.00 ATOM 100 O LEU 13 4.073 4.325 49.020 1.00 0.00 ATOM 101 C LEU 13 3.079 3.596 49.079 1.00 0.00 ATOM 102 N ASP 14 2.447 3.129 48.002 1.00 0.00 ATOM 103 CA ASP 14 2.947 3.431 46.667 1.00 0.00 ATOM 104 CB ASP 14 2.510 2.398 45.627 1.00 0.00 ATOM 105 CG ASP 14 3.591 2.157 44.569 1.00 0.00 ATOM 106 OD1 ASP 14 3.580 2.852 43.530 1.00 0.00 ATOM 107 OD2 ASP 14 4.480 1.302 44.797 1.00 0.00 ATOM 108 O ASP 14 3.270 5.500 45.515 1.00 0.00 ATOM 109 C ASP 14 2.549 4.843 46.260 1.00 0.00 ATOM 110 N ALA 15 1.467 5.339 46.855 1.00 0.00 ATOM 111 CA ALA 15 0.988 6.691 46.602 1.00 0.00 ATOM 112 CB ALA 15 -0.373 6.896 47.255 1.00 0.00 ATOM 113 O ALA 15 2.038 8.859 46.616 1.00 0.00 ATOM 114 C ALA 15 1.993 7.735 47.118 1.00 0.00 ATOM 115 N GLN 16 2.826 7.334 48.080 1.00 0.00 ATOM 116 CA GLN 16 3.841 8.209 48.668 1.00 0.00 ATOM 117 CB GLN 16 4.147 7.777 50.094 1.00 0.00 ATOM 118 CG GLN 16 2.930 7.450 50.976 1.00 0.00 ATOM 119 CD GLN 16 1.848 8.538 51.028 1.00 0.00 ATOM 120 OE1 GLN 16 2.137 9.735 50.973 1.00 0.00 ATOM 121 NE2 GLN 16 0.591 8.108 51.146 1.00 0.00 ATOM 122 O GLN 16 5.651 7.150 47.506 1.00 0.00 ATOM 123 C GLN 16 5.097 8.204 47.799 1.00 0.00 ATOM 124 N ASP 17 5.550 9.396 47.422 1.00 0.00 ATOM 125 CA ASP 17 6.688 9.590 46.507 1.00 0.00 ATOM 126 CB ASP 17 6.179 10.431 45.323 1.00 0.00 ATOM 127 CG ASP 17 5.831 11.889 45.721 1.00 0.00 ATOM 128 OD1 ASP 17 5.403 12.151 46.876 1.00 0.00 ATOM 129 OD2 ASP 17 6.022 12.781 44.873 1.00 0.00 ATOM 130 O ASP 17 8.770 10.796 46.417 1.00 0.00 ATOM 131 C ASP 17 7.888 10.301 47.121 1.00 0.00 ATOM 132 N ASN 18 7.911 10.318 48.441 1.00 0.00 ATOM 133 CA ASN 18 8.900 11.036 49.224 1.00 0.00 ATOM 134 CB ASN 18 8.239 12.434 49.426 1.00 0.00 ATOM 135 CG ASN 18 8.504 13.080 50.740 1.00 0.00 ATOM 136 ND2 ASN 18 7.905 12.555 51.776 1.00 0.00 ATOM 137 OD1 ASN 18 9.131 14.135 50.801 1.00 0.00 ATOM 138 O ASN 18 8.155 9.462 50.886 1.00 0.00 ATOM 139 C ASN 18 9.093 10.147 50.468 1.00 0.00 ATOM 140 N LEU 19 10.320 10.071 50.987 1.00 0.00 ATOM 141 CA LEU 19 10.607 9.236 52.161 1.00 0.00 ATOM 142 CB LEU 19 12.107 9.204 52.486 1.00 0.00 ATOM 143 CG LEU 19 12.841 8.070 53.244 1.00 0.00 ATOM 144 CD1 LEU 19 13.569 8.640 54.436 1.00 0.00 ATOM 145 CD2 LEU 19 11.964 6.897 53.656 1.00 0.00 ATOM 146 O LEU 19 9.218 8.806 54.031 1.00 0.00 ATOM 147 C LEU 19 9.812 9.656 53.379 1.00 0.00 ATOM 148 N PHE 20 9.733 10.966 53.612 1.00 0.00 ATOM 149 CA PHE 20 8.995 11.534 54.746 1.00 0.00 ATOM 150 CB PHE 20 9.098 13.073 54.740 1.00 0.00 ATOM 151 CG PHE 20 8.283 13.736 55.821 1.00 0.00 ATOM 152 CD1 PHE 20 6.991 14.221 55.555 1.00 0.00 ATOM 153 CD2 PHE 20 8.773 13.817 57.134 1.00 0.00 ATOM 154 CE1 PHE 20 6.196 14.739 56.592 1.00 0.00 ATOM 155 CE2 PHE 20 7.983 14.341 58.180 1.00 0.00 ATOM 156 CZ PHE 20 6.698 14.806 57.907 1.00 0.00 ATOM 157 O PHE 20 7.007 10.673 55.785 1.00 0.00 ATOM 158 C PHE 20 7.522 11.101 54.751 1.00 0.00 ATOM 159 N SER 21 6.859 11.268 53.604 1.00 0.00 ATOM 160 CA SER 21 5.451 10.922 53.425 1.00 0.00 ATOM 161 CB SER 21 4.957 11.328 52.044 1.00 0.00 ATOM 162 OG SER 21 5.022 12.725 51.886 1.00 0.00 ATOM 163 O SER 21 4.337 9.010 54.272 1.00 0.00 ATOM 164 C SER 21 5.270 9.441 53.600 1.00 0.00 ATOM 165 N PHE 22 6.223 8.677 53.061 1.00 0.00 ATOM 166 CA PHE 22 6.215 7.225 53.151 1.00 0.00 ATOM 167 CB PHE 22 7.393 6.622 52.371 1.00 0.00 ATOM 168 CG PHE 22 7.359 5.124 52.272 1.00 0.00 ATOM 169 CD1 PHE 22 6.793 4.503 51.155 1.00 0.00 ATOM 170 CD2 PHE 22 7.806 4.322 53.348 1.00 0.00 ATOM 171 CE1 PHE 22 6.672 3.100 51.108 1.00 0.00 ATOM 172 CE2 PHE 22 7.687 2.934 53.318 1.00 0.00 ATOM 173 CZ PHE 22 7.114 2.317 52.201 1.00 0.00 ATOM 174 O PHE 22 5.436 6.063 55.079 1.00 0.00 ATOM 175 C PHE 22 6.275 6.833 54.608 1.00 0.00 ATOM 176 N MET 23 7.245 7.398 55.319 1.00 0.00 ATOM 177 CA MET 23 7.412 7.095 56.723 1.00 0.00 ATOM 178 CB MET 23 8.765 7.562 57.222 1.00 0.00 ATOM 179 CG MET 23 9.944 6.801 56.595 1.00 0.00 ATOM 180 SD MET 23 10.035 4.874 56.831 1.00 0.00 ATOM 181 CE MET 23 10.317 4.853 58.739 1.00 0.00 ATOM 182 O MET 23 5.960 6.934 58.595 1.00 0.00 ATOM 183 C MET 23 6.275 7.584 57.602 1.00 0.00 ATOM 184 N LYS 24 5.616 8.675 57.197 1.00 0.00 ATOM 185 CA LYS 24 4.465 9.220 57.932 1.00 0.00 ATOM 186 CB LYS 24 4.045 10.600 57.383 1.00 0.00 ATOM 187 CG LYS 24 2.937 11.299 58.197 1.00 0.00 ATOM 188 CD LYS 24 2.794 12.773 57.877 1.00 0.00 ATOM 189 CE LYS 24 1.438 13.312 58.357 1.00 0.00 ATOM 190 NZ LYS 24 1.142 14.701 57.875 1.00 0.00 ATOM 191 O LYS 24 2.693 7.846 58.806 1.00 0.00 ATOM 192 C LYS 24 3.319 8.224 57.812 1.00 0.00 ATOM 193 N THR 25 3.146 7.728 56.590 1.00 0.00 ATOM 194 CA THR 25 2.122 6.753 56.247 1.00 0.00 ATOM 195 CB THR 25 1.986 6.662 54.727 1.00 0.00 ATOM 196 CG2 THR 25 0.771 5.841 54.312 1.00 0.00 ATOM 197 OG1 THR 25 1.852 7.987 54.202 1.00 0.00 ATOM 198 O THR 25 1.529 4.753 57.403 1.00 0.00 ATOM 199 C THR 25 2.425 5.375 56.838 1.00 0.00 ATOM 200 N ALA 26 3.684 4.932 56.750 1.00 0.00 ATOM 201 CA ALA 26 4.105 3.632 57.285 1.00 0.00 ATOM 202 CB ALA 26 5.587 3.379 57.006 1.00 0.00 ATOM 203 O ALA 26 3.231 2.654 59.274 1.00 0.00 ATOM 204 C ALA 26 3.847 3.591 58.773 1.00 0.00 ATOM 205 N HIS 27 4.216 4.676 59.450 1.00 0.00 ATOM 206 CA HIS 27 4.031 4.796 60.891 1.00 0.00 ATOM 207 CB HIS 27 4.578 6.129 61.407 1.00 0.00 ATOM 208 CG HIS 27 4.275 6.382 62.850 1.00 0.00 ATOM 209 CD2 HIS 27 4.799 5.835 63.982 1.00 0.00 ATOM 210 ND1 HIS 27 3.277 7.230 63.265 1.00 0.00 ATOM 211 CE1 HIS 27 3.186 7.201 64.583 1.00 0.00 ATOM 212 NE2 HIS 27 4.102 6.360 65.035 1.00 0.00 ATOM 213 O HIS 27 2.277 3.995 62.308 1.00 0.00 ATOM 214 C HIS 27 2.573 4.655 61.314 1.00 0.00 ATOM 215 N SER 28 1.672 5.293 60.579 1.00 0.00 ATOM 216 CA SER 28 0.272 5.198 60.941 1.00 0.00 ATOM 217 CB SER 28 -0.535 6.432 60.507 1.00 0.00 ATOM 218 OG SER 28 -1.169 6.256 59.260 1.00 0.00 ATOM 219 O SER 28 -1.369 3.508 61.037 1.00 0.00 ATOM 220 C SER 28 -0.346 3.876 60.509 1.00 0.00 ATOM 221 N ILE 29 0.309 3.138 59.612 1.00 0.00 ATOM 222 CA ILE 29 -0.193 1.822 59.201 1.00 0.00 ATOM 223 CB ILE 29 0.259 1.427 57.774 1.00 0.00 ATOM 224 CG1 ILE 29 -0.627 2.142 56.756 1.00 0.00 ATOM 225 CG2 ILE 29 0.145 -0.085 57.543 1.00 0.00 ATOM 226 CD1 ILE 29 -0.033 2.206 55.369 1.00 0.00 ATOM 227 O ILE 29 -0.533 -0.090 60.594 1.00 0.00 ATOM 228 C ILE 29 0.248 0.798 60.245 1.00 0.00 ATOM 229 N LEU 30 1.472 0.951 60.755 1.00 0.00 ATOM 230 CA LEU 30 1.994 0.068 61.798 1.00 0.00 ATOM 231 CB LEU 30 3.496 0.275 62.003 1.00 0.00 ATOM 232 CG LEU 30 4.337 -0.075 60.775 1.00 0.00 ATOM 233 CD1 LEU 30 5.759 0.408 60.942 1.00 0.00 ATOM 234 CD2 LEU 30 4.284 -1.570 60.507 1.00 0.00 ATOM 235 O LEU 30 0.949 -0.668 63.817 1.00 0.00 ATOM 236 C LEU 30 1.242 0.292 63.112 1.00 0.00 ATOM 237 N LEU 31 0.868 1.551 63.390 1.00 0.00 ATOM 238 CA LEU 31 0.107 1.904 64.593 1.00 0.00 ATOM 239 CB LEU 31 -0.041 3.425 64.768 1.00 0.00 ATOM 240 CG LEU 31 -0.009 4.075 66.173 1.00 0.00 ATOM 241 CD1 LEU 31 -1.011 5.197 66.236 1.00 0.00 ATOM 242 CD2 LEU 31 -0.265 3.108 67.327 1.00 0.00 ATOM 243 O LEU 31 -1.687 0.543 65.348 1.00 0.00 ATOM 244 C LEU 31 -1.270 1.272 64.449 1.00 0.00 ATOM 245 N GLN 32 -1.913 1.479 63.285 1.00 0.00 ATOM 246 CA GLN 32 -3.240 0.905 62.973 1.00 0.00 ATOM 247 CB GLN 32 -3.737 1.297 61.544 1.00 0.00 ATOM 248 CG GLN 32 -4.236 2.789 61.308 1.00 0.00 ATOM 249 CD GLN 32 -4.651 3.149 59.827 1.00 0.00 ATOM 250 OE1 GLN 32 -3.877 3.008 58.874 1.00 0.00 ATOM 251 NE2 GLN 32 -5.865 3.665 59.675 1.00 0.00 ATOM 252 O GLN 32 -3.983 -1.300 63.624 1.00 0.00 ATOM 253 C GLN 32 -3.106 -0.629 63.081 1.00 0.00 ATOM 254 N GLY 33 -1.924 -1.128 62.705 1.00 0.00 ATOM 255 CA GLY 33 -1.617 -2.551 62.740 1.00 0.00 ATOM 256 O GLY 33 -2.127 -4.132 64.431 1.00 0.00 ATOM 257 C GLY 33 -1.466 -3.149 64.118 1.00 0.00 ATOM 258 N ILE 34 -0.603 -2.538 64.931 1.00 0.00 ATOM 259 CA ILE 34 -0.330 -2.949 66.315 1.00 0.00 ATOM 260 CB ILE 34 0.785 -2.050 66.968 1.00 0.00 ATOM 261 CG1 ILE 34 2.137 -2.250 66.266 1.00 0.00 ATOM 262 CG2 ILE 34 0.916 -2.324 68.478 1.00 0.00 ATOM 263 CD1 ILE 34 2.872 -3.532 66.619 1.00 0.00 ATOM 264 O ILE 34 -1.863 -3.723 67.991 1.00 0.00 ATOM 265 C ILE 34 -1.601 -2.849 67.165 1.00 0.00 ATOM 266 N ARG 35 -2.383 -1.791 66.945 1.00 0.00 ATOM 267 CA ARG 35 -3.621 -1.574 67.684 1.00 0.00 ATOM 268 CB ARG 35 -4.165 -0.166 67.454 1.00 0.00 ATOM 269 CG ARG 35 -3.322 0.913 68.115 1.00 0.00 ATOM 270 CD ARG 35 -3.962 2.276 68.004 1.00 0.00 ATOM 271 NE ARG 35 -4.872 2.547 69.114 1.00 0.00 ATOM 272 CZ ARG 35 -6.199 2.614 69.012 1.00 0.00 ATOM 273 NH1 ARG 35 -6.801 2.423 67.839 1.00 0.00 ATOM 274 NH2 ARG 35 -6.926 2.888 70.087 1.00 0.00 ATOM 275 O ARG 35 -5.457 -2.965 68.343 1.00 0.00 ATOM 276 C ARG 35 -4.697 -2.627 67.435 1.00 0.00 ATOM 277 N GLN 36 -4.711 -3.181 66.224 1.00 0.00 ATOM 278 CA GLN 36 -5.654 -4.228 65.840 1.00 0.00 ATOM 279 CB GLN 36 -5.679 -4.384 64.326 1.00 0.00 ATOM 280 CG GLN 36 -6.632 -3.431 63.636 1.00 0.00 ATOM 281 CD GLN 36 -6.478 -3.421 62.124 1.00 0.00 ATOM 282 OE1 GLN 36 -6.691 -2.385 61.482 1.00 0.00 ATOM 283 NE2 GLN 36 -6.111 -4.570 61.546 1.00 0.00 ATOM 284 O GLN 36 -6.113 -6.442 66.619 1.00 0.00 ATOM 285 C GLN 36 -5.273 -5.557 66.475 1.00 0.00 ATOM 286 N PHE 37 -4.003 -5.668 66.861 1.00 0.00 ATOM 287 CA PHE 37 -3.444 -6.864 67.492 1.00 0.00 ATOM 288 CB PHE 37 -1.929 -6.962 67.217 1.00 0.00 ATOM 289 CG PHE 37 -1.262 -8.176 67.817 1.00 0.00 ATOM 290 CD1 PHE 37 -0.573 -8.088 69.040 1.00 0.00 ATOM 291 CD2 PHE 37 -1.361 -9.421 67.191 1.00 0.00 ATOM 292 CE1 PHE 37 0.020 -9.223 69.622 1.00 0.00 ATOM 293 CE2 PHE 37 -0.770 -10.576 67.758 1.00 0.00 ATOM 294 CZ PHE 37 -0.085 -10.477 68.982 1.00 0.00 ATOM 295 O PHE 37 -3.869 -7.951 69.571 1.00 0.00 ATOM 296 C PHE 37 -3.689 -6.879 68.999 1.00 0.00 ATOM 297 N LEU 38 -3.703 -5.694 69.624 1.00 0.00 ATOM 298 CA LEU 38 -3.905 -5.548 71.069 1.00 0.00 ATOM 299 CB LEU 38 -4.001 -4.070 71.457 1.00 0.00 ATOM 300 CG LEU 38 -2.772 -3.292 71.950 1.00 0.00 ATOM 301 CD1 LEU 38 -1.475 -3.977 71.673 1.00 0.00 ATOM 302 CD2 LEU 38 -2.773 -1.922 71.337 1.00 0.00 ATOM 303 O LEU 38 -4.728 -7.026 72.767 1.00 0.00 ATOM 304 C LEU 38 -4.996 -6.426 71.721 1.00 0.00 ATOM 305 N PRO 39 -6.201 -6.572 71.092 1.00 0.00 ATOM 306 CA PRO 39 -7.213 -7.434 71.724 1.00 0.00 ATOM 307 CB PRO 39 -8.400 -7.303 70.782 1.00 0.00 ATOM 308 CG PRO 39 -8.291 -5.935 70.284 1.00 0.00 ATOM 309 CD PRO 39 -6.830 -5.798 69.996 1.00 0.00 ATOM 310 O PRO 39 -7.280 -9.609 72.768 1.00 0.00 ATOM 311 C PRO 39 -6.777 -8.920 71.880 1.00 0.00 ATOM 312 N SER 40 -5.812 -9.378 71.061 1.00 0.00 ATOM 313 CA SER 40 -5.251 -10.754 71.102 1.00 0.00 ATOM 314 CB SER 40 -4.044 -10.894 70.151 1.00 0.00 ATOM 315 OG SER 40 -4.370 -11.438 68.887 1.00 0.00 ATOM 316 O SER 40 -4.798 -12.178 72.988 1.00 0.00 ATOM 317 C SER 40 -4.709 -11.053 72.494 1.00 0.00 ATOM 318 N LEU 41 -4.139 -10.008 73.093 1.00 0.00 ATOM 319 CA LEU 41 -3.512 -10.020 74.414 1.00 0.00 ATOM 320 CB LEU 41 -2.804 -8.681 74.631 1.00 0.00 ATOM 321 CG LEU 41 -1.341 -8.409 74.296 1.00 0.00 ATOM 322 CD1 LEU 41 -0.788 -9.308 73.229 1.00 0.00 ATOM 323 CD2 LEU 41 -1.203 -6.950 73.935 1.00 0.00 ATOM 324 O LEU 41 -3.954 -10.839 76.609 1.00 0.00 ATOM 325 C LEU 41 -4.390 -10.245 75.630 1.00 0.00 ATOM 326 N PHE 42 -5.606 -9.720 75.571 1.00 0.00 ATOM 327 CA PHE 42 -6.537 -9.766 76.695 1.00 0.00 ATOM 328 CB PHE 42 -7.125 -8.362 76.914 1.00 0.00 ATOM 329 CG PHE 42 -6.105 -7.279 76.954 1.00 0.00 ATOM 330 CD1 PHE 42 -5.072 -7.305 77.895 1.00 0.00 ATOM 331 CD2 PHE 42 -6.128 -6.259 75.997 1.00 0.00 ATOM 332 CE1 PHE 42 -4.068 -6.337 77.892 1.00 0.00 ATOM 333 CE2 PHE 42 -5.126 -5.266 75.972 1.00 0.00 ATOM 334 CZ PHE 42 -4.086 -5.307 76.921 1.00 0.00 ATOM 335 O PHE 42 -7.885 -11.411 75.592 1.00 0.00 ATOM 336 C PHE 42 -7.684 -10.755 76.620 1.00 0.00 ATOM 337 N VAL 43 -8.465 -10.792 77.711 1.00 0.00 ATOM 338 CA VAL 43 -9.650 -11.635 77.850 1.00 0.00 ATOM 339 CB VAL 43 -10.262 -11.540 79.276 1.00 0.00 ATOM 340 CG1 VAL 43 -11.679 -12.096 79.339 1.00 0.00 ATOM 341 CG2 VAL 43 -9.390 -12.327 80.242 1.00 0.00 ATOM 342 O VAL 43 -10.762 -10.205 76.222 1.00 0.00 ATOM 343 C VAL 43 -10.622 -11.335 76.707 1.00 0.00 ATOM 344 N ASP 44 -11.265 -12.410 76.299 1.00 0.00 ATOM 345 CA ASP 44 -12.118 -12.487 75.140 1.00 0.00 ATOM 346 CB ASP 44 -11.443 -13.628 74.358 1.00 0.00 ATOM 347 CG ASP 44 -11.872 -13.755 72.926 1.00 0.00 ATOM 348 OD1 ASP 44 -12.696 -12.962 72.423 1.00 0.00 ATOM 349 OD2 ASP 44 -11.347 -14.700 72.295 1.00 0.00 ATOM 350 O ASP 44 -14.502 -12.125 74.983 1.00 0.00 ATOM 351 C ASP 44 -13.586 -12.820 75.431 1.00 0.00 ATOM 352 N ASN 45 -13.759 -13.918 76.164 1.00 0.00 ATOM 353 CA ASN 45 -15.033 -14.540 76.537 1.00 0.00 ATOM 354 CB ASN 45 -14.761 -16.035 76.775 1.00 0.00 ATOM 355 CG ASN 45 -13.684 -16.288 77.853 1.00 0.00 ATOM 356 ND2 ASN 45 -13.366 -17.560 78.082 1.00 0.00 ATOM 357 OD1 ASN 45 -13.154 -15.353 78.464 1.00 0.00 ATOM 358 O ASN 45 -16.951 -14.582 77.982 1.00 0.00 ATOM 359 C ASN 45 -15.896 -14.007 77.691 1.00 0.00 ATOM 360 N ASP 46 -15.432 -12.971 78.379 1.00 0.00 ATOM 361 CA ASP 46 -16.168 -12.382 79.508 1.00 0.00 ATOM 362 CB ASP 46 -15.284 -12.449 80.775 1.00 0.00 ATOM 363 CG ASP 46 -15.928 -11.819 82.023 1.00 0.00 ATOM 364 OD1 ASP 46 -16.768 -10.897 81.922 1.00 0.00 ATOM 365 OD2 ASP 46 -15.524 -12.212 83.137 1.00 0.00 ATOM 366 O ASP 46 -15.595 -10.167 78.830 1.00 0.00 ATOM 367 C ASP 46 -16.499 -10.943 79.124 1.00 0.00 ATOM 368 N GLU 47 -17.777 -10.568 79.197 1.00 0.00 ATOM 369 CA GLU 47 -18.159 -9.209 78.816 1.00 0.00 ATOM 370 CB GLU 47 -19.486 -9.162 78.050 1.00 0.00 ATOM 371 CG GLU 47 -19.409 -8.163 76.878 1.00 0.00 ATOM 372 CD GLU 47 -20.753 -7.650 76.420 1.00 0.00 ATOM 373 OE1 GLU 47 -21.293 -6.709 77.053 1.00 0.00 ATOM 374 OE2 GLU 47 -21.261 -8.181 75.410 1.00 0.00 ATOM 375 O GLU 47 -18.295 -6.920 79.492 1.00 0.00 ATOM 376 C GLU 47 -18.093 -8.084 79.848 1.00 0.00 ATOM 377 N GLU 48 -17.819 -8.403 81.113 1.00 0.00 ATOM 378 CA GLU 48 -17.680 -7.341 82.112 1.00 0.00 ATOM 379 CB GLU 48 -17.899 -7.854 83.539 1.00 0.00 ATOM 380 CG GLU 48 -18.810 -6.943 84.376 1.00 0.00 ATOM 381 CD GLU 48 -20.014 -7.674 84.961 1.00 0.00 ATOM 382 OE1 GLU 48 -21.162 -7.377 84.555 1.00 0.00 ATOM 383 OE2 GLU 48 -19.812 -8.544 85.835 1.00 0.00 ATOM 384 O GLU 48 -16.055 -5.604 81.752 1.00 0.00 ATOM 385 C GLU 48 -16.258 -6.816 81.909 1.00 0.00 ATOM 386 N ILE 49 -15.328 -7.764 81.728 1.00 0.00 ATOM 387 CA ILE 49 -13.912 -7.485 81.478 1.00 0.00 ATOM 388 CB ILE 49 -13.052 -8.790 81.452 1.00 0.00 ATOM 389 CG1 ILE 49 -13.176 -9.537 82.785 1.00 0.00 ATOM 390 CG2 ILE 49 -11.594 -8.454 81.175 1.00 0.00 ATOM 391 CD1 ILE 49 -12.273 -10.770 82.991 1.00 0.00 ATOM 392 O ILE 49 -12.987 -5.721 80.135 1.00 0.00 ATOM 393 C ILE 49 -13.709 -6.714 80.158 1.00 0.00 ATOM 394 N VAL 50 -14.373 -7.143 79.083 1.00 0.00 ATOM 395 CA VAL 50 -14.234 -6.479 77.783 1.00 0.00 ATOM 396 CB VAL 50 -14.914 -7.273 76.609 1.00 0.00 ATOM 397 CG1 VAL 50 -14.807 -6.496 75.286 1.00 0.00 ATOM 398 CG2 VAL 50 -14.261 -8.630 76.436 1.00 0.00 ATOM 399 O VAL 50 -14.049 -4.121 77.410 1.00 0.00 ATOM 400 C VAL 50 -14.756 -5.051 77.795 1.00 0.00 ATOM 401 N GLU 51 -15.970 -4.893 78.306 1.00 0.00 ATOM 402 CA GLU 51 -16.640 -3.602 78.357 1.00 0.00 ATOM 403 CB GLU 51 -18.141 -3.820 78.599 1.00 0.00 ATOM 404 CG GLU 51 -19.069 -2.818 77.905 1.00 0.00 ATOM 405 CD GLU 51 -18.937 -2.819 76.383 1.00 0.00 ATOM 406 OE1 GLU 51 -18.849 -3.912 75.770 1.00 0.00 ATOM 407 OE2 GLU 51 -18.919 -1.712 75.803 1.00 0.00 ATOM 408 O GLU 51 -16.152 -1.377 79.110 1.00 0.00 ATOM 409 C GLU 51 -16.087 -2.585 79.354 1.00 0.00 ATOM 410 N TYR 52 -15.535 -3.065 80.466 1.00 0.00 ATOM 411 CA TYR 52 -15.029 -2.159 81.489 1.00 0.00 ATOM 412 CB TYR 52 -15.829 -2.354 82.791 1.00 0.00 ATOM 413 CG TYR 52 -17.303 -2.000 82.610 1.00 0.00 ATOM 414 CD1 TYR 52 -18.314 -2.981 82.737 1.00 0.00 ATOM 415 CD2 TYR 52 -17.687 -0.695 82.204 1.00 0.00 ATOM 416 CE1 TYR 52 -19.686 -2.671 82.448 1.00 0.00 ATOM 417 CE2 TYR 52 -19.042 -0.372 81.912 1.00 0.00 ATOM 418 CZ TYR 52 -20.037 -1.362 82.036 1.00 0.00 ATOM 419 OH TYR 52 -21.352 -1.039 81.749 1.00 0.00 ATOM 420 O TYR 52 -13.013 -1.158 82.319 1.00 0.00 ATOM 421 C TYR 52 -13.519 -2.112 81.717 1.00 0.00 ATOM 422 N ALA 53 -12.796 -3.094 81.178 1.00 0.00 ATOM 423 CA ALA 53 -11.347 -3.132 81.324 1.00 0.00 ATOM 424 CB ALA 53 -10.904 -4.395 82.052 1.00 0.00 ATOM 425 O ALA 53 -9.757 -2.092 79.870 1.00 0.00 ATOM 426 C ALA 53 -10.607 -2.972 79.994 1.00 0.00 ATOM 427 N VAL 54 -10.999 -3.756 78.985 1.00 0.00 ATOM 428 CA VAL 54 -10.363 -3.739 77.655 1.00 0.00 ATOM 429 CB VAL 54 -10.696 -5.035 76.843 1.00 0.00 ATOM 430 CG1 VAL 54 -10.010 -5.057 75.487 1.00 0.00 ATOM 431 CG2 VAL 54 -10.290 -6.252 77.622 1.00 0.00 ATOM 432 O VAL 54 -9.724 -1.890 76.284 1.00 0.00 ATOM 433 C VAL 54 -10.651 -2.486 76.819 1.00 0.00 ATOM 434 N LYS 55 -11.918 -2.085 76.729 1.00 0.00 ATOM 435 CA LYS 55 -12.312 -0.901 75.964 1.00 0.00 ATOM 436 CB LYS 55 -13.831 -0.746 75.952 1.00 0.00 ATOM 437 CG LYS 55 -14.534 -1.215 74.707 1.00 0.00 ATOM 438 CD LYS 55 -15.912 -0.558 74.634 1.00 0.00 ATOM 439 CE LYS 55 -15.864 0.971 74.895 1.00 0.00 ATOM 440 NZ LYS 55 -17.194 1.630 74.859 1.00 0.00 ATOM 441 O LYS 55 -11.030 1.070 75.535 1.00 0.00 ATOM 442 C LYS 55 -11.625 0.416 76.384 1.00 0.00 ATOM 443 N PRO 56 -11.673 0.815 77.684 1.00 0.00 ATOM 444 CA PRO 56 -10.991 2.076 78.035 1.00 0.00 ATOM 445 CB PRO 56 -11.500 2.355 79.447 1.00 0.00 ATOM 446 CG PRO 56 -11.805 1.000 79.974 1.00 0.00 ATOM 447 CD PRO 56 -12.452 0.324 78.843 1.00 0.00 ATOM 448 O PRO 56 -8.761 3.015 77.982 1.00 0.00 ATOM 449 C PRO 56 -9.454 1.992 77.973 1.00 0.00 ATOM 450 N LEU 57 -8.950 0.761 77.885 1.00 0.00 ATOM 451 CA LEU 57 -7.520 0.478 77.791 1.00 0.00 ATOM 452 CB LEU 57 -7.277 -0.958 78.231 1.00 0.00 ATOM 453 CG LEU 57 -6.087 -1.460 79.040 1.00 0.00 ATOM 454 CD1 LEU 57 -5.616 -0.466 80.095 1.00 0.00 ATOM 455 CD2 LEU 57 -6.533 -2.757 79.688 1.00 0.00 ATOM 456 O LEU 57 -5.973 1.061 76.049 1.00 0.00 ATOM 457 C LEU 57 -7.095 0.653 76.330 1.00 0.00 ATOM 458 N LEU 58 -8.021 0.357 75.415 1.00 0.00 ATOM 459 CA LEU 58 -7.797 0.458 73.972 1.00 0.00 ATOM 460 CB LEU 58 -8.209 -0.840 73.274 1.00 0.00 ATOM 461 CG LEU 58 -7.516 -2.120 73.722 1.00 0.00 ATOM 462 CD1 LEU 58 -7.914 -3.240 72.817 1.00 0.00 ATOM 463 CD2 LEU 58 -6.033 -1.948 73.703 1.00 0.00 ATOM 464 O LEU 58 -8.720 1.666 72.113 1.00 0.00 ATOM 465 C LEU 58 -8.557 1.609 73.341 1.00 0.00 ATOM 466 N ALA 59 -9.030 2.525 74.184 1.00 0.00 ATOM 467 CA ALA 59 -9.771 3.688 73.714 1.00 0.00 ATOM 468 CB ALA 59 -10.394 4.450 74.881 1.00 0.00 ATOM 469 O ALA 59 -7.600 4.541 73.176 1.00 0.00 ATOM 470 C ALA 59 -8.814 4.583 72.973 1.00 0.00 ATOM 471 N GLN 60 -9.378 5.348 72.057 1.00 0.00 ATOM 472 CA GLN 60 -8.632 6.294 71.270 1.00 0.00 ATOM 473 CB GLN 60 -9.572 6.845 70.204 1.00 0.00 ATOM 474 CG GLN 60 -9.315 8.264 69.738 1.00 0.00 ATOM 475 CD GLN 60 -9.600 8.459 68.273 1.00 0.00 ATOM 476 OE1 GLN 60 -8.974 9.282 67.628 1.00 0.00 ATOM 477 NE2 GLN 60 -10.531 7.693 67.734 1.00 0.00 ATOM 478 O GLN 60 -8.880 7.794 73.118 1.00 0.00 ATOM 479 C GLN 60 -8.136 7.365 72.236 1.00 0.00 ATOM 480 N SER 61 -6.852 7.702 72.114 1.00 0.00 ATOM 481 CA SER 61 -6.151 8.684 72.964 1.00 0.00 ATOM 482 CB SER 61 -6.888 10.031 73.060 1.00 0.00 ATOM 483 OG SER 61 -6.636 10.837 71.928 1.00 0.00 ATOM 484 O SER 61 -5.355 8.903 75.227 1.00 0.00 ATOM 485 C SER 61 -5.840 8.159 74.364 1.00 0.00 ATOM 486 N GLY 62 -6.088 6.865 74.562 1.00 0.00 ATOM 487 CA GLY 62 -5.838 6.221 75.843 1.00 0.00 ATOM 488 O GLY 62 -3.550 5.989 75.201 1.00 0.00 ATOM 489 C GLY 62 -4.404 5.753 76.060 1.00 0.00 ATOM 490 N PRO 63 -4.121 5.046 77.181 1.00 0.00 ATOM 491 CA PRO 63 -2.788 4.533 77.530 1.00 0.00 ATOM 492 CB PRO 63 -3.047 3.751 78.822 1.00 0.00 ATOM 493 CG PRO 63 -4.514 3.437 78.763 1.00 0.00 ATOM 494 CD PRO 63 -5.082 4.703 78.233 1.00 0.00 ATOM 495 O PRO 63 -0.818 3.793 76.461 1.00 0.00 ATOM 496 C PRO 63 -2.032 3.713 76.499 1.00 0.00 ATOM 497 N LEU 64 -2.743 2.979 75.639 1.00 0.00 ATOM 498 CA LEU 64 -2.100 2.168 74.601 1.00 0.00 ATOM 499 CB LEU 64 -2.663 0.739 74.604 1.00 0.00 ATOM 500 CG LEU 64 -2.639 -0.045 75.920 1.00 0.00 ATOM 501 CD1 LEU 64 -3.259 -1.384 75.694 1.00 0.00 ATOM 502 CD2 LEU 64 -1.225 -0.226 76.460 1.00 0.00 ATOM 503 O LEU 64 -1.711 2.085 72.223 1.00 0.00 ATOM 504 C LEU 64 -2.126 2.753 73.176 1.00 0.00 ATOM 505 N ASP 65 -2.588 3.999 73.030 1.00 0.00 ATOM 506 CA ASP 65 -2.643 4.649 71.718 1.00 0.00 ATOM 507 CB ASP 65 -3.821 5.627 71.630 1.00 0.00 ATOM 508 CG ASP 65 -4.189 6.001 70.181 1.00 0.00 ATOM 509 OD1 ASP 65 -3.558 5.500 69.217 1.00 0.00 ATOM 510 OD2 ASP 65 -5.126 6.810 70.010 1.00 0.00 ATOM 511 O ASP 65 -1.244 6.544 71.129 1.00 0.00 ATOM 512 C ASP 65 -1.318 5.350 71.449 1.00 0.00 ATOM 513 N ASP 66 -0.271 4.561 71.606 1.00 0.00 ATOM 514 CA ASP 66 1.090 4.981 71.403 1.00 0.00 ATOM 515 CB ASP 66 1.675 5.490 72.712 1.00 0.00 ATOM 516 CG ASP 66 3.009 6.160 72.525 1.00 0.00 ATOM 517 OD1 ASP 66 4.026 5.571 72.932 1.00 0.00 ATOM 518 OD2 ASP 66 3.043 7.272 71.957 1.00 0.00 ATOM 519 O ASP 66 1.686 2.692 71.658 1.00 0.00 ATOM 520 C ASP 66 1.779 3.707 70.972 1.00 0.00 ATOM 521 N ILE 67 2.438 3.761 69.819 1.00 0.00 ATOM 522 CA ILE 67 3.150 2.615 69.252 1.00 0.00 ATOM 523 CB ILE 67 3.660 2.932 67.806 1.00 0.00 ATOM 524 CG1 ILE 67 4.298 1.702 67.166 1.00 0.00 ATOM 525 CG2 ILE 67 4.578 4.151 67.807 1.00 0.00 ATOM 526 CD1 ILE 67 4.526 1.837 65.690 1.00 0.00 ATOM 527 O ILE 67 4.494 0.934 70.300 1.00 0.00 ATOM 528 C ILE 67 4.281 2.135 70.161 1.00 0.00 ATOM 529 N ASP 68 4.912 3.077 70.860 1.00 0.00 ATOM 530 CA ASP 68 6.008 2.745 71.754 1.00 0.00 ATOM 531 CB ASP 68 6.907 3.964 71.991 1.00 0.00 ATOM 532 CG ASP 68 7.615 4.439 70.704 1.00 0.00 ATOM 533 OD1 ASP 68 7.441 3.804 69.645 1.00 0.00 ATOM 534 OD2 ASP 68 8.349 5.455 70.752 1.00 0.00 ATOM 535 O ASP 68 6.262 1.114 73.472 1.00 0.00 ATOM 536 C ASP 68 5.579 2.042 73.049 1.00 0.00 ATOM 537 N VAL 69 4.432 2.409 73.638 1.00 0.00 ATOM 538 CA VAL 69 3.987 1.709 74.847 1.00 0.00 ATOM 539 CB VAL 69 3.168 2.589 75.885 1.00 0.00 ATOM 540 CG1 VAL 69 3.454 4.053 75.741 1.00 0.00 ATOM 541 CG2 VAL 69 1.699 2.312 75.845 1.00 0.00 ATOM 542 O VAL 69 3.331 -0.589 75.192 1.00 0.00 ATOM 543 C VAL 69 3.245 0.411 74.470 1.00 0.00 ATOM 544 N ALA 70 2.568 0.417 73.321 1.00 0.00 ATOM 545 CA ALA 70 1.832 -0.758 72.848 1.00 0.00 ATOM 546 CB ALA 70 0.952 -0.400 71.670 1.00 0.00 ATOM 547 O ALA 70 2.550 -3.059 72.767 1.00 0.00 ATOM 548 C ALA 70 2.802 -1.885 72.474 1.00 0.00 ATOM 549 N LEU 71 3.938 -1.498 71.891 1.00 0.00 ATOM 550 CA LEU 71 4.985 -2.431 71.493 1.00 0.00 ATOM 551 CB LEU 71 6.092 -1.712 70.741 1.00 0.00 ATOM 552 CG LEU 71 6.107 -1.798 69.229 1.00 0.00 ATOM 553 CD1 LEU 71 7.202 -0.853 68.767 1.00 0.00 ATOM 554 CD2 LEU 71 6.350 -3.233 68.753 1.00 0.00 ATOM 555 O LEU 71 5.766 -4.265 72.793 1.00 0.00 ATOM 556 C LEU 71 5.607 -3.048 72.715 1.00 0.00 ATOM 557 N ARG 72 5.926 -2.187 73.680 1.00 0.00 ATOM 558 CA ARG 72 6.534 -2.616 74.926 1.00 0.00 ATOM 559 CB ARG 72 6.966 -1.420 75.758 1.00 0.00 ATOM 560 CG ARG 72 8.153 -0.739 75.127 1.00 0.00 ATOM 561 CD ARG 72 8.808 0.239 76.046 1.00 0.00 ATOM 562 NE ARG 72 8.265 1.591 75.981 1.00 0.00 ATOM 563 CZ ARG 72 8.933 2.646 75.519 1.00 0.00 ATOM 564 NH1 ARG 72 10.175 2.519 75.071 1.00 0.00 ATOM 565 NH2 ARG 72 8.361 3.838 75.521 1.00 0.00 ATOM 566 O ARG 72 6.166 -4.528 76.266 1.00 0.00 ATOM 567 C ARG 72 5.657 -3.572 75.709 1.00 0.00 ATOM 568 N LEU 73 4.338 -3.385 75.599 1.00 0.00 ATOM 569 CA LEU 73 3.355 -4.228 76.269 1.00 0.00 ATOM 570 CB LEU 73 1.954 -3.601 76.186 1.00 0.00 ATOM 571 CG LEU 73 0.882 -3.746 77.286 1.00 0.00 ATOM 572 CD1 LEU 73 -0.402 -4.268 76.682 1.00 0.00 ATOM 573 CD2 LEU 73 1.299 -4.608 78.464 1.00 0.00 ATOM 574 O LEU 73 3.454 -6.617 76.405 1.00 0.00 ATOM 575 C LEU 73 3.349 -5.639 75.663 1.00 0.00 ATOM 576 N ILE 74 3.292 -5.726 74.330 1.00 0.00 ATOM 577 CA ILE 74 3.285 -7.006 73.604 1.00 0.00 ATOM 578 CB ILE 74 3.118 -6.801 72.073 1.00 0.00 ATOM 579 CG1 ILE 74 1.814 -6.063 71.787 1.00 0.00 ATOM 580 CG2 ILE 74 3.092 -8.152 71.338 1.00 0.00 ATOM 581 CD1 ILE 74 1.639 -5.622 70.352 1.00 0.00 ATOM 582 O ILE 74 4.587 -8.943 74.195 1.00 0.00 ATOM 583 C ILE 74 4.593 -7.747 73.878 1.00 0.00 ATOM 584 N TYR 75 5.696 -7.001 73.830 1.00 0.00 ATOM 585 CA TYR 75 7.019 -7.553 74.084 1.00 0.00 ATOM 586 CB TYR 75 8.106 -6.534 73.736 1.00 0.00 ATOM 587 CG TYR 75 9.480 -7.129 73.485 1.00 0.00 ATOM 588 CD1 TYR 75 9.630 -8.320 72.748 1.00 0.00 ATOM 589 CD2 TYR 75 10.639 -6.482 73.944 1.00 0.00 ATOM 590 CE1 TYR 75 10.906 -8.857 72.470 1.00 0.00 ATOM 591 CE2 TYR 75 11.926 -6.999 73.665 1.00 0.00 ATOM 592 CZ TYR 75 12.049 -8.190 72.929 1.00 0.00 ATOM 593 OH TYR 75 13.291 -8.716 72.668 1.00 0.00 ATOM 594 O TYR 75 7.669 -9.072 75.792 1.00 0.00 ATOM 595 C TYR 75 7.167 -7.985 75.539 1.00 0.00 ATOM 596 N ALA 76 6.702 -7.143 76.470 1.00 0.00 ATOM 597 CA ALA 76 6.765 -7.406 77.917 1.00 0.00 ATOM 598 CB ALA 76 6.292 -6.214 78.706 1.00 0.00 ATOM 599 O ALA 76 6.414 -9.413 79.160 1.00 0.00 ATOM 600 C ALA 76 5.986 -8.660 78.295 1.00 0.00 ATOM 601 N LEU 77 4.862 -8.903 77.615 1.00 0.00 ATOM 602 CA LEU 77 4.100 -10.138 77.810 1.00 0.00 ATOM 603 CB LEU 77 2.648 -9.958 77.320 1.00 0.00 ATOM 604 CG LEU 77 1.775 -8.936 78.094 1.00 0.00 ATOM 605 CD1 LEU 77 0.485 -8.628 77.399 1.00 0.00 ATOM 606 CD2 LEU 77 1.469 -9.424 79.493 1.00 0.00 ATOM 607 O LEU 77 6.029 -10.807 76.518 1.00 0.00 ATOM 608 C LEU 77 4.920 -11.141 76.944 1.00 0.00 ATOM 609 N GLY 78 4.465 -12.356 76.684 1.00 0.00 ATOM 610 CA GLY 78 5.326 -13.210 75.861 1.00 0.00 ATOM 611 O GLY 78 5.070 -14.405 73.810 1.00 0.00 ATOM 612 C GLY 78 4.890 -13.337 74.410 1.00 0.00 ATOM 613 N LYS 79 4.397 -12.242 73.819 1.00 0.00 ATOM 614 CA LYS 79 3.841 -12.299 72.464 1.00 0.00 ATOM 615 CB LYS 79 2.364 -11.835 72.518 1.00 0.00 ATOM 616 CG LYS 79 1.523 -12.280 73.771 1.00 0.00 ATOM 617 CD LYS 79 1.253 -13.795 73.877 1.00 0.00 ATOM 618 CE LYS 79 0.562 -14.187 75.200 1.00 0.00 ATOM 619 NZ LYS 79 -0.914 -13.891 75.244 1.00 0.00 ATOM 620 O LYS 79 3.958 -11.589 70.147 1.00 0.00 ATOM 621 C LYS 79 4.569 -11.709 71.221 1.00 0.00 ATOM 622 N MET 80 5.865 -11.403 71.337 1.00 0.00 ATOM 623 CA MET 80 6.635 -10.862 70.208 1.00 0.00 ATOM 624 CB MET 80 6.562 -9.326 70.171 1.00 0.00 ATOM 625 CG MET 80 7.198 -8.702 68.928 1.00 0.00 ATOM 626 SD MET 80 6.789 -6.848 68.632 1.00 0.00 ATOM 627 CE MET 80 4.934 -7.005 68.153 1.00 0.00 ATOM 628 O MET 80 8.807 -11.131 71.205 1.00 0.00 ATOM 629 C MET 80 8.100 -11.298 70.207 1.00 0.00 ATOM 630 N ASP 81 8.557 -11.813 69.063 1.00 0.00 ATOM 631 CA ASP 81 9.948 -12.245 68.886 1.00 0.00 ATOM 632 CB ASP 81 10.112 -13.009 67.550 1.00 0.00 ATOM 633 CG ASP 81 9.204 -14.225 67.434 1.00 0.00 ATOM 634 OD1 ASP 81 9.399 -15.200 68.192 1.00 0.00 ATOM 635 OD2 ASP 81 8.316 -14.216 66.551 1.00 0.00 ATOM 636 O ASP 81 10.357 -9.926 68.392 1.00 0.00 ATOM 637 C ASP 81 10.799 -10.980 68.807 1.00 0.00 ATOM 638 N LYS 82 11.997 -11.065 69.299 1.00 0.00 ATOM 639 CA LYS 82 12.828 -10.000 69.167 1.00 0.00 ATOM 640 CB LYS 82 14.052 -10.440 69.762 1.00 0.00 ATOM 641 CG LYS 82 15.172 -9.520 69.514 1.00 0.00 ATOM 642 CD LYS 82 16.273 -9.367 70.546 1.00 0.00 ATOM 643 CE LYS 82 17.539 -10.193 70.389 1.00 0.00 ATOM 644 NZ LYS 82 18.848 -9.572 70.360 1.00 0.00 ATOM 645 O LYS 82 13.508 -8.367 67.929 1.00 0.00 ATOM 646 C LYS 82 13.133 -9.394 67.871 1.00 0.00 ATOM 647 N TRP 83 13.265 -10.090 66.770 1.00 0.00 ATOM 648 CA TRP 83 13.502 -9.489 65.443 1.00 0.00 ATOM 649 CB TRP 83 13.672 -10.597 64.360 1.00 0.00 ATOM 650 CG TRP 83 12.437 -11.393 63.942 1.00 0.00 ATOM 651 CD1 TRP 83 11.999 -12.565 64.490 1.00 0.00 ATOM 652 CD2 TRP 83 11.502 -11.073 62.886 1.00 0.00 ATOM 653 CE2 TRP 83 10.530 -12.118 62.872 1.00 0.00 ATOM 654 CE3 TRP 83 11.398 -10.016 61.960 1.00 0.00 ATOM 655 NE1 TRP 83 10.854 -13.002 63.852 1.00 0.00 ATOM 656 CZ2 TRP 83 9.447 -12.118 61.959 1.00 0.00 ATOM 657 CZ3 TRP 83 10.312 -10.018 61.048 1.00 0.00 ATOM 658 CH2 TRP 83 9.357 -11.072 61.056 1.00 0.00 ATOM 659 O TRP 83 12.699 -7.380 64.616 1.00 0.00 ATOM 660 C TRP 83 12.401 -8.499 65.045 1.00 0.00 ATOM 661 N LEU 84 11.149 -8.915 65.260 1.00 0.00 ATOM 662 CA LEU 84 9.956 -8.122 64.955 1.00 0.00 ATOM 663 CB LEU 84 8.683 -8.970 65.105 1.00 0.00 ATOM 664 CG LEU 84 7.339 -8.299 64.792 1.00 0.00 ATOM 665 CD1 LEU 84 7.324 -7.745 63.381 1.00 0.00 ATOM 666 CD2 LEU 84 6.231 -9.286 64.983 1.00 0.00 ATOM 667 O LEU 84 9.509 -5.800 65.337 1.00 0.00 ATOM 668 C LEU 84 9.874 -6.879 65.828 1.00 0.00 ATOM 669 N TYR 85 10.235 -7.039 67.106 1.00 0.00 ATOM 670 CA TYR 85 10.241 -5.933 68.041 1.00 0.00 ATOM 671 CB TYR 85 10.592 -6.395 69.462 1.00 0.00 ATOM 672 CG TYR 85 10.808 -5.263 70.452 1.00 0.00 ATOM 673 CD1 TYR 85 12.113 -4.864 70.811 1.00 0.00 ATOM 674 CD2 TYR 85 9.723 -4.572 71.022 1.00 0.00 ATOM 675 CE1 TYR 85 12.337 -3.808 71.709 1.00 0.00 ATOM 676 CE2 TYR 85 9.938 -3.497 71.944 1.00 0.00 ATOM 677 CZ TYR 85 11.249 -3.132 72.273 1.00 0.00 ATOM 678 OH TYR 85 11.494 -2.110 73.154 1.00 0.00 ATOM 679 O TYR 85 10.872 -3.773 67.280 1.00 0.00 ATOM 680 C TYR 85 11.242 -4.918 67.517 1.00 0.00 ATOM 681 N ALA 86 12.457 -5.382 67.224 1.00 0.00 ATOM 682 CA ALA 86 13.527 -4.527 66.708 1.00 0.00 ATOM 683 CB ALA 86 14.786 -5.329 66.521 1.00 0.00 ATOM 684 O ALA 86 13.454 -2.606 65.267 1.00 0.00 ATOM 685 C ALA 86 13.161 -3.797 65.407 1.00 0.00 ATOM 686 N ASP 87 12.453 -4.478 64.504 1.00 0.00 ATOM 687 CA ASP 87 12.055 -3.867 63.238 1.00 0.00 ATOM 688 CB ASP 87 11.427 -4.890 62.280 1.00 0.00 ATOM 689 CG ASP 87 12.463 -5.657 61.474 1.00 0.00 ATOM 690 OD1 ASP 87 13.671 -5.533 61.776 1.00 0.00 ATOM 691 OD2 ASP 87 12.073 -6.392 60.535 1.00 0.00 ATOM 692 O ASP 87 11.418 -1.584 62.969 1.00 0.00 ATOM 693 C ASP 87 11.115 -2.688 63.424 1.00 0.00 ATOM 694 N ILE 88 10.043 -2.904 64.189 1.00 0.00 ATOM 695 CA ILE 88 9.048 -1.870 64.427 1.00 0.00 ATOM 696 CB ILE 88 7.787 -2.418 65.127 1.00 0.00 ATOM 697 CG1 ILE 88 7.281 -3.652 64.381 1.00 0.00 ATOM 698 CG2 ILE 88 6.673 -1.340 65.145 1.00 0.00 ATOM 699 CD1 ILE 88 6.003 -4.267 64.933 1.00 0.00 ATOM 700 O ILE 88 9.303 0.472 64.766 1.00 0.00 ATOM 701 C ILE 88 9.599 -0.656 65.171 1.00 0.00 ATOM 702 N THR 89 10.452 -0.872 66.184 1.00 0.00 ATOM 703 CA THR 89 11.000 0.271 66.913 1.00 0.00 ATOM 704 CB THR 89 11.498 -0.008 68.395 1.00 0.00 ATOM 705 CG2 THR 89 11.244 -1.399 68.838 1.00 0.00 ATOM 706 OG1 THR 89 12.888 0.298 68.542 1.00 0.00 ATOM 707 O THR 89 12.190 2.230 66.317 1.00 0.00 ATOM 708 C THR 89 12.001 1.048 66.082 1.00 0.00 ATOM 709 N HIS 90 12.585 0.402 65.070 1.00 0.00 ATOM 710 CA HIS 90 13.512 1.091 64.168 1.00 0.00 ATOM 711 CB HIS 90 14.384 0.116 63.374 1.00 0.00 ATOM 712 CG HIS 90 15.518 -0.459 64.172 1.00 0.00 ATOM 713 CD2 HIS 90 16.176 0.011 65.251 1.00 0.00 ATOM 714 ND1 HIS 90 16.079 -1.683 63.878 1.00 0.00 ATOM 715 CE1 HIS 90 17.038 -1.939 64.753 1.00 0.00 ATOM 716 NE2 HIS 90 17.119 -0.932 65.596 1.00 0.00 ATOM 717 O HIS 90 13.094 3.112 62.968 1.00 0.00 ATOM 718 C HIS 90 12.695 1.983 63.240 1.00 0.00 ATOM 719 N PHE 91 11.515 1.502 62.831 1.00 0.00 ATOM 720 CA PHE 91 10.610 2.273 61.979 1.00 0.00 ATOM 721 CB PHE 91 9.415 1.429 61.510 1.00 0.00 ATOM 722 CG PHE 91 9.560 0.900 60.111 1.00 0.00 ATOM 723 CD1 PHE 91 10.251 -0.304 59.860 1.00 0.00 ATOM 724 CD2 PHE 91 9.051 1.621 59.022 1.00 0.00 ATOM 725 CE1 PHE 91 10.440 -0.774 58.530 1.00 0.00 ATOM 726 CE2 PHE 91 9.236 1.166 57.690 1.00 0.00 ATOM 727 CZ PHE 91 9.929 -0.032 57.446 1.00 0.00 ATOM 728 O PHE 91 10.274 4.626 62.343 1.00 0.00 ATOM 729 C PHE 91 10.142 3.484 62.791 1.00 0.00 ATOM 730 N SER 92 9.763 3.227 64.045 1.00 0.00 ATOM 731 CA SER 92 9.320 4.269 64.958 1.00 0.00 ATOM 732 CB SER 92 8.809 3.660 66.260 1.00 0.00 ATOM 733 OG SER 92 8.274 4.659 67.112 1.00 0.00 ATOM 734 O SER 92 10.192 6.486 65.171 1.00 0.00 ATOM 735 C SER 92 10.437 5.282 65.242 1.00 0.00 ATOM 736 N GLN 93 11.665 4.790 65.471 1.00 0.00 ATOM 737 CA GLN 93 12.836 5.638 65.746 1.00 0.00 ATOM 738 CB GLN 93 14.081 4.808 66.070 1.00 0.00 ATOM 739 CG GLN 93 14.216 4.355 67.518 1.00 0.00 ATOM 740 CD GLN 93 15.568 3.702 67.835 1.00 0.00 ATOM 741 OE1 GLN 93 16.455 3.599 66.974 1.00 0.00 ATOM 742 NE2 GLN 93 15.731 3.275 69.085 1.00 0.00 ATOM 743 O GLN 93 13.605 7.670 64.735 1.00 0.00 ATOM 744 C GLN 93 13.184 6.522 64.563 1.00 0.00 ATOM 745 N TYR 94 13.007 5.973 63.361 1.00 0.00 ATOM 746 CA TYR 94 13.307 6.698 62.140 1.00 0.00 ATOM 747 CB TYR 94 13.482 5.749 60.951 1.00 0.00 ATOM 748 CG TYR 94 14.165 6.366 59.750 1.00 0.00 ATOM 749 CD1 TYR 94 13.990 5.825 58.473 1.00 0.00 ATOM 750 CD2 TYR 94 15.005 7.490 59.883 1.00 0.00 ATOM 751 CE1 TYR 94 14.643 6.377 57.354 1.00 0.00 ATOM 752 CE2 TYR 94 15.637 8.049 58.787 1.00 0.00 ATOM 753 CZ TYR 94 15.461 7.489 57.532 1.00 0.00 ATOM 754 OH TYR 94 16.114 8.053 56.477 1.00 0.00 ATOM 755 O TYR 94 12.499 8.791 61.375 1.00 0.00 ATOM 756 C TYR 94 12.217 7.702 61.868 1.00 0.00 ATOM 757 N TRP 95 10.981 7.338 62.209 1.00 0.00 ATOM 758 CA TRP 95 9.875 8.258 62.038 1.00 0.00 ATOM 759 CB TRP 95 8.504 7.613 62.283 1.00 0.00 ATOM 760 CG TRP 95 7.376 8.631 62.371 1.00 0.00 ATOM 761 CD1 TRP 95 6.512 8.797 63.416 1.00 0.00 ATOM 762 CD2 TRP 95 7.079 9.692 61.432 1.00 0.00 ATOM 763 CE2 TRP 95 6.018 10.445 62.009 1.00 0.00 ATOM 764 CE3 TRP 95 7.617 10.078 60.187 1.00 0.00 ATOM 765 NE1 TRP 95 5.700 9.884 63.199 1.00 0.00 ATOM 766 CZ2 TRP 95 5.486 11.583 61.357 1.00 0.00 ATOM 767 CZ3 TRP 95 7.093 11.213 59.552 1.00 0.00 ATOM 768 CH2 TRP 95 6.030 11.951 60.142 1.00 0.00 ATOM 769 O TRP 95 9.984 10.597 62.493 1.00 0.00 ATOM 770 C TRP 95 10.082 9.457 62.958 1.00 0.00 ATOM 771 N HIS 96 10.387 9.192 64.235 1.00 0.00 ATOM 772 CA HIS 96 10.650 10.251 65.212 1.00 0.00 ATOM 773 CB HIS 96 11.038 9.691 66.576 1.00 0.00 ATOM 774 CG HIS 96 9.877 9.208 67.392 1.00 0.00 ATOM 775 CD2 HIS 96 9.154 9.819 68.357 1.00 0.00 ATOM 776 ND1 HIS 96 9.375 7.932 67.282 1.00 0.00 ATOM 777 CE1 HIS 96 8.390 7.773 68.151 1.00 0.00 ATOM 778 NE2 HIS 96 8.235 8.901 68.816 1.00 0.00 ATOM 779 O HIS 96 11.642 12.338 64.697 1.00 0.00 ATOM 780 C HIS 96 11.780 11.127 64.704 1.00 0.00 ATOM 781 N TYR 97 12.823 10.504 64.145 1.00 0.00 ATOM 782 CA TYR 97 13.966 11.238 63.606 1.00 0.00 ATOM 783 CB TYR 97 15.083 10.286 63.119 1.00 0.00 ATOM 784 CG TYR 97 16.303 11.004 62.553 1.00 0.00 ATOM 785 CD1 TYR 97 16.403 11.293 61.169 1.00 0.00 ATOM 786 CD2 TYR 97 17.292 11.520 63.406 1.00 0.00 ATOM 787 CE1 TYR 97 17.453 12.103 60.658 1.00 0.00 ATOM 788 CE2 TYR 97 18.349 12.330 62.905 1.00 0.00 ATOM 789 CZ TYR 97 18.419 12.618 61.535 1.00 0.00 ATOM 790 OH TYR 97 19.425 13.422 61.035 1.00 0.00 ATOM 791 O TYR 97 13.978 13.325 62.445 1.00 0.00 ATOM 792 C TYR 97 13.549 12.171 62.472 1.00 0.00 ATOM 793 N LEU 98 12.757 11.657 61.528 1.00 0.00 ATOM 794 CA LEU 98 12.306 12.447 60.379 1.00 0.00 ATOM 795 CB LEU 98 11.684 11.544 59.317 1.00 0.00 ATOM 796 CG LEU 98 12.628 10.548 58.641 1.00 0.00 ATOM 797 CD1 LEU 98 11.834 9.377 58.183 1.00 0.00 ATOM 798 CD2 LEU 98 13.394 11.134 57.492 1.00 0.00 ATOM 799 O LEU 98 11.420 14.658 60.156 1.00 0.00 ATOM 800 C LEU 98 11.338 13.578 60.732 1.00 0.00 ATOM 801 N ASN 99 10.481 13.347 61.725 1.00 0.00 ATOM 802 CA ASN 99 9.492 14.336 62.148 1.00 0.00 ATOM 803 CB ASN 99 8.240 13.630 62.666 1.00 0.00 ATOM 804 CG ASN 99 7.024 14.557 62.779 1.00 0.00 ATOM 805 ND2 ASN 99 7.033 15.671 62.050 1.00 0.00 ATOM 806 OD1 ASN 99 6.078 14.247 63.496 1.00 0.00 ATOM 807 O ASN 99 9.552 16.485 63.221 1.00 0.00 ATOM 808 C ASN 99 9.981 15.328 63.206 1.00 0.00 ATOM 809 N GLU 100 10.856 14.865 64.095 1.00 0.00 ATOM 810 CA GLU 100 11.370 15.693 65.182 1.00 0.00 ATOM 811 CB GLU 100 11.320 14.908 66.500 1.00 0.00 ATOM 812 CG GLU 100 9.918 14.382 66.844 1.00 0.00 ATOM 813 CD GLU 100 9.883 13.349 67.965 1.00 0.00 ATOM 814 OE1 GLU 100 10.914 13.093 68.628 1.00 0.00 ATOM 815 OE2 GLU 100 8.795 12.775 68.185 1.00 0.00 ATOM 816 O GLU 100 13.137 17.191 65.712 1.00 0.00 ATOM 817 C GLU 100 12.756 16.289 64.974 1.00 0.00 ATOM 818 N GLN 101 13.495 15.820 63.964 1.00 0.00 ATOM 819 CA GLN 101 14.846 16.326 63.704 1.00 0.00 ATOM 820 CB GLN 101 15.908 15.412 64.341 1.00 0.00 ATOM 821 CG GLN 101 16.260 15.712 65.809 1.00 0.00 ATOM 822 CD GLN 101 16.019 14.517 66.733 1.00 0.00 ATOM 823 OE1 GLN 101 16.422 13.384 66.436 1.00 0.00 ATOM 824 NE2 GLN 101 15.361 14.768 67.862 1.00 0.00 ATOM 825 O GLN 101 16.046 17.624 62.122 1.00 0.00 ATOM 826 C GLN 101 15.285 16.669 62.278 1.00 0.00 ATOM 827 N ASP 102 14.884 15.907 61.247 1.00 0.00 ATOM 828 CA ASP 102 15.339 16.256 59.882 1.00 0.00 ATOM 829 CB ASP 102 16.743 15.680 59.598 1.00 0.00 ATOM 830 CG ASP 102 17.427 16.346 58.397 1.00 0.00 ATOM 831 OD1 ASP 102 17.659 17.573 58.417 1.00 0.00 ATOM 832 OD2 ASP 102 17.665 15.653 57.395 1.00 0.00 ATOM 833 O ASP 102 14.741 17.026 57.725 1.00 0.00 ATOM 834 C ASP 102 14.486 16.208 58.596 1.00 0.00 ATOM 835 N GLU 103 13.479 15.340 58.448 1.00 0.00 ATOM 836 CA GLU 103 12.625 15.273 57.211 1.00 0.00 ATOM 837 CB GLU 103 11.382 16.207 57.262 1.00 0.00 ATOM 838 CG GLU 103 11.359 17.439 58.178 1.00 0.00 ATOM 839 CD GLU 103 12.070 18.673 57.624 1.00 0.00 ATOM 840 OE1 GLU 103 12.034 18.911 56.397 1.00 0.00 ATOM 841 OE2 GLU 103 12.655 19.418 58.441 1.00 0.00 ATOM 842 O GLU 103 12.510 14.925 54.831 1.00 0.00 ATOM 843 C GLU 103 13.191 15.315 55.777 1.00 0.00 ATOM 844 N THR 104 14.446 15.739 55.635 1.00 0.00 ATOM 845 CA THR 104 15.148 15.854 54.350 1.00 0.00 ATOM 846 CB THR 104 16.375 16.817 54.447 1.00 0.00 ATOM 847 CG2 THR 104 16.473 17.708 53.216 1.00 0.00 ATOM 848 OG1 THR 104 16.263 17.637 55.614 1.00 0.00 ATOM 849 O THR 104 15.811 14.539 52.447 1.00 0.00 ATOM 850 C THR 104 15.653 14.556 53.683 1.00 0.00 ATOM 851 N PRO 105 15.964 13.480 54.466 1.00 0.00 ATOM 852 CA PRO 105 16.445 12.241 53.849 1.00 0.00 ATOM 853 CB PRO 105 16.633 11.335 55.053 1.00 0.00 ATOM 854 CG PRO 105 17.067 12.266 56.096 1.00 0.00 ATOM 855 CD PRO 105 16.044 13.323 55.934 1.00 0.00 ATOM 856 O PRO 105 14.317 11.429 53.134 1.00 0.00 ATOM 857 C PRO 105 15.497 11.604 52.843 1.00 0.00 ATOM 858 N GLY 106 16.019 11.316 51.649 1.00 0.00 ATOM 859 CA GLY 106 15.235 10.685 50.592 1.00 0.00 ATOM 860 O GLY 106 16.127 8.657 51.440 1.00 0.00 ATOM 861 C GLY 106 15.422 9.174 50.590 1.00 0.00 ATOM 862 N PHE 107 14.804 8.461 49.649 1.00 0.00 ATOM 863 CA PHE 107 14.934 6.997 49.578 1.00 0.00 ATOM 864 CB PHE 107 13.981 6.411 48.533 1.00 0.00 ATOM 865 CG PHE 107 12.530 6.506 48.893 1.00 0.00 ATOM 866 CD1 PHE 107 11.669 7.330 48.145 1.00 0.00 ATOM 867 CD2 PHE 107 11.995 5.739 49.949 1.00 0.00 ATOM 868 CE1 PHE 107 10.297 7.386 48.428 1.00 0.00 ATOM 869 CE2 PHE 107 10.623 5.784 50.247 1.00 0.00 ATOM 870 CZ PHE 107 9.771 6.614 49.485 1.00 0.00 ATOM 871 O PHE 107 16.697 5.361 49.624 1.00 0.00 ATOM 872 C PHE 107 16.342 6.484 49.261 1.00 0.00 ATOM 873 N ALA 108 17.145 7.333 48.627 1.00 0.00 ATOM 874 CA ALA 108 18.488 6.965 48.215 1.00 0.00 ATOM 875 CB ALA 108 18.643 7.263 46.743 1.00 0.00 ATOM 876 O ALA 108 20.801 7.532 48.520 1.00 0.00 ATOM 877 C ALA 108 19.666 7.545 49.008 1.00 0.00 ATOM 878 N ASP 109 19.419 8.013 50.232 1.00 0.00 ATOM 879 CA ASP 109 20.493 8.576 51.057 1.00 0.00 ATOM 880 CB ASP 109 19.973 9.740 51.912 1.00 0.00 ATOM 881 CG ASP 109 19.628 10.975 51.083 1.00 0.00 ATOM 882 OD1 ASP 109 20.241 11.197 50.011 1.00 0.00 ATOM 883 OD2 ASP 109 18.744 11.738 51.510 1.00 0.00 ATOM 884 O ASP 109 20.671 6.426 52.117 1.00 0.00 ATOM 885 C ASP 109 21.191 7.534 51.934 1.00 0.00 ATOM 886 N ASP 110 22.371 7.901 52.455 1.00 0.00 ATOM 887 CA ASP 110 23.196 7.053 53.327 1.00 0.00 ATOM 888 CB ASP 110 24.491 7.769 53.755 1.00 0.00 ATOM 889 CG ASP 110 25.445 8.073 52.597 1.00 0.00 ATOM 890 OD1 ASP 110 26.329 8.942 52.792 1.00 0.00 ATOM 891 OD2 ASP 110 25.344 7.451 51.516 1.00 0.00 ATOM 892 O ASP 110 22.436 5.538 55.020 1.00 0.00 ATOM 893 C ASP 110 22.453 6.699 54.606 1.00 0.00 ATOM 894 N ILE 111 21.809 7.710 55.193 1.00 0.00 ATOM 895 CA ILE 111 21.066 7.586 56.445 1.00 0.00 ATOM 896 CB ILE 111 20.578 9.009 56.923 1.00 0.00 ATOM 897 CG1 ILE 111 20.334 9.080 58.439 1.00 0.00 ATOM 898 CG2 ILE 111 19.445 9.491 56.102 1.00 0.00 ATOM 899 CD1 ILE 111 19.008 8.587 58.958 1.00 0.00 ATOM 900 O ILE 111 19.743 5.759 57.259 1.00 0.00 ATOM 901 C ILE 111 19.948 6.543 56.332 1.00 0.00 ATOM 902 N THR 112 19.288 6.480 55.177 1.00 0.00 ATOM 903 CA THR 112 18.223 5.500 54.992 1.00 0.00 ATOM 904 CB THR 112 17.040 6.010 54.113 1.00 0.00 ATOM 905 CG2 THR 112 17.277 7.408 53.676 1.00 0.00 ATOM 906 OG1 THR 112 16.810 5.150 52.996 1.00 0.00 ATOM 907 O THR 112 18.131 3.122 54.735 1.00 0.00 ATOM 908 C THR 112 18.779 4.157 54.548 1.00 0.00 ATOM 909 N TRP 113 20.010 4.175 54.033 1.00 0.00 ATOM 910 CA TRP 113 20.674 2.948 53.611 1.00 0.00 ATOM 911 CB TRP 113 21.907 3.234 52.732 1.00 0.00 ATOM 912 CG TRP 113 22.637 1.992 52.313 1.00 0.00 ATOM 913 CD1 TRP 113 23.859 1.585 52.761 1.00 0.00 ATOM 914 CD2 TRP 113 22.123 0.916 51.513 1.00 0.00 ATOM 915 CE2 TRP 113 23.084 -0.124 51.559 1.00 0.00 ATOM 916 CE3 TRP 113 20.935 0.722 50.773 1.00 0.00 ATOM 917 NE1 TRP 113 24.126 0.317 52.325 1.00 0.00 ATOM 918 CZ2 TRP 113 22.898 -1.361 50.885 1.00 0.00 ATOM 919 CZ3 TRP 113 20.742 -0.512 50.097 1.00 0.00 ATOM 920 CH2 TRP 113 21.723 -1.537 50.166 1.00 0.00 ATOM 921 O TRP 113 20.847 0.959 54.949 1.00 0.00 ATOM 922 C TRP 113 21.061 2.172 54.869 1.00 0.00 ATOM 923 N ASP 114 21.576 2.904 55.856 1.00 0.00 ATOM 924 CA ASP 114 21.976 2.338 57.143 1.00 0.00 ATOM 925 CB ASP 114 22.715 3.381 57.986 1.00 0.00 ATOM 926 CG ASP 114 24.002 3.886 57.323 1.00 0.00 ATOM 927 OD1 ASP 114 24.585 3.178 56.469 1.00 0.00 ATOM 928 OD2 ASP 114 24.437 5.012 57.659 1.00 0.00 ATOM 929 O ASP 114 20.752 0.767 58.495 1.00 0.00 ATOM 930 C ASP 114 20.726 1.834 57.871 1.00 0.00 ATOM 931 N PHE 115 19.616 2.562 57.707 1.00 0.00 ATOM 932 CA PHE 115 18.335 2.185 58.304 1.00 0.00 ATOM 933 CB PHE 115 17.258 3.268 58.068 1.00 0.00 ATOM 934 CG PHE 115 15.855 2.818 58.403 1.00 0.00 ATOM 935 CD1 PHE 115 14.930 2.549 57.384 1.00 0.00 ATOM 936 CD2 PHE 115 15.467 2.613 59.730 1.00 0.00 ATOM 937 CE1 PHE 115 13.636 2.053 57.678 1.00 0.00 ATOM 938 CE2 PHE 115 14.181 2.114 60.036 1.00 0.00 ATOM 939 CZ PHE 115 13.261 1.840 59.010 1.00 0.00 ATOM 940 O PHE 115 17.567 -0.067 58.558 1.00 0.00 ATOM 941 C PHE 115 17.856 0.830 57.766 1.00 0.00 ATOM 942 N ILE 116 17.778 0.687 56.439 1.00 0.00 ATOM 943 CA ILE 116 17.305 -0.565 55.851 1.00 0.00 ATOM 944 CB ILE 116 16.845 -0.439 54.363 1.00 0.00 ATOM 945 CG1 ILE 116 18.009 -0.285 53.395 1.00 0.00 ATOM 946 CG2 ILE 116 15.913 0.731 54.212 1.00 0.00 ATOM 947 CD1 ILE 116 17.573 -0.394 51.942 1.00 0.00 ATOM 948 O ILE 116 17.812 -2.904 56.053 1.00 0.00 ATOM 949 C ILE 116 18.242 -1.746 56.076 1.00 0.00 ATOM 950 N SER 117 19.500 -1.433 56.383 1.00 0.00 ATOM 951 CA SER 117 20.502 -2.449 56.679 1.00 0.00 ATOM 952 CB SER 117 21.915 -1.875 56.585 1.00 0.00 ATOM 953 OG SER 117 22.242 -1.565 55.238 1.00 0.00 ATOM 954 O SER 117 20.766 -4.120 58.387 1.00 0.00 ATOM 955 C SER 117 20.263 -3.041 58.075 1.00 0.00 ATOM 956 N ASN 118 19.467 -2.351 58.893 1.00 0.00 ATOM 957 CA ASN 118 19.145 -2.827 60.232 1.00 0.00 ATOM 958 CB ASN 118 19.505 -1.777 61.280 1.00 0.00 ATOM 959 CG ASN 118 21.005 -1.592 61.426 1.00 0.00 ATOM 960 ND2 ASN 118 21.419 -0.373 61.755 1.00 0.00 ATOM 961 OD1 ASN 118 21.784 -2.537 61.254 1.00 0.00 ATOM 962 O ASN 118 17.233 -3.562 61.495 1.00 0.00 ATOM 963 C ASN 118 17.698 -3.297 60.380 1.00 0.00 ATOM 964 N VAL 119 16.996 -3.414 59.252 1.00 0.00 ATOM 965 CA VAL 119 15.609 -3.886 59.250 1.00 0.00 ATOM 966 CB VAL 119 14.702 -3.074 58.272 1.00 0.00 ATOM 967 CG1 VAL 119 13.261 -3.553 58.336 1.00 0.00 ATOM 968 CG2 VAL 119 14.743 -1.605 58.606 1.00 0.00 ATOM 969 O VAL 119 15.807 -5.680 57.677 1.00 0.00 ATOM 970 C VAL 119 15.638 -5.355 58.849 1.00 0.00 ATOM 971 N ASN 120 15.447 -6.227 59.837 1.00 0.00 ATOM 972 CA ASN 120 15.457 -7.683 59.658 1.00 0.00 ATOM 973 CB ASN 120 15.118 -8.411 60.964 1.00 0.00 ATOM 974 CG ASN 120 16.201 -8.252 62.022 1.00 0.00 ATOM 975 ND2 ASN 120 17.422 -8.666 61.692 1.00 0.00 ATOM 976 OD1 ASN 120 15.940 -7.759 63.119 1.00 0.00 ATOM 977 O ASN 120 15.170 -9.002 57.726 1.00 0.00 ATOM 978 C ASN 120 14.629 -8.257 58.520 1.00 0.00 ATOM 979 N SER 121 13.367 -7.854 58.372 1.00 0.00 ATOM 980 CA SER 121 12.525 -8.374 57.285 1.00 0.00 ATOM 981 CB SER 121 11.106 -7.850 57.422 1.00 0.00 ATOM 982 OG SER 121 11.124 -6.447 57.554 1.00 0.00 ATOM 983 O SER 121 12.791 -8.809 54.913 1.00 0.00 ATOM 984 C SER 121 13.085 -8.082 55.878 1.00 0.00 ATOM 985 N ILE 122 13.908 -7.032 55.786 1.00 0.00 ATOM 986 CA ILE 122 14.565 -6.669 54.541 1.00 0.00 ATOM 987 CB ILE 122 14.841 -5.136 54.410 1.00 0.00 ATOM 988 CG1 ILE 122 13.523 -4.375 54.262 1.00 0.00 ATOM 989 CG2 ILE 122 15.745 -4.836 53.191 1.00 0.00 ATOM 990 CD1 ILE 122 13.663 -2.860 54.416 1.00 0.00 ATOM 991 O ILE 122 15.986 -8.285 53.527 1.00 0.00 ATOM 992 C ILE 122 15.869 -7.465 54.433 1.00 0.00 ATOM 993 N THR 123 16.818 -7.276 55.359 1.00 0.00 ATOM 994 CA THR 123 18.093 -8.002 55.271 1.00 0.00 ATOM 995 CB THR 123 19.184 -7.606 56.314 1.00 0.00 ATOM 996 CG2 THR 123 19.611 -6.187 56.165 1.00 0.00 ATOM 997 OG1 THR 123 18.737 -7.879 57.647 1.00 0.00 ATOM 998 O THR 123 18.861 -10.147 54.686 1.00 0.00 ATOM 999 C THR 123 18.024 -9.510 55.306 1.00 0.00 ATOM 1000 N ARG 124 17.044 -10.084 56.005 1.00 0.00 ATOM 1001 CA ARG 124 16.942 -11.540 56.080 1.00 0.00 ATOM 1002 CB ARG 124 16.093 -11.999 57.277 1.00 0.00 ATOM 1003 CG ARG 124 16.567 -11.417 58.644 1.00 0.00 ATOM 1004 CD ARG 124 17.119 -12.442 59.644 1.00 0.00 ATOM 1005 NE ARG 124 16.308 -12.736 60.847 1.00 0.00 ATOM 1006 CZ ARG 124 15.007 -13.050 60.881 1.00 0.00 ATOM 1007 NH1 ARG 124 14.260 -13.094 59.781 1.00 0.00 ATOM 1008 NH2 ARG 124 14.484 -13.497 62.012 1.00 0.00 ATOM 1009 O ARG 124 16.839 -13.294 54.480 1.00 0.00 ATOM 1010 C ARG 124 16.487 -12.154 54.759 1.00 0.00 ATOM 1011 N ASN 125 15.783 -11.374 53.927 1.00 0.00 ATOM 1012 CA ASN 125 15.344 -11.802 52.580 1.00 0.00 ATOM 1013 CB ASN 125 14.178 -10.919 52.063 1.00 0.00 ATOM 1014 CG ASN 125 13.700 -11.299 50.633 1.00 0.00 ATOM 1015 ND2 ASN 125 12.390 -11.291 50.435 1.00 0.00 ATOM 1016 OD1 ASN 125 14.499 -11.548 49.723 1.00 0.00 ATOM 1017 O ASN 125 16.848 -10.508 51.188 1.00 0.00 ATOM 1018 C ASN 125 16.599 -11.609 51.706 1.00 0.00 ATOM 1019 N ALA 126 17.346 -12.700 51.526 1.00 0.00 ATOM 1020 CA ALA 126 18.611 -12.726 50.783 1.00 0.00 ATOM 1021 CB ALA 126 19.195 -14.129 50.790 1.00 0.00 ATOM 1022 O ALA 126 19.440 -11.285 49.067 1.00 0.00 ATOM 1023 C ALA 126 18.613 -12.155 49.372 1.00 0.00 ATOM 1024 N THR 127 17.651 -12.576 48.548 1.00 0.00 ATOM 1025 CA THR 127 17.571 -12.106 47.168 1.00 0.00 ATOM 1026 CB THR 127 16.692 -13.000 46.289 1.00 0.00 ATOM 1027 CG2 THR 127 17.319 -14.382 46.138 1.00 0.00 ATOM 1028 OG1 THR 127 15.376 -13.106 46.856 1.00 0.00 ATOM 1029 O THR 127 17.654 -10.039 46.012 1.00 0.00 ATOM 1030 C THR 127 17.179 -10.652 46.966 1.00 0.00 ATOM 1031 N LEU 128 16.356 -10.092 47.861 1.00 0.00 ATOM 1032 CA LEU 128 15.939 -8.680 47.763 1.00 0.00 ATOM 1033 CB LEU 128 14.759 -8.368 48.693 1.00 0.00 ATOM 1034 CG LEU 128 13.741 -7.214 48.551 1.00 0.00 ATOM 1035 CD1 LEU 128 13.320 -6.874 49.962 1.00 0.00 ATOM 1036 CD2 LEU 128 14.232 -5.935 47.852 1.00 0.00 ATOM 1037 O LEU 128 17.331 -6.738 47.548 1.00 0.00 ATOM 1038 C LEU 128 17.106 -7.786 48.164 1.00 0.00 ATOM 1039 N TYR 129 17.840 -8.218 49.188 1.00 0.00 ATOM 1040 CA TYR 129 18.978 -7.469 49.705 1.00 0.00 ATOM 1041 CB TYR 129 19.314 -7.899 51.148 1.00 0.00 ATOM 1042 CG TYR 129 20.211 -6.938 51.899 1.00 0.00 ATOM 1043 CD1 TYR 129 21.345 -7.407 52.573 1.00 0.00 ATOM 1044 CD2 TYR 129 19.967 -5.543 51.898 1.00 0.00 ATOM 1045 CE1 TYR 129 22.235 -6.517 53.228 1.00 0.00 ATOM 1046 CE2 TYR 129 20.853 -4.640 52.550 1.00 0.00 ATOM 1047 CZ TYR 129 21.984 -5.141 53.206 1.00 0.00 ATOM 1048 OH TYR 129 22.883 -4.290 53.814 1.00 0.00 ATOM 1049 O TYR 129 20.822 -6.438 48.596 1.00 0.00 ATOM 1050 C TYR 129 20.195 -7.485 48.772 1.00 0.00 ATOM 1051 N ASP 130 20.492 -8.637 48.144 1.00 0.00 ATOM 1052 CA ASP 130 21.611 -8.749 47.172 1.00 0.00 ATOM 1053 CB ASP 130 21.778 -10.166 46.596 1.00 0.00 ATOM 1054 CG ASP 130 22.079 -11.221 47.652 1.00 0.00 ATOM 1055 OD1 ASP 130 22.805 -10.942 48.630 1.00 0.00 ATOM 1056 OD2 ASP 130 21.576 -12.356 47.492 1.00 0.00 ATOM 1057 O ASP 130 22.084 -7.024 45.571 1.00 0.00 ATOM 1058 C ASP 130 21.258 -7.830 46.008 1.00 0.00 ATOM 1059 N ALA 131 19.989 -7.908 45.594 1.00 0.00 ATOM 1060 CA ALA 131 19.445 -7.081 44.526 1.00 0.00 ATOM 1061 CB ALA 131 17.994 -7.407 44.300 1.00 0.00 ATOM 1062 O ALA 131 20.089 -4.840 43.955 1.00 0.00 ATOM 1063 C ALA 131 19.626 -5.591 44.813 1.00 0.00 ATOM 1064 N LEU 132 19.396 -5.224 46.073 1.00 0.00 ATOM 1065 CA LEU 132 19.515 -3.863 46.566 1.00 0.00 ATOM 1066 CB LEU 132 18.859 -3.787 47.937 1.00 0.00 ATOM 1067 CG LEU 132 17.812 -2.754 48.335 1.00 0.00 ATOM 1068 CD1 LEU 132 17.048 -2.181 47.171 1.00 0.00 ATOM 1069 CD2 LEU 132 16.880 -3.459 49.286 1.00 0.00 ATOM 1070 O LEU 132 21.283 -2.255 46.345 1.00 0.00 ATOM 1071 C LEU 132 20.973 -3.413 46.651 1.00 0.00 ATOM 1072 N LYS 133 21.855 -4.328 47.073 1.00 0.00 ATOM 1073 CA LYS 133 23.300 -4.061 47.181 1.00 0.00 ATOM 1074 CB LYS 133 24.025 -5.180 47.937 1.00 0.00 ATOM 1075 CG LYS 133 23.991 -5.060 49.455 1.00 0.00 ATOM 1076 CD LYS 133 25.045 -5.949 50.097 1.00 0.00 ATOM 1077 CE LYS 133 24.525 -7.350 50.354 1.00 0.00 ATOM 1078 NZ LYS 133 25.589 -8.262 50.852 1.00 0.00 ATOM 1079 O LYS 133 24.671 -2.998 45.527 1.00 0.00 ATOM 1080 C LYS 133 23.922 -3.942 45.795 1.00 0.00 ATOM 1081 N ALA 134 23.568 -4.884 44.915 1.00 0.00 ATOM 1082 CA ALA 134 24.055 -4.928 43.536 1.00 0.00 ATOM 1083 CB ALA 134 23.463 -6.091 42.821 1.00 0.00 ATOM 1084 O ALA 134 24.523 -3.022 42.193 1.00 0.00 ATOM 1085 C ALA 134 23.681 -3.658 42.822 1.00 0.00 ATOM 1086 N MET 135 22.433 -3.244 43.039 1.00 0.00 ATOM 1087 CA MET 135 21.874 -2.036 42.456 1.00 0.00 ATOM 1088 CB MET 135 20.379 -1.958 42.771 1.00 0.00 ATOM 1089 CG MET 135 19.582 -0.926 41.996 1.00 0.00 ATOM 1090 SD MET 135 17.805 -1.586 41.765 1.00 0.00 ATOM 1091 CE MET 135 18.151 -2.601 40.141 1.00 0.00 ATOM 1092 O MET 135 22.923 0.089 42.163 1.00 0.00 ATOM 1093 C MET 135 22.615 -0.794 42.958 1.00 0.00 ATOM 1094 N LYS 136 22.983 -0.774 44.241 1.00 0.00 ATOM 1095 CA LYS 136 23.698 0.371 44.816 1.00 0.00 ATOM 1096 CB LYS 136 23.585 0.390 46.353 1.00 0.00 ATOM 1097 CG LYS 136 24.126 1.694 46.953 1.00 0.00 ATOM 1098 CD LYS 136 23.842 1.938 48.400 1.00 0.00 ATOM 1099 CE LYS 136 24.349 3.333 48.785 1.00 0.00 ATOM 1100 NZ LYS 136 23.337 4.165 49.506 1.00 0.00 ATOM 1101 O LYS 136 25.711 1.628 44.371 1.00 0.00 ATOM 1102 C LYS 136 25.178 0.508 44.430 1.00 0.00 ATOM 1103 N PHE 137 25.827 -0.615 44.131 1.00 0.00 ATOM 1104 CA PHE 137 27.262 -0.599 43.844 1.00 0.00 ATOM 1105 CB PHE 137 27.981 -1.510 44.848 1.00 0.00 ATOM 1106 CG PHE 137 27.645 -1.196 46.284 1.00 0.00 ATOM 1107 CD1 PHE 137 27.138 -2.199 47.123 1.00 0.00 ATOM 1108 CD2 PHE 137 27.903 0.077 46.829 1.00 0.00 ATOM 1109 CE1 PHE 137 26.807 -1.925 48.472 1.00 0.00 ATOM 1110 CE2 PHE 137 27.582 0.373 48.180 1.00 0.00 ATOM 1111 CZ PHE 137 27.067 -0.641 49.013 1.00 0.00 ATOM 1112 O PHE 137 27.870 -2.053 42.035 1.00 0.00 ATOM 1113 C PHE 137 27.765 -0.870 42.427 1.00 0.00 ATOM 1114 N VAL 142 24.915 0.306 36.595 1.00 0.00 ATOM 1115 CA VAL 142 24.964 1.716 36.014 1.00 0.00 ATOM 1116 CB VAL 142 25.382 1.700 34.637 1.00 0.00 ATOM 1117 CG1 VAL 142 24.277 1.474 33.845 1.00 0.00 ATOM 1118 CG2 VAL 142 26.190 3.029 34.203 1.00 0.00 ATOM 1119 O VAL 142 22.862 0.939 35.665 1.00 0.00 ATOM 1120 C VAL 142 23.444 1.786 36.197 1.00 0.00 ATOM 1121 N TRP 143 23.131 3.054 36.481 1.00 0.00 ATOM 1122 CA TRP 143 22.456 3.236 37.832 1.00 0.00 ATOM 1123 CB TRP 143 23.656 3.686 38.747 1.00 0.00 ATOM 1124 CG TRP 143 23.486 4.928 39.537 1.00 0.00 ATOM 1125 CD1 TRP 143 23.708 6.159 39.147 1.00 0.00 ATOM 1126 CD2 TRP 143 23.078 4.995 40.826 1.00 0.00 ATOM 1127 CE2 TRP 143 23.107 6.293 41.196 1.00 0.00 ATOM 1128 CE3 TRP 143 22.736 4.073 41.742 1.00 0.00 ATOM 1129 NE1 TRP 143 23.489 7.009 40.131 1.00 0.00 ATOM 1130 CZ2 TRP 143 22.753 6.677 42.359 1.00 0.00 ATOM 1131 CZ3 TRP 143 22.390 4.459 42.860 1.00 0.00 ATOM 1132 CH2 TRP 143 22.409 5.730 43.203 1.00 0.00 ATOM 1133 O TRP 143 21.955 5.217 36.995 1.00 0.00 ATOM 1134 C TRP 143 21.670 4.394 37.717 1.00 0.00 ATOM 1135 N SER 144 20.710 4.537 38.544 1.00 0.00 ATOM 1136 CA SER 144 19.829 5.546 38.219 1.00 0.00 ATOM 1137 CB SER 144 18.849 4.812 37.424 1.00 0.00 ATOM 1138 OG SER 144 17.716 5.567 37.347 1.00 0.00 ATOM 1139 O SER 144 19.128 4.930 40.190 1.00 0.00 ATOM 1140 C SER 144 19.328 5.788 39.496 1.00 0.00 ATOM 1141 N GLU 145 19.195 7.025 39.873 1.00 0.00 ATOM 1142 CA GLU 145 18.744 7.329 41.212 1.00 0.00 ATOM 1143 CB GLU 145 18.863 8.825 41.486 1.00 0.00 ATOM 1144 CG GLU 145 19.431 9.118 42.870 1.00 0.00 ATOM 1145 CD GLU 145 19.195 10.541 43.339 1.00 0.00 ATOM 1146 OE1 GLU 145 18.108 11.100 43.069 1.00 0.00 ATOM 1147 OE2 GLU 145 20.092 11.096 44.008 1.00 0.00 ATOM 1148 O GLU 145 17.015 6.118 42.311 1.00 0.00 ATOM 1149 C GLU 145 17.311 6.852 41.376 1.00 0.00 ATOM 1150 N ALA 146 16.499 7.111 40.348 1.00 0.00 ATOM 1151 CA ALA 146 15.086 6.733 40.303 1.00 0.00 ATOM 1152 CB ALA 146 14.459 7.245 39.013 1.00 0.00 ATOM 1153 O ALA 146 13.886 4.869 41.250 1.00 0.00 ATOM 1154 C ALA 146 14.790 5.230 40.488 1.00 0.00 ATOM 1155 N ARG 147 15.574 4.365 39.841 1.00 0.00 ATOM 1156 CA ARG 147 15.382 2.909 39.943 1.00 0.00 ATOM 1157 CB ARG 147 16.227 2.162 38.915 1.00 0.00 ATOM 1158 CG ARG 147 15.711 0.755 38.557 1.00 0.00 ATOM 1159 CD ARG 147 16.659 -0.046 37.634 1.00 0.00 ATOM 1160 NE ARG 147 17.441 0.760 36.683 1.00 0.00 ATOM 1161 CZ ARG 147 16.946 1.506 35.687 1.00 0.00 ATOM 1162 NH1 ARG 147 15.634 1.577 35.469 1.00 0.00 ATOM 1163 NH2 ARG 147 17.768 2.261 34.971 1.00 0.00 ATOM 1164 O ARG 147 15.013 1.554 41.882 1.00 0.00 ATOM 1165 C ARG 147 15.738 2.383 41.329 1.00 0.00 ATOM 1166 N PHE 148 16.874 2.850 41.858 1.00 0.00 ATOM 1167 CA PHE 148 17.344 2.463 43.187 1.00 0.00 ATOM 1168 CB PHE 148 18.751 3.021 43.460 1.00 0.00 ATOM 1169 CG PHE 148 19.286 2.679 44.822 1.00 0.00 ATOM 1170 CD1 PHE 148 19.555 3.698 45.758 1.00 0.00 ATOM 1171 CD2 PHE 148 19.464 1.335 45.208 1.00 0.00 ATOM 1172 CE1 PHE 148 19.994 3.389 47.070 1.00 0.00 ATOM 1173 CE2 PHE 148 19.900 1.007 46.513 1.00 0.00 ATOM 1174 CZ PHE 148 20.163 2.042 47.446 1.00 0.00 ATOM 1175 O PHE 148 15.955 2.246 45.119 1.00 0.00 ATOM 1176 C PHE 148 16.346 2.980 44.224 1.00 0.00 ATOM 1177 N SER 149 15.904 4.223 44.029 1.00 0.00 ATOM 1178 CA SER 149 14.934 4.899 44.884 1.00 0.00 ATOM 1179 CB SER 149 14.615 6.281 44.314 1.00 0.00 ATOM 1180 OG SER 149 14.745 7.295 45.285 1.00 0.00 ATOM 1181 O SER 149 13.172 3.746 46.039 1.00 0.00 ATOM 1182 C SER 149 13.648 4.080 44.948 1.00 0.00 ATOM 1183 N GLY 150 13.163 3.686 43.767 1.00 0.00 ATOM 1184 CA GLY 150 11.949 2.895 43.649 1.00 0.00 ATOM 1185 O GLY 150 11.127 0.882 44.637 1.00 0.00 ATOM 1186 C GLY 150 12.106 1.499 44.217 1.00 0.00 ATOM 1187 N MET 151 13.351 1.024 44.267 1.00 0.00 ATOM 1188 CA MET 151 13.644 -0.295 44.802 1.00 0.00 ATOM 1189 CB MET 151 14.875 -0.909 44.130 1.00 0.00 ATOM 1190 CG MET 151 14.957 -2.438 44.243 1.00 0.00 ATOM 1191 SD MET 151 13.931 -3.611 43.070 1.00 0.00 ATOM 1192 CE MET 151 12.344 -2.552 42.522 1.00 0.00 ATOM 1193 O MET 151 13.330 -1.226 46.979 1.00 0.00 ATOM 1194 C MET 151 13.750 -0.275 46.318 1.00 0.00 ATOM 1195 N VAL 152 14.251 0.835 46.863 1.00 0.00 ATOM 1196 CA VAL 152 14.354 1.022 48.309 1.00 0.00 ATOM 1197 CB VAL 152 15.152 2.310 48.660 1.00 0.00 ATOM 1198 CG1 VAL 152 14.989 2.701 50.143 1.00 0.00 ATOM 1199 CG2 VAL 152 16.617 2.095 48.355 1.00 0.00 ATOM 1200 O VAL 152 12.583 0.451 49.838 1.00 0.00 ATOM 1201 C VAL 152 12.918 1.104 48.844 1.00 0.00 ATOM 1202 N LYS 153 12.066 1.821 48.105 1.00 0.00 ATOM 1203 CA LYS 153 10.656 1.988 48.443 1.00 0.00 ATOM 1204 CB LYS 153 10.003 3.036 47.528 1.00 0.00 ATOM 1205 CG LYS 153 8.516 3.299 47.747 1.00 0.00 ATOM 1206 CD LYS 153 8.098 4.537 46.998 1.00 0.00 ATOM 1207 CE LYS 153 6.823 4.339 46.215 1.00 0.00 ATOM 1208 NZ LYS 153 6.626 5.492 45.285 1.00 0.00 ATOM 1209 O LYS 153 9.103 0.365 49.260 1.00 0.00 ATOM 1210 C LYS 153 9.936 0.632 48.394 1.00 0.00 ATOM 1211 N THR 154 10.330 -0.244 47.458 1.00 0.00 ATOM 1212 CA THR 154 9.750 -1.591 47.334 1.00 0.00 ATOM 1213 CB THR 154 10.259 -2.325 46.034 1.00 0.00 ATOM 1214 CG2 THR 154 9.842 -3.806 45.979 1.00 0.00 ATOM 1215 OG1 THR 154 9.734 -1.669 44.881 1.00 0.00 ATOM 1216 O THR 154 9.214 -2.999 49.210 1.00 0.00 ATOM 1217 C THR 154 10.100 -2.410 48.592 1.00 0.00 ATOM 1218 N ALA 155 11.377 -2.382 48.979 1.00 0.00 ATOM 1219 CA ALA 155 11.893 -3.083 50.160 1.00 0.00 ATOM 1220 CB ALA 155 13.396 -2.883 50.265 1.00 0.00 ATOM 1221 O ALA 155 10.846 -3.428 52.305 1.00 0.00 ATOM 1222 C ALA 155 11.228 -2.615 51.463 1.00 0.00 ATOM 1223 N LEU 156 11.113 -1.294 51.603 1.00 0.00 ATOM 1224 CA LEU 156 10.508 -0.631 52.752 1.00 0.00 ATOM 1225 CB LEU 156 10.653 0.876 52.562 1.00 0.00 ATOM 1226 CG LEU 156 11.475 1.757 53.494 1.00 0.00 ATOM 1227 CD1 LEU 156 12.519 0.971 54.249 1.00 0.00 ATOM 1228 CD2 LEU 156 12.084 2.867 52.675 1.00 0.00 ATOM 1229 O LEU 156 8.549 -1.341 53.938 1.00 0.00 ATOM 1230 C LEU 156 9.033 -1.018 52.859 1.00 0.00 ATOM 1231 N THR 157 8.355 -1.059 51.712 1.00 0.00 ATOM 1232 CA THR 157 6.949 -1.453 51.642 1.00 0.00 ATOM 1233 CB THR 157 6.360 -1.196 50.236 1.00 0.00 ATOM 1234 CG2 THR 157 4.879 -1.458 50.192 1.00 0.00 ATOM 1235 OG1 THR 157 6.567 0.174 49.894 1.00 0.00 ATOM 1236 O THR 157 5.891 -3.373 52.590 1.00 0.00 ATOM 1237 C THR 157 6.870 -2.937 51.984 1.00 0.00 ATOM 1238 N LEU 158 7.930 -3.686 51.649 1.00 0.00 ATOM 1239 CA LEU 158 7.974 -5.107 51.953 1.00 0.00 ATOM 1240 CB LEU 158 9.078 -5.859 51.180 1.00 0.00 ATOM 1241 CG LEU 158 9.270 -7.408 51.166 1.00 0.00 ATOM 1242 CD1 LEU 158 10.147 -7.900 52.327 1.00 0.00 ATOM 1243 CD2 LEU 158 7.942 -8.184 51.098 1.00 0.00 ATOM 1244 O LEU 158 7.354 -6.006 54.042 1.00 0.00 ATOM 1245 C LEU 158 8.121 -5.260 53.455 1.00 0.00 ATOM 1246 N ALA 159 8.998 -4.474 54.082 1.00 0.00 ATOM 1247 CA ALA 159 9.197 -4.549 55.534 1.00 0.00 ATOM 1248 CB ALA 159 10.225 -3.565 55.993 1.00 0.00 ATOM 1249 O ALA 159 7.593 -5.210 57.143 1.00 0.00 ATOM 1250 C ALA 159 7.912 -4.359 56.330 1.00 0.00 ATOM 1251 N VAL 160 7.126 -3.328 55.991 1.00 0.00 ATOM 1252 CA VAL 160 5.870 -3.043 56.690 1.00 0.00 ATOM 1253 CB VAL 160 5.306 -1.545 56.508 1.00 0.00 ATOM 1254 CG1 VAL 160 6.372 -0.566 56.106 1.00 0.00 ATOM 1255 CG2 VAL 160 4.145 -1.478 55.575 1.00 0.00 ATOM 1256 O VAL 160 3.940 -4.341 57.180 1.00 0.00 ATOM 1257 C VAL 160 4.799 -4.062 56.353 1.00 0.00 ATOM 1258 N THR 161 4.850 -4.605 55.139 1.00 0.00 ATOM 1259 CA THR 161 3.862 -5.594 54.730 1.00 0.00 ATOM 1260 CB THR 161 3.764 -5.723 53.184 1.00 0.00 ATOM 1261 CG2 THR 161 4.686 -6.797 52.624 1.00 0.00 ATOM 1262 OG1 THR 161 2.425 -6.051 52.829 1.00 0.00 ATOM 1263 O THR 161 3.103 -7.536 55.906 1.00 0.00 ATOM 1264 C THR 161 4.080 -6.935 55.451 1.00 0.00 ATOM 1265 N THR 162 5.346 -7.369 55.591 1.00 0.00 ATOM 1266 CA THR 162 5.650 -8.622 56.300 1.00 0.00 ATOM 1267 CB THR 162 7.058 -9.312 55.945 1.00 0.00 ATOM 1268 CG2 THR 162 7.973 -8.420 55.224 1.00 0.00 ATOM 1269 OG1 THR 162 7.729 -9.764 57.134 1.00 0.00 ATOM 1270 O THR 162 5.093 -9.327 58.513 1.00 0.00 ATOM 1271 C THR 162 5.495 -8.405 57.800 1.00 0.00 ATOM 1272 N THR 163 5.765 -7.175 58.255 1.00 0.00 ATOM 1273 CA THR 163 5.620 -6.806 59.666 1.00 0.00 ATOM 1274 CB THR 163 6.219 -5.408 59.958 1.00 0.00 ATOM 1275 CG2 THR 163 5.794 -4.878 61.299 1.00 0.00 ATOM 1276 OG1 THR 163 7.654 -5.481 59.908 1.00 0.00 ATOM 1277 O THR 163 3.732 -7.410 61.016 1.00 0.00 ATOM 1278 C THR 163 4.129 -6.847 59.998 1.00 0.00 ATOM 1279 N LEU 164 3.314 -6.353 59.074 1.00 0.00 ATOM 1280 CA LEU 164 1.869 -6.356 59.240 1.00 0.00 ATOM 1281 CB LEU 164 1.221 -5.563 58.123 1.00 0.00 ATOM 1282 CG LEU 164 0.487 -4.259 58.401 1.00 0.00 ATOM 1283 CD1 LEU 164 0.958 -3.483 59.646 1.00 0.00 ATOM 1284 CD2 LEU 164 0.669 -3.467 57.139 1.00 0.00 ATOM 1285 O LEU 164 0.300 -8.035 59.905 1.00 0.00 ATOM 1286 C LEU 164 1.300 -7.765 59.236 1.00 0.00 ATOM 1287 N LYS 165 1.979 -8.665 58.522 1.00 0.00 ATOM 1288 CA LYS 165 1.546 -10.052 58.420 1.00 0.00 ATOM 1289 CB LYS 165 2.138 -10.732 57.179 1.00 0.00 ATOM 1290 CG LYS 165 1.466 -12.069 56.778 1.00 0.00 ATOM 1291 CD LYS 165 0.331 -11.932 55.741 1.00 0.00 ATOM 1292 CE LYS 165 -1.083 -11.695 56.311 1.00 0.00 ATOM 1293 NZ LYS 165 -1.411 -10.246 56.530 1.00 0.00 ATOM 1294 O LYS 165 1.079 -11.780 59.993 1.00 0.00 ATOM 1295 C LYS 165 1.835 -10.870 59.670 1.00 0.00 ATOM 1296 N GLU 166 2.885 -10.499 60.402 1.00 0.00 ATOM 1297 CA GLU 166 3.265 -11.200 61.631 1.00 0.00 ATOM 1298 CB GLU 166 4.714 -10.888 62.012 1.00 0.00 ATOM 1299 CG GLU 166 5.768 -11.401 61.040 1.00 0.00 ATOM 1300 CD GLU 166 5.678 -12.898 60.749 1.00 0.00 ATOM 1301 OE1 GLU 166 5.849 -13.712 61.684 1.00 0.00 ATOM 1302 OE2 GLU 166 5.445 -13.254 59.573 1.00 0.00 ATOM 1303 O GLU 166 2.418 -11.583 63.849 1.00 0.00 ATOM 1304 C GLU 166 2.343 -10.914 62.815 1.00 0.00 ATOM 1305 N LEU 167 1.463 -9.929 62.639 1.00 0.00 ATOM 1306 CA LEU 167 0.500 -9.531 63.658 1.00 0.00 ATOM 1307 CB LEU 167 0.445 -7.996 63.768 1.00 0.00 ATOM 1308 CG LEU 167 1.782 -7.258 63.960 1.00 0.00 ATOM 1309 CD1 LEU 167 1.617 -5.775 63.745 1.00 0.00 ATOM 1310 CD2 LEU 167 2.378 -7.536 65.317 1.00 0.00 ATOM 1311 O LEU 167 -1.809 -9.922 64.194 1.00 0.00 ATOM 1312 C LEU 167 -0.896 -10.133 63.402 1.00 0.00 ATOM 1313 N THR 168 -1.055 -10.827 62.268 1.00 0.00 ATOM 1314 CA THR 168 -2.285 -11.536 61.837 1.00 0.00 ATOM 1315 CB THR 168 -3.490 -10.610 61.355 1.00 0.00 ATOM 1316 CG2 THR 168 -4.338 -10.077 62.524 1.00 0.00 ATOM 1317 OG1 THR 168 -3.006 -9.537 60.541 1.00 0.00 ATOM 1318 O THR 168 -1.735 -13.658 60.854 1.00 0.00 ATOM 1319 C THR 168 -1.896 -12.435 60.653 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 T0361.undertaker-align.pdb looking for model 1 # WARNING: incomplete conformation T0361 can't currently be optimized by undertaker # command:# naming current conformation align1 # command:# fraction of real conformation used = 0.366 # GDT_score = -14.482 # GDT_score(maxd=8.000,maxw=2.900)= -14.488 # GDT_score(maxd=8.000,maxw=3.200)= -13.816 # GDT_score(maxd=8.000,maxw=3.500)= -13.211 # GDT_score(maxd=10.000,maxw=3.800)= -14.124 # GDT_score(maxd=10.000,maxw=4.000)= -13.753 # GDT_score(maxd=10.000,maxw=4.200)= -13.399 # GDT_score(maxd=12.000,maxw=4.300)= -14.537 # GDT_score(maxd=12.000,maxw=4.500)= -14.167 # GDT_score(maxd=12.000,maxw=4.700)= -13.823 # GDT_score(maxd=14.000,maxw=5.200)= -14.202 # GDT_score(maxd=14.000,maxw=5.500)= -13.699 # command:# ReadConformPDB reading from PDB file T0361.undertaker-align.pdb looking for model 2 # WARNING: incomplete conformation T0361 can't currently be optimized by undertaker # command:# naming current conformation align2 # command:# fraction of real conformation used = 0.720 # GDT_score = -14.939 # GDT_score(maxd=8.000,maxw=2.900)= -14.964 # GDT_score(maxd=8.000,maxw=3.200)= -14.551 # GDT_score(maxd=8.000,maxw=3.500)= -14.172 # GDT_score(maxd=10.000,maxw=3.800)= -15.108 # GDT_score(maxd=10.000,maxw=4.000)= -14.805 # GDT_score(maxd=10.000,maxw=4.200)= -14.477 # GDT_score(maxd=12.000,maxw=4.300)= -15.781 # GDT_score(maxd=12.000,maxw=4.500)= -15.432 # GDT_score(maxd=12.000,maxw=4.700)= -15.075 # GDT_score(maxd=14.000,maxw=5.200)= -15.651 # GDT_score(maxd=14.000,maxw=5.500)= -15.070 # command:# ReadConformPDB reading from PDB file T0361.undertaker-align.pdb looking for model 3 # WARNING: incomplete conformation T0361 can't currently be optimized by undertaker # command:# naming current conformation align3 # command:# ReadConformPDB reading from PDB file T0361.undertaker-align.pdb looking for model 4 # WARNING: incomplete conformation T0361 can't currently be optimized by undertaker # command:# naming current conformation align4 # command:# ReadConformPDB reading from PDB file T0361.undertaker-align.pdb looking for model 5 # WARNING: incomplete conformation T0361 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 146 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ../model2.ts-submitted looking for model 1 # Found a chain break before 129 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ../model3.ts-submitted looking for model 1 # Found a chain break before 137 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ../model4.ts-submitted looking for model 1 # Found a chain break before 136 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ../model5.ts-submitted looking for model 1 # Found a chain break before 136 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ROBETTA_deNovo1.repack.pdb.gz looking for model 1 # ReadConformPDB reading from PDB file ROBETTA_deNovo10.repack.pdb.gz looking for model 1 # ReadConformPDB reading from PDB file ROBETTA_deNovo2.repack.pdb.gz looking for model 1 # Found a chain break before 136 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ROBETTA_deNovo3.repack.pdb.gz looking for model 1 # Found a chain break before 116 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ROBETTA_deNovo4.repack.pdb.gz looking for model 1 # Found a chain break before 1 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ROBETTA_deNovo5.repack.pdb.gz looking for model 1 # ReadConformPDB reading from PDB file ROBETTA_deNovo6.repack.pdb.gz looking for model 1 # ReadConformPDB reading from PDB file ROBETTA_deNovo7.repack.pdb.gz looking for model 1 # Found a chain break before 106 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ROBETTA_deNovo8.repack.pdb.gz looking for model 1 # Found a chain break before 16 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ROBETTA_deNovo9.repack.pdb.gz looking for model 1 # ReadConformPDB reading from PDB file ROBETTA_parent1.repack.pdb.gz looking for model 1 # Found a chain break before 150 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ROBETTA_parent2.repack.pdb.gz looking for model 1 # Found a chain break before 152 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ROBETTA_parent3.repack.pdb.gz looking for model 1 # Found a chain break before 146 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ROBETTA_parent4.repack.pdb.gz looking for model 1 # Found a chain break before 146 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ROBETTA_parent5.repack.pdb.gz looking for model 1 # Found a chain break before 149 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try1-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 105 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try1-opt1.pdb.gz looking for model 1 # Found a chain break before 105 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try1-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 129 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try1-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 129 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try1-opt2.pdb.gz looking for model 1 # Found a chain break before 167 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try1-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 167 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try10-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 161 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try10-opt1.pdb.gz looking for model 1 # Found a chain break before 161 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try10-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 161 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try10-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 161 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try10-opt2.pdb.gz looking for model 1 # Found a chain break before 161 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try10-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 161 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try11-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 136 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try11-opt1.pdb.gz looking for model 1 # Found a chain break before 136 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try11-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 119 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try11-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 119 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try11-opt2.pdb.gz looking for model 1 # Found a chain break before 136 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try11-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 136 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try12-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 156 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try12-opt1.pdb.gz looking for model 1 # Found a chain break before 156 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try12-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 106 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try12-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 106 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try12-opt2.pdb.gz looking for model 1 # Found a chain break before 156 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try12-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 156 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try13-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 167 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try13-opt1.pdb.gz looking for model 1 # Found a chain break before 167 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try13-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 133 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try13-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 133 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try13-opt2.pdb.gz looking for model 1 # Found a chain break before 167 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try13-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 167 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try14-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 133 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try14-opt1.pdb.gz looking for model 1 # Found a chain break before 133 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try14-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 133 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try14-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 133 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try14-opt2.pdb.gz looking for model 1 # Found a chain break before 136 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try14-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 136 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try15-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 129 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try15-opt1.pdb.gz looking for model 1 # Found a chain break before 129 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try15-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 154 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try15-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 154 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try15-opt2.pdb.gz looking for model 1 # Found a chain break before 126 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try15-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 126 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try16-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 81 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try16-opt1.pdb.gz looking for model 1 # Found a chain break before 81 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try16-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 81 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try16-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 81 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try16-opt2.pdb.gz looking for model 1 # Found a chain break before 81 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try16-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 81 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try17-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 125 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try17-opt1.pdb.gz looking for model 1 # Found a chain break before 125 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try17-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 125 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try17-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 125 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try17-opt2.pdb.gz looking for model 1 # Found a chain break before 125 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try17-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 125 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try18-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 136 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try18-opt1.pdb.gz looking for model 1 # Found a chain break before 136 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try18-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 98 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try18-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 98 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try18-opt2.pdb.gz looking for model 1 # Found a chain break before 136 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try18-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 136 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try19-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 137 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try19-opt1.pdb.gz looking for model 1 # Found a chain break before 137 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try19-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 55 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try19-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 55 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try19-opt2.pdb.gz looking for model 1 # Found a chain break before 137 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try19-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 137 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try2-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 137 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try2-opt1.pdb.gz looking for model 1 # Found a chain break before 137 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try2-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 53 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try2-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 53 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try2-opt2.pdb.gz looking for model 1 # Found a chain break before 137 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try2-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 137 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try20-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 165 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try20-opt1.pdb.gz looking for model 1 # Found a chain break before 165 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try20-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 101 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try20-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 101 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try20-opt2.pdb.gz looking for model 1 # Found a chain break before 165 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try20-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 165 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try3-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 167 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try3-opt1.pdb.gz looking for model 1 # Found a chain break before 167 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try3-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 134 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try3-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 134 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try3-opt2.pdb.gz looking for model 1 # Found a chain break before 167 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try3-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 167 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try4-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 167 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try4-opt1.pdb.gz looking for model 1 # Found a chain break before 167 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try4-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 133 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try4-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 133 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try4-opt2.pdb.gz looking for model 1 # Found a chain break before 167 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try4-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 167 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try5-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 137 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try5-opt1.pdb.gz looking for model 1 # Found a chain break before 137 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try5-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 53 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try5-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 53 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try5-opt2.pdb.gz looking for model 1 # Found a chain break before 137 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try5-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 137 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try6-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 136 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try6-opt1.pdb.gz looking for model 1 # Found a chain break before 136 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try6-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 99 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try6-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 99 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try6-opt2.pdb.gz looking for model 1 # Found a chain break before 136 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try6-opt2.ps.pdb.gz looking for model 1 # Found a chain break before 136 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try6-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 136 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try7-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 108 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try7-opt1.pdb.gz looking for model 1 # Found a chain break before 108 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try7-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 129 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try7-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 129 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try7-opt2.pdb.gz looking for model 1 # Found a chain break before 138 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try7-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 138 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try8-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 146 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try8-opt1.pdb.gz looking for model 1 # Found a chain break before 146 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try8-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 111 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try8-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 111 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try8-opt2.pdb.gz looking for model 1 # Found a chain break before 146 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try8-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 146 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try9-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 133 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try9-opt1.pdb.gz looking for model 1 # Found a chain break before 133 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try9-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 133 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try9-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 133 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try9-opt2.pdb.gz looking for model 1 # Found a chain break before 133 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0361.try9-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 133 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file servers/3D-JIGSAW_POPULUS_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0361 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_POPULUS_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1484202408.pdb -s /var/tmp/to_scwrl_1484202408.seq -o /var/tmp/from_scwrl_1484202408.pdb > /var/tmp/scwrl_1484202408.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1484202408.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 T0361 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_POPULUS_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_504534923.pdb -s /var/tmp/to_scwrl_504534923.seq -o /var/tmp/from_scwrl_504534923.pdb > /var/tmp/scwrl_504534923.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_504534923.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 T0361 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_POPULUS_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_370593081.pdb -s /var/tmp/to_scwrl_370593081.seq -o /var/tmp/from_scwrl_370593081.pdb > /var/tmp/scwrl_370593081.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_370593081.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 # Found a chain break before 154 # copying to AlignedFragments data structure # naming current conformation 3D-JIGSAW_POPULUS_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_949682058.pdb -s /var/tmp/to_scwrl_949682058.seq -o /var/tmp/from_scwrl_949682058.pdb > /var/tmp/scwrl_949682058.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_949682058.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 T0361 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_POPULUS_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_2022578082.pdb -s /var/tmp/to_scwrl_2022578082.seq -o /var/tmp/from_scwrl_2022578082.pdb > /var/tmp/scwrl_2022578082.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2022578082.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 T0361 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_RECOM_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1522028695.pdb -s /var/tmp/to_scwrl_1522028695.seq -o /var/tmp/from_scwrl_1522028695.pdb > /var/tmp/scwrl_1522028695.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1522028695.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 # Found a chain break before 154 # copying to AlignedFragments data structure # naming current conformation 3D-JIGSAW_RECOM_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1836900080.pdb -s /var/tmp/to_scwrl_1836900080.seq -o /var/tmp/from_scwrl_1836900080.pdb > /var/tmp/scwrl_1836900080.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1836900080.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 T0361 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_RECOM_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_478669172.pdb -s /var/tmp/to_scwrl_478669172.seq -o /var/tmp/from_scwrl_478669172.pdb > /var/tmp/scwrl_478669172.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_478669172.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 T0361 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_RECOM_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1957645427.pdb -s /var/tmp/to_scwrl_1957645427.seq -o /var/tmp/from_scwrl_1957645427.pdb > /var/tmp/scwrl_1957645427.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1957645427.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 T0361 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_RECOM_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1325247477.pdb -s /var/tmp/to_scwrl_1325247477.seq -o /var/tmp/from_scwrl_1325247477.pdb > /var/tmp/scwrl_1325247477.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1325247477.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 T0361 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1471009984.pdb -s /var/tmp/to_scwrl_1471009984.seq -o /var/tmp/from_scwrl_1471009984.pdb > /var/tmp/scwrl_1471009984.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1471009984.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 T0361 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1672212981.pdb -s /var/tmp/to_scwrl_1672212981.seq -o /var/tmp/from_scwrl_1672212981.pdb > /var/tmp/scwrl_1672212981.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1672212981.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 T0361 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_354558362.pdb -s /var/tmp/to_scwrl_354558362.seq -o /var/tmp/from_scwrl_354558362.pdb > /var/tmp/scwrl_354558362.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_354558362.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 T0361 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1798000297.pdb -s /var/tmp/to_scwrl_1798000297.seq -o /var/tmp/from_scwrl_1798000297.pdb > /var/tmp/scwrl_1798000297.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1798000297.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 T0361 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1468770193.pdb -s /var/tmp/to_scwrl_1468770193.seq -o /var/tmp/from_scwrl_1468770193.pdb > /var/tmp/scwrl_1468770193.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1468770193.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 155 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1000205686.pdb -s /var/tmp/to_scwrl_1000205686.seq -o /var/tmp/from_scwrl_1000205686.pdb > /var/tmp/scwrl_1000205686.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1000205686.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 141 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1033810924.pdb -s /var/tmp/to_scwrl_1033810924.seq -o /var/tmp/from_scwrl_1033810924.pdb > /var/tmp/scwrl_1033810924.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1033810924.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 160 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_953748071.pdb -s /var/tmp/to_scwrl_953748071.seq -o /var/tmp/from_scwrl_953748071.pdb > /var/tmp/scwrl_953748071.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_953748071.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 110 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_2145814811.pdb -s /var/tmp/to_scwrl_2145814811.seq -o /var/tmp/from_scwrl_2145814811.pdb > /var/tmp/scwrl_2145814811.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2145814811.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 138 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_482294215.pdb -s /var/tmp/to_scwrl_482294215.seq -o /var/tmp/from_scwrl_482294215.pdb > /var/tmp/scwrl_482294215.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_482294215.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 155 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_59403221.pdb -s /var/tmp/to_scwrl_59403221.seq -o /var/tmp/from_scwrl_59403221.pdb > /var/tmp/scwrl_59403221.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_59403221.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 160 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_74541541.pdb -s /var/tmp/to_scwrl_74541541.seq -o /var/tmp/from_scwrl_74541541.pdb > /var/tmp/scwrl_74541541.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_74541541.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 159 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_754445.pdb -s /var/tmp/to_scwrl_754445.seq -o /var/tmp/from_scwrl_754445.pdb > /var/tmp/scwrl_754445.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_754445.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 151 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1899044741.pdb -s /var/tmp/to_scwrl_1899044741.seq -o /var/tmp/from_scwrl_1899044741.pdb > /var/tmp/scwrl_1899044741.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1899044741.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 151 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1242666489.pdb -s /var/tmp/to_scwrl_1242666489.seq -o /var/tmp/from_scwrl_1242666489.pdb > /var/tmp/scwrl_1242666489.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1242666489.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 164 # copying to AlignedFragments data structure # naming current conformation BayesHH_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1030871205.pdb -s /var/tmp/to_scwrl_1030871205.seq -o /var/tmp/from_scwrl_1030871205.pdb > /var/tmp/scwrl_1030871205.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1030871205.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 # naming current conformation Bilab-ENABLE_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_703219055.pdb -s /var/tmp/to_scwrl_703219055.seq -o /var/tmp/from_scwrl_703219055.pdb > /var/tmp/scwrl_703219055.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_703219055.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 168 # copying to AlignedFragments data structure # naming current conformation Bilab-ENABLE_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1516839739.pdb -s /var/tmp/to_scwrl_1516839739.seq -o /var/tmp/from_scwrl_1516839739.pdb > /var/tmp/scwrl_1516839739.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1516839739.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 # naming current conformation Bilab-ENABLE_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1464076815.pdb -s /var/tmp/to_scwrl_1464076815.seq -o /var/tmp/from_scwrl_1464076815.pdb > /var/tmp/scwrl_1464076815.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1464076815.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 149 # copying to AlignedFragments data structure # naming current conformation Bilab-ENABLE_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1600339493.pdb -s /var/tmp/to_scwrl_1600339493.seq -o /var/tmp/from_scwrl_1600339493.pdb > /var/tmp/scwrl_1600339493.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1600339493.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 168 # copying to AlignedFragments data structure # naming current conformation Bilab-ENABLE_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_915252589.pdb -s /var/tmp/to_scwrl_915252589.seq -o /var/tmp/from_scwrl_915252589.pdb > /var/tmp/scwrl_915252589.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_915252589.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 168 # copying to AlignedFragments data structure # naming current conformation CIRCLE_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_800795577.pdb -s /var/tmp/to_scwrl_800795577.seq -o /var/tmp/from_scwrl_800795577.pdb > /var/tmp/scwrl_800795577.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_800795577.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 T0361 can't currently be optimized by undertaker # naming current conformation CIRCLE_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_2104874416.pdb -s /var/tmp/to_scwrl_2104874416.seq -o /var/tmp/from_scwrl_2104874416.pdb > /var/tmp/scwrl_2104874416.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2104874416.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 # Found a chain break before 168 # copying to AlignedFragments data structure # naming current conformation CIRCLE_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1285845669.pdb -s /var/tmp/to_scwrl_1285845669.seq -o /var/tmp/from_scwrl_1285845669.pdb > /var/tmp/scwrl_1285845669.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1285845669.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 # Found a chain break before 168 # copying to AlignedFragments data structure # naming current conformation CIRCLE_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1750477634.pdb -s /var/tmp/to_scwrl_1750477634.seq -o /var/tmp/from_scwrl_1750477634.pdb > /var/tmp/scwrl_1750477634.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1750477634.pdb # conformation set from SCWRL output # naming current conformation CIRCLE_TS4-scwrl # ReadConformPDB reading from PDB file servers/CIRCLE_TS5.pdb.gz looking for model 1 # Found a chain break before 168 # copying to AlignedFragments data structure # naming current conformation CIRCLE_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1979968852.pdb -s /var/tmp/to_scwrl_1979968852.seq -o /var/tmp/from_scwrl_1979968852.pdb > /var/tmp/scwrl_1979968852.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1979968852.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 T0361 can't currently be optimized by undertaker # naming current conformation CaspIta-FOX_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_660390718.pdb -s /var/tmp/to_scwrl_660390718.seq -o /var/tmp/from_scwrl_660390718.pdb > /var/tmp/scwrl_660390718.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_660390718.pdb # conformation set from SCWRL output # naming current conformation CaspIta-FOX_TS1-scwrl # ReadConformPDB reading from PDB file servers/CaspIta-FOX_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0361 can't currently be optimized by undertaker # naming current conformation CaspIta-FOX_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1439894068.pdb -s /var/tmp/to_scwrl_1439894068.seq -o /var/tmp/from_scwrl_1439894068.pdb > /var/tmp/scwrl_1439894068.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1439894068.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 T0361 can't currently be optimized by undertaker # naming current conformation CaspIta-FOX_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_311154377.pdb -s /var/tmp/to_scwrl_311154377.seq -o /var/tmp/from_scwrl_311154377.pdb > /var/tmp/scwrl_311154377.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_311154377.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 T0361 can't currently be optimized by undertaker # naming current conformation CaspIta-FOX_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_470552499.pdb -s /var/tmp/to_scwrl_470552499.seq -o /var/tmp/from_scwrl_470552499.pdb > /var/tmp/scwrl_470552499.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_470552499.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 T0361 can't currently be optimized by undertaker # naming current conformation CaspIta-FOX_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_617657899.pdb -s /var/tmp/to_scwrl_617657899.seq -o /var/tmp/from_scwrl_617657899.pdb > /var/tmp/scwrl_617657899.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_617657899.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 T0361 can't currently be optimized by undertaker # naming current conformation Distill_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1782164361.pdb -s /var/tmp/to_scwrl_1782164361.seq -o /var/tmp/from_scwrl_1782164361.pdb > /var/tmp/scwrl_1782164361.log Error: can't open any of /var/tmp/from_scwrl_1782164361.pdb or /var/tmp/from_scwrl_1782164361_b.pdb or /var/tmp/from_scwrl_1782164361_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 T0361 can't currently be optimized by undertaker # naming current conformation Distill_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_2142765480.pdb -s /var/tmp/to_scwrl_2142765480.seq -o /var/tmp/from_scwrl_2142765480.pdb > /var/tmp/scwrl_2142765480.log Error: can't open any of /var/tmp/from_scwrl_2142765480.pdb or /var/tmp/from_scwrl_2142765480_b.pdb or /var/tmp/from_scwrl_2142765480_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 T0361 can't currently be optimized by undertaker # naming current conformation Distill_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_972216262.pdb -s /var/tmp/to_scwrl_972216262.seq -o /var/tmp/from_scwrl_972216262.pdb > /var/tmp/scwrl_972216262.log Error: can't open any of /var/tmp/from_scwrl_972216262.pdb or /var/tmp/from_scwrl_972216262_b.pdb or /var/tmp/from_scwrl_972216262_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 T0361 can't currently be optimized by undertaker # naming current conformation Distill_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1432681012.pdb -s /var/tmp/to_scwrl_1432681012.seq -o /var/tmp/from_scwrl_1432681012.pdb > /var/tmp/scwrl_1432681012.log Error: can't open any of /var/tmp/from_scwrl_1432681012.pdb or /var/tmp/from_scwrl_1432681012_b.pdb or /var/tmp/from_scwrl_1432681012_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 T0361 can't currently be optimized by undertaker # naming current conformation Distill_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1464052026.pdb -s /var/tmp/to_scwrl_1464052026.seq -o /var/tmp/from_scwrl_1464052026.pdb > /var/tmp/scwrl_1464052026.log Error: can't open any of /var/tmp/from_scwrl_1464052026.pdb or /var/tmp/from_scwrl_1464052026_b.pdb or /var/tmp/from_scwrl_1464052026_a.pdb Error: no new SCWRL conformation added # naming current conformation Distill_TS5-scwrl # ReadConformPDB reading from PDB file servers/FAMSD_TS1.pdb.gz looking for model 1 # Found a chain break before 164 # copying to AlignedFragments data structure # naming current conformation FAMSD_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1972421947.pdb -s /var/tmp/to_scwrl_1972421947.seq -o /var/tmp/from_scwrl_1972421947.pdb > /var/tmp/scwrl_1972421947.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1972421947.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 T0361 can't currently be optimized by undertaker # naming current conformation FAMSD_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_319008289.pdb -s /var/tmp/to_scwrl_319008289.seq -o /var/tmp/from_scwrl_319008289.pdb > /var/tmp/scwrl_319008289.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_319008289.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 168 # copying to AlignedFragments data structure # naming current conformation FAMSD_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_270316450.pdb -s /var/tmp/to_scwrl_270316450.seq -o /var/tmp/from_scwrl_270316450.pdb > /var/tmp/scwrl_270316450.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_270316450.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 T0361 can't currently be optimized by undertaker # naming current conformation FAMSD_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1970753111.pdb -s /var/tmp/to_scwrl_1970753111.seq -o /var/tmp/from_scwrl_1970753111.pdb > /var/tmp/scwrl_1970753111.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1970753111.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 T0361 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation FAMSD_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_801302504.pdb -s /var/tmp/to_scwrl_801302504.seq -o /var/tmp/from_scwrl_801302504.pdb > /var/tmp/scwrl_801302504.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_801302504.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 168 # copying to AlignedFragments data structure # naming current conformation FAMS_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_329719672.pdb -s /var/tmp/to_scwrl_329719672.seq -o /var/tmp/from_scwrl_329719672.pdb > /var/tmp/scwrl_329719672.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_329719672.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 168 # copying to AlignedFragments data structure # naming current conformation FAMS_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_2045294652.pdb -s /var/tmp/to_scwrl_2045294652.seq -o /var/tmp/from_scwrl_2045294652.pdb > /var/tmp/scwrl_2045294652.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2045294652.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 # Found a chain break before 168 # copying to AlignedFragments data structure # naming current conformation FAMS_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_802056949.pdb -s /var/tmp/to_scwrl_802056949.seq -o /var/tmp/from_scwrl_802056949.pdb > /var/tmp/scwrl_802056949.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_802056949.pdb # conformation set from SCWRL output # naming current conformation FAMS_TS3-scwrl # ReadConformPDB reading from PDB file servers/FAMS_TS4.pdb.gz looking for model 1 # Found a chain break before 164 # copying to AlignedFragments data structure # naming current conformation FAMS_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_81280766.pdb -s /var/tmp/to_scwrl_81280766.seq -o /var/tmp/from_scwrl_81280766.pdb > /var/tmp/scwrl_81280766.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_81280766.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 # WARNING: incomplete conformation T0361 can't currently be optimized by undertaker # naming current conformation FAMS_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1140477494.pdb -s /var/tmp/to_scwrl_1140477494.seq -o /var/tmp/from_scwrl_1140477494.pdb > /var/tmp/scwrl_1140477494.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1140477494.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 161 # copying to AlignedFragments data structure # naming current conformation FOLDpro_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1832928153.pdb -s /var/tmp/to_scwrl_1832928153.seq -o /var/tmp/from_scwrl_1832928153.pdb > /var/tmp/scwrl_1832928153.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1832928153.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 143 # copying to AlignedFragments data structure # naming current conformation FOLDpro_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_784499821.pdb -s /var/tmp/to_scwrl_784499821.seq -o /var/tmp/from_scwrl_784499821.pdb > /var/tmp/scwrl_784499821.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_784499821.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 133 # copying to AlignedFragments data structure # naming current conformation FOLDpro_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_509833587.pdb -s /var/tmp/to_scwrl_509833587.seq -o /var/tmp/from_scwrl_509833587.pdb > /var/tmp/scwrl_509833587.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_509833587.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 151 # copying to AlignedFragments data structure # naming current conformation FOLDpro_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1149521321.pdb -s /var/tmp/to_scwrl_1149521321.seq -o /var/tmp/from_scwrl_1149521321.pdb > /var/tmp/scwrl_1149521321.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1149521321.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 165 # copying to AlignedFragments data structure # naming current conformation FOLDpro_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_237355668.pdb -s /var/tmp/to_scwrl_237355668.seq -o /var/tmp/from_scwrl_237355668.pdb > /var/tmp/scwrl_237355668.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_237355668.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 T0361 can't currently be optimized by undertaker # naming current conformation FORTE1_AL1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1425086175.pdb -s /var/tmp/to_scwrl_1425086175.seq -o /var/tmp/from_scwrl_1425086175.pdb > /var/tmp/scwrl_1425086175.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1425086175.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 T0361 can't currently be optimized by undertaker # naming current conformation FORTE1_AL2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1950316899.pdb -s /var/tmp/to_scwrl_1950316899.seq -o /var/tmp/from_scwrl_1950316899.pdb > /var/tmp/scwrl_1950316899.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1950316899.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 T0361 can't currently be optimized by undertaker # naming current conformation FORTE1_AL3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_194746437.pdb -s /var/tmp/to_scwrl_194746437.seq -o /var/tmp/from_scwrl_194746437.pdb > /var/tmp/scwrl_194746437.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_194746437.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 T0361 can't currently be optimized by undertaker # naming current conformation FORTE1_AL4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_563448199.pdb -s /var/tmp/to_scwrl_563448199.seq -o /var/tmp/from_scwrl_563448199.pdb > /var/tmp/scwrl_563448199.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_563448199.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 T0361 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation FORTE1_AL5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1553310886.pdb -s /var/tmp/to_scwrl_1553310886.seq -o /var/tmp/from_scwrl_1553310886.pdb > /var/tmp/scwrl_1553310886.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1553310886.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 T0361 can't currently be optimized by undertaker # naming current conformation FORTE2_AL1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_27231642.pdb -s /var/tmp/to_scwrl_27231642.seq -o /var/tmp/from_scwrl_27231642.pdb > /var/tmp/scwrl_27231642.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_27231642.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 T0361 can't currently be optimized by undertaker # naming current conformation FORTE2_AL2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1223838916.pdb -s /var/tmp/to_scwrl_1223838916.seq -o /var/tmp/from_scwrl_1223838916.pdb > /var/tmp/scwrl_1223838916.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1223838916.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 T0361 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation FORTE2_AL3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_845721308.pdb -s /var/tmp/to_scwrl_845721308.seq -o /var/tmp/from_scwrl_845721308.pdb > /var/tmp/scwrl_845721308.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_845721308.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 T0361 can't currently be optimized by undertaker # naming current conformation FORTE2_AL4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_338386019.pdb -s /var/tmp/to_scwrl_338386019.seq -o /var/tmp/from_scwrl_338386019.pdb > /var/tmp/scwrl_338386019.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_338386019.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 T0361 can't currently be optimized by undertaker # naming current conformation FORTE2_AL5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1694391415.pdb -s /var/tmp/to_scwrl_1694391415.seq -o /var/tmp/from_scwrl_1694391415.pdb > /var/tmp/scwrl_1694391415.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1694391415.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 168 # copying to AlignedFragments data structure # naming current conformation FPSOLVER-SERVER_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1463379207.pdb -s /var/tmp/to_scwrl_1463379207.seq -o /var/tmp/from_scwrl_1463379207.pdb > /var/tmp/scwrl_1463379207.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1463379207.pdb # conformation set from SCWRL output # naming current conformation FPSOLVER-SERVER_TS1-scwrl # ReadConformPDB reading from PDB file servers/FPSOLVER-SERVER_TS2.pdb.gz looking for model 1 # Found a chain break before 119 # copying to AlignedFragments data structure # naming current conformation FPSOLVER-SERVER_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_2120550381.pdb -s /var/tmp/to_scwrl_2120550381.seq -o /var/tmp/from_scwrl_2120550381.pdb > /var/tmp/scwrl_2120550381.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2120550381.pdb # conformation set from SCWRL output # naming current conformation FPSOLVER-SERVER_TS2-scwrl # ReadConformPDB reading from PDB file servers/FPSOLVER-SERVER_TS3.pdb.gz looking for model 1 # Found a chain break before 158 # copying to AlignedFragments data structure # naming current conformation FPSOLVER-SERVER_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1689673249.pdb -s /var/tmp/to_scwrl_1689673249.seq -o /var/tmp/from_scwrl_1689673249.pdb > /var/tmp/scwrl_1689673249.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1689673249.pdb # conformation set from SCWRL output # naming current conformation FPSOLVER-SERVER_TS3-scwrl # ReadConformPDB reading from PDB file servers/FPSOLVER-SERVER_TS4.pdb.gz looking for model 1 # Found a chain break before 167 # copying to AlignedFragments data structure # naming current conformation FPSOLVER-SERVER_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_288111822.pdb -s /var/tmp/to_scwrl_288111822.seq -o /var/tmp/from_scwrl_288111822.pdb > /var/tmp/scwrl_288111822.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_288111822.pdb # conformation set from SCWRL output # naming current conformation FPSOLVER-SERVER_TS4-scwrl # ReadConformPDB reading from PDB file servers/FPSOLVER-SERVER_TS5.pdb.gz looking for model 1 # Found a chain break before 162 # copying to AlignedFragments data structure # naming current conformation FPSOLVER-SERVER_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1405747746.pdb -s /var/tmp/to_scwrl_1405747746.seq -o /var/tmp/from_scwrl_1405747746.pdb > /var/tmp/scwrl_1405747746.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1405747746.pdb # conformation set from SCWRL output # naming current conformation FPSOLVER-SERVER_TS5-scwrl # ReadConformPDB reading from PDB file servers/FUGMOD_TS1.pdb.gz looking for model 1 # Found a chain break before 104 # copying to AlignedFragments data structure # naming current conformation FUGMOD_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1006241629.pdb -s /var/tmp/to_scwrl_1006241629.seq -o /var/tmp/from_scwrl_1006241629.pdb > /var/tmp/scwrl_1006241629.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1006241629.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 136 # copying to AlignedFragments data structure # naming current conformation FUGMOD_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_113050122.pdb -s /var/tmp/to_scwrl_113050122.seq -o /var/tmp/from_scwrl_113050122.pdb > /var/tmp/scwrl_113050122.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_113050122.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 # WARNING: incomplete conformation T0361 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation FUGMOD_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1724756035.pdb -s /var/tmp/to_scwrl_1724756035.seq -o /var/tmp/from_scwrl_1724756035.pdb > /var/tmp/scwrl_1724756035.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1724756035.pdb # conformation set from SCWRL output # naming current conformation FUGMOD_TS3-scwrl # ReadConformPDB reading from PDB file servers/FUGMOD_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0361 can't currently be optimized by undertaker # naming current conformation FUGMOD_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1276558079.pdb -s /var/tmp/to_scwrl_1276558079.seq -o /var/tmp/from_scwrl_1276558079.pdb > /var/tmp/scwrl_1276558079.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1276558079.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 T0361 can't currently be optimized by undertaker # naming current conformation FUGMOD_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_2083803233.pdb -s /var/tmp/to_scwrl_2083803233.seq -o /var/tmp/from_scwrl_2083803233.pdb > /var/tmp/scwrl_2083803233.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2083803233.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 T0361 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation FUGUE_AL1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_378574892.pdb -s /var/tmp/to_scwrl_378574892.seq -o /var/tmp/from_scwrl_378574892.pdb > /var/tmp/scwrl_378574892.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_378574892.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 T0361 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation FUGUE_AL2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1606277751.pdb -s /var/tmp/to_scwrl_1606277751.seq -o /var/tmp/from_scwrl_1606277751.pdb > /var/tmp/scwrl_1606277751.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1606277751.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 T0361 can't currently be optimized by undertaker # naming current conformation FUGUE_AL3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1981614238.pdb -s /var/tmp/to_scwrl_1981614238.seq -o /var/tmp/from_scwrl_1981614238.pdb > /var/tmp/scwrl_1981614238.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1981614238.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 T0361 can't currently be optimized by undertaker # naming current conformation FUGUE_AL4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1180631840.pdb -s /var/tmp/to_scwrl_1180631840.seq -o /var/tmp/from_scwrl_1180631840.pdb > /var/tmp/scwrl_1180631840.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1180631840.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 T0361 can't currently be optimized by undertaker # naming current conformation FUGUE_AL5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1687558517.pdb -s /var/tmp/to_scwrl_1687558517.seq -o /var/tmp/from_scwrl_1687558517.pdb > /var/tmp/scwrl_1687558517.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1687558517.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 168 # copying to AlignedFragments data structure # naming current conformation FUNCTION_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_974608086.pdb -s /var/tmp/to_scwrl_974608086.seq -o /var/tmp/from_scwrl_974608086.pdb > /var/tmp/scwrl_974608086.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_974608086.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 168 # copying to AlignedFragments data structure # naming current conformation FUNCTION_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_866076348.pdb -s /var/tmp/to_scwrl_866076348.seq -o /var/tmp/from_scwrl_866076348.pdb > /var/tmp/scwrl_866076348.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_866076348.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 168 # copying to AlignedFragments data structure # naming current conformation FUNCTION_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_324574691.pdb -s /var/tmp/to_scwrl_324574691.seq -o /var/tmp/from_scwrl_324574691.pdb > /var/tmp/scwrl_324574691.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_324574691.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 168 # copying to AlignedFragments data structure # naming current conformation FUNCTION_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1484441672.pdb -s /var/tmp/to_scwrl_1484441672.seq -o /var/tmp/from_scwrl_1484441672.pdb > /var/tmp/scwrl_1484441672.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1484441672.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 168 # copying to AlignedFragments data structure # naming current conformation FUNCTION_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_2015597669.pdb -s /var/tmp/to_scwrl_2015597669.seq -o /var/tmp/from_scwrl_2015597669.pdb > /var/tmp/scwrl_2015597669.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2015597669.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 # WARNING: incomplete conformation T0361 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation GeneSilicoMetaServer_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_561930359.pdb -s /var/tmp/to_scwrl_561930359.seq -o /var/tmp/from_scwrl_561930359.pdb > /var/tmp/scwrl_561930359.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_561930359.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 148 # copying to AlignedFragments data structure # naming current conformation GeneSilicoMetaServer_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_762044201.pdb -s /var/tmp/to_scwrl_762044201.seq -o /var/tmp/from_scwrl_762044201.pdb > /var/tmp/scwrl_762044201.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_762044201.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 158 # copying to AlignedFragments data structure # naming current conformation GeneSilicoMetaServer_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1818430921.pdb -s /var/tmp/to_scwrl_1818430921.seq -o /var/tmp/from_scwrl_1818430921.pdb > /var/tmp/scwrl_1818430921.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1818430921.pdb # conformation set from SCWRL output # naming current conformation GeneSilicoMetaServer_TS3-scwrl # ReadConformPDB reading from PDB file servers/GeneSilicoMetaServer_TS4.pdb.gz looking for model 1 # Found a chain break before 95 # copying to AlignedFragments data structure # naming current conformation GeneSilicoMetaServer_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_756676797.pdb -s /var/tmp/to_scwrl_756676797.seq -o /var/tmp/from_scwrl_756676797.pdb > /var/tmp/scwrl_756676797.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_756676797.pdb # conformation set from SCWRL output # naming current conformation GeneSilicoMetaServer_TS4-scwrl # ReadConformPDB reading from PDB file servers/GeneSilicoMetaServer_TS5.pdb.gz looking for model 1 # Found a chain break before 105 # copying to AlignedFragments data structure # naming current conformation GeneSilicoMetaServer_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1325492399.pdb -s /var/tmp/to_scwrl_1325492399.seq -o /var/tmp/from_scwrl_1325492399.pdb > /var/tmp/scwrl_1325492399.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1325492399.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 121 # copying to AlignedFragments data structure # naming current conformation HHpred1_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1224258161.pdb -s /var/tmp/to_scwrl_1224258161.seq -o /var/tmp/from_scwrl_1224258161.pdb > /var/tmp/scwrl_1224258161.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1224258161.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 168 # copying to AlignedFragments data structure # naming current conformation HHpred2_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_783908439.pdb -s /var/tmp/to_scwrl_783908439.seq -o /var/tmp/from_scwrl_783908439.pdb > /var/tmp/scwrl_783908439.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_783908439.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 117 # copying to AlignedFragments data structure # naming current conformation HHpred3_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_401847670.pdb -s /var/tmp/to_scwrl_401847670.seq -o /var/tmp/from_scwrl_401847670.pdb > /var/tmp/scwrl_401847670.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_401847670.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 T0361 can't currently be optimized by undertaker # naming current conformation Huber-Torda-Server_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_2069979469.pdb -s /var/tmp/to_scwrl_2069979469.seq -o /var/tmp/from_scwrl_2069979469.pdb > /var/tmp/scwrl_2069979469.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2069979469.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 T0361 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation Huber-Torda-Server_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1122294458.pdb -s /var/tmp/to_scwrl_1122294458.seq -o /var/tmp/from_scwrl_1122294458.pdb > /var/tmp/scwrl_1122294458.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1122294458.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 T0361 can't currently be optimized by undertaker # naming current conformation Huber-Torda-Server_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_2096239085.pdb -s /var/tmp/to_scwrl_2096239085.seq -o /var/tmp/from_scwrl_2096239085.pdb > /var/tmp/scwrl_2096239085.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2096239085.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 T0361 can't currently be optimized by undertaker # naming current conformation Huber-Torda-Server_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1385875029.pdb -s /var/tmp/to_scwrl_1385875029.seq -o /var/tmp/from_scwrl_1385875029.pdb > /var/tmp/scwrl_1385875029.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1385875029.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 T0361 can't currently be optimized by undertaker # naming current conformation Huber-Torda-Server_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1095361192.pdb -s /var/tmp/to_scwrl_1095361192.seq -o /var/tmp/from_scwrl_1095361192.pdb > /var/tmp/scwrl_1095361192.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1095361192.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 T0361 can't currently be optimized by undertaker # naming current conformation LOOPP_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1638428687.pdb -s /var/tmp/to_scwrl_1638428687.seq -o /var/tmp/from_scwrl_1638428687.pdb > /var/tmp/scwrl_1638428687.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1638428687.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 T0361 can't currently be optimized by undertaker # naming current conformation LOOPP_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1673986851.pdb -s /var/tmp/to_scwrl_1673986851.seq -o /var/tmp/from_scwrl_1673986851.pdb > /var/tmp/scwrl_1673986851.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1673986851.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 # Found a chain break before 141 # copying to AlignedFragments data structure # naming current conformation LOOPP_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_353625292.pdb -s /var/tmp/to_scwrl_353625292.seq -o /var/tmp/from_scwrl_353625292.pdb > /var/tmp/scwrl_353625292.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_353625292.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 T0361 can't currently be optimized by undertaker # naming current conformation LOOPP_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_497186670.pdb -s /var/tmp/to_scwrl_497186670.seq -o /var/tmp/from_scwrl_497186670.pdb > /var/tmp/scwrl_497186670.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_497186670.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 T0361 can't currently be optimized by undertaker # naming current conformation LOOPP_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1787036973.pdb -s /var/tmp/to_scwrl_1787036973.seq -o /var/tmp/from_scwrl_1787036973.pdb > /var/tmp/scwrl_1787036973.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1787036973.pdb # conformation set from SCWRL output # naming current conformation LOOPP_TS5-scwrl # ReadConformPDB reading from PDB file servers/MIG_FROST_AL1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0361 can't currently be optimized by undertaker # naming current conformation MIG_FROST_AL1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_2078381327.pdb -s /var/tmp/to_scwrl_2078381327.seq -o /var/tmp/from_scwrl_2078381327.pdb > /var/tmp/scwrl_2078381327.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2078381327.pdb # conformation set from SCWRL output # naming current conformation MIG_FROST_AL1-scwrl # ReadConformPDB reading from PDB file servers/Ma-OPUS-server2_TS1.pdb.gz looking for model 1 # Found a chain break before 121 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server2_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1773744749.pdb -s /var/tmp/to_scwrl_1773744749.seq -o /var/tmp/from_scwrl_1773744749.pdb > /var/tmp/scwrl_1773744749.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1773744749.pdb # conformation set from SCWRL output # naming current conformation Ma-OPUS-server2_TS1-scwrl # ReadConformPDB reading from PDB file servers/Ma-OPUS-server2_TS2.pdb.gz looking for model 1 # Found a chain break before 166 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server2_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1723356559.pdb -s /var/tmp/to_scwrl_1723356559.seq -o /var/tmp/from_scwrl_1723356559.pdb > /var/tmp/scwrl_1723356559.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1723356559.pdb # conformation set from SCWRL output # naming current conformation Ma-OPUS-server2_TS2-scwrl # ReadConformPDB reading from PDB file servers/Ma-OPUS-server2_TS3.pdb.gz looking for model 1 # Found a chain break before 151 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server2_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_309472572.pdb -s /var/tmp/to_scwrl_309472572.seq -o /var/tmp/from_scwrl_309472572.pdb > /var/tmp/scwrl_309472572.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_309472572.pdb # conformation set from SCWRL output # naming current conformation Ma-OPUS-server2_TS3-scwrl # ReadConformPDB reading from PDB file servers/Ma-OPUS-server2_TS4.pdb.gz looking for model 1 # Found a chain break before 125 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server2_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1232538853.pdb -s /var/tmp/to_scwrl_1232538853.seq -o /var/tmp/from_scwrl_1232538853.pdb > /var/tmp/scwrl_1232538853.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1232538853.pdb # conformation set from SCWRL output # naming current conformation Ma-OPUS-server2_TS4-scwrl # ReadConformPDB reading from PDB file servers/Ma-OPUS-server2_TS5.pdb.gz looking for model 1 # Found a chain break before 136 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server2_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1557487150.pdb -s /var/tmp/to_scwrl_1557487150.seq -o /var/tmp/from_scwrl_1557487150.pdb > /var/tmp/scwrl_1557487150.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1557487150.pdb # conformation set from SCWRL output # naming current conformation Ma-OPUS-server2_TS5-scwrl # ReadConformPDB reading from PDB file servers/Ma-OPUS-server_TS1.pdb.gz looking for model 1 # Found a chain break before 165 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1490104412.pdb -s /var/tmp/to_scwrl_1490104412.seq -o /var/tmp/from_scwrl_1490104412.pdb > /var/tmp/scwrl_1490104412.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1490104412.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 121 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_772613724.pdb -s /var/tmp/to_scwrl_772613724.seq -o /var/tmp/from_scwrl_772613724.pdb > /var/tmp/scwrl_772613724.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_772613724.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 130 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_384611589.pdb -s /var/tmp/to_scwrl_384611589.seq -o /var/tmp/from_scwrl_384611589.pdb > /var/tmp/scwrl_384611589.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_384611589.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 168 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_208697113.pdb -s /var/tmp/to_scwrl_208697113.seq -o /var/tmp/from_scwrl_208697113.pdb > /var/tmp/scwrl_208697113.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_208697113.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 135 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1097188414.pdb -s /var/tmp/to_scwrl_1097188414.seq -o /var/tmp/from_scwrl_1097188414.pdb > /var/tmp/scwrl_1097188414.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1097188414.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 155 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1869053261.pdb -s /var/tmp/to_scwrl_1869053261.seq -o /var/tmp/from_scwrl_1869053261.pdb > /var/tmp/scwrl_1869053261.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1869053261.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 167 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_76811136.pdb -s /var/tmp/to_scwrl_76811136.seq -o /var/tmp/from_scwrl_76811136.pdb > /var/tmp/scwrl_76811136.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_76811136.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 167 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1659118774.pdb -s /var/tmp/to_scwrl_1659118774.seq -o /var/tmp/from_scwrl_1659118774.pdb > /var/tmp/scwrl_1659118774.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1659118774.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 168 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_483613816.pdb -s /var/tmp/to_scwrl_483613816.seq -o /var/tmp/from_scwrl_483613816.pdb > /var/tmp/scwrl_483613816.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_483613816.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 165 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1895242057.pdb -s /var/tmp/to_scwrl_1895242057.seq -o /var/tmp/from_scwrl_1895242057.pdb > /var/tmp/scwrl_1895242057.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1895242057.pdb # conformation set from SCWRL output # naming current conformation MetaTasser_TS5-scwrl # ReadConformPDB reading from PDB file servers/NN_PUT_lab_TS1.pdb.gz looking for model 1 # Found a chain break before 44 # copying to AlignedFragments data structure # naming current conformation NN_PUT_lab_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_268311924.pdb -s /var/tmp/to_scwrl_268311924.seq -o /var/tmp/from_scwrl_268311924.pdb > /var/tmp/scwrl_268311924.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_268311924.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 140 # copying to AlignedFragments data structure # naming current conformation POMYSL_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1809106215.pdb -s /var/tmp/to_scwrl_1809106215.seq -o /var/tmp/from_scwrl_1809106215.pdb > /var/tmp/scwrl_1809106215.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1809106215.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 154 # copying to AlignedFragments data structure # naming current conformation POMYSL_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_972016572.pdb -s /var/tmp/to_scwrl_972016572.seq -o /var/tmp/from_scwrl_972016572.pdb > /var/tmp/scwrl_972016572.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_972016572.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 140 # copying to AlignedFragments data structure # naming current conformation POMYSL_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1052220363.pdb -s /var/tmp/to_scwrl_1052220363.seq -o /var/tmp/from_scwrl_1052220363.pdb > /var/tmp/scwrl_1052220363.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1052220363.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 138 # copying to AlignedFragments data structure # naming current conformation POMYSL_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_63470238.pdb -s /var/tmp/to_scwrl_63470238.seq -o /var/tmp/from_scwrl_63470238.pdb > /var/tmp/scwrl_63470238.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_63470238.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 136 # copying to AlignedFragments data structure # naming current conformation POMYSL_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_894512395.pdb -s /var/tmp/to_scwrl_894512395.seq -o /var/tmp/from_scwrl_894512395.pdb > /var/tmp/scwrl_894512395.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_894512395.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 153 ; scwrl -i /var/tmp/to_scwrl_27031174.pdb -s /var/tmp/to_scwrl_27031174.seq -o /var/tmp/from_scwrl_27031174.pdb > /var/tmp/scwrl_27031174.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_27031174.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 153 ; scwrl -i /var/tmp/to_scwrl_12225677.pdb -s /var/tmp/to_scwrl_12225677.seq -o /var/tmp/from_scwrl_12225677.pdb > /var/tmp/scwrl_12225677.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_12225677.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 153 ; scwrl -i /var/tmp/to_scwrl_132903777.pdb -s /var/tmp/to_scwrl_132903777.seq -o /var/tmp/from_scwrl_132903777.pdb > /var/tmp/scwrl_132903777.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_132903777.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 153 ; scwrl -i /var/tmp/to_scwrl_1122392366.pdb -s /var/tmp/to_scwrl_1122392366.seq -o /var/tmp/from_scwrl_1122392366.pdb > /var/tmp/scwrl_1122392366.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1122392366.pdb # conformation set from SCWRL output # naming current conformation PROTINFO-AB_TS4-scwrl # ReadConformPDB reading from PDB file servers/PROTINFO-AB_TS5.pdb.gz looking for model 1 # naming current conformation PROTINFO-AB_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1650654364.pdb -s /var/tmp/to_scwrl_1650654364.seq -o /var/tmp/from_scwrl_1650654364.pdb > /var/tmp/scwrl_1650654364.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1650654364.pdb # conformation set from SCWRL output # naming current conformation PROTINFO-AB_TS5-scwrl # ReadConformPDB reading from PDB file servers/PROTINFO_TS1.pdb.gz looking for model 1 # Found a chain break before 127 # copying to AlignedFragments data structure # naming current conformation PROTINFO_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1806890629.pdb -s /var/tmp/to_scwrl_1806890629.seq -o /var/tmp/from_scwrl_1806890629.pdb > /var/tmp/scwrl_1806890629.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1806890629.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 168 # copying to AlignedFragments data structure # naming current conformation PROTINFO_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1476017658.pdb -s /var/tmp/to_scwrl_1476017658.seq -o /var/tmp/from_scwrl_1476017658.pdb > /var/tmp/scwrl_1476017658.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1476017658.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 168 # copying to AlignedFragments data structure # naming current conformation PROTINFO_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_357387.pdb -s /var/tmp/to_scwrl_357387.seq -o /var/tmp/from_scwrl_357387.pdb > /var/tmp/scwrl_357387.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_357387.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 48 # copying to AlignedFragments data structure # naming current conformation PROTINFO_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1446443955.pdb -s /var/tmp/to_scwrl_1446443955.seq -o /var/tmp/from_scwrl_1446443955.pdb > /var/tmp/scwrl_1446443955.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1446443955.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 123 # copying to AlignedFragments data structure # naming current conformation PROTINFO_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1406915338.pdb -s /var/tmp/to_scwrl_1406915338.seq -o /var/tmp/from_scwrl_1406915338.pdb > /var/tmp/scwrl_1406915338.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1406915338.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 T0361 can't currently be optimized by undertaker # naming current conformation Pcons6_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1774102136.pdb -s /var/tmp/to_scwrl_1774102136.seq -o /var/tmp/from_scwrl_1774102136.pdb > /var/tmp/scwrl_1774102136.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1774102136.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 T0361 can't currently be optimized by undertaker # naming current conformation Pcons6_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1022316869.pdb -s /var/tmp/to_scwrl_1022316869.seq -o /var/tmp/from_scwrl_1022316869.pdb > /var/tmp/scwrl_1022316869.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1022316869.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 T0361 can't currently be optimized by undertaker # naming current conformation Pcons6_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1716387910.pdb -s /var/tmp/to_scwrl_1716387910.seq -o /var/tmp/from_scwrl_1716387910.pdb > /var/tmp/scwrl_1716387910.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1716387910.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 T0361 can't currently be optimized by undertaker # naming current conformation Pcons6_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_859157343.pdb -s /var/tmp/to_scwrl_859157343.seq -o /var/tmp/from_scwrl_859157343.pdb > /var/tmp/scwrl_859157343.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_859157343.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 T0361 can't currently be optimized by undertaker # naming current conformation Pcons6_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_432320372.pdb -s /var/tmp/to_scwrl_432320372.seq -o /var/tmp/from_scwrl_432320372.pdb > /var/tmp/scwrl_432320372.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_432320372.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 T0361 can't currently be optimized by undertaker # naming current conformation Phyre-1_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1059008677.pdb -s /var/tmp/to_scwrl_1059008677.seq -o /var/tmp/from_scwrl_1059008677.pdb > /var/tmp/scwrl_1059008677.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1059008677.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 # Found a chain break before 125 # copying to AlignedFragments data structure # naming current conformation Phyre-2_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1631771066.pdb -s /var/tmp/to_scwrl_1631771066.seq -o /var/tmp/from_scwrl_1631771066.pdb > /var/tmp/scwrl_1631771066.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1631771066.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 # Found a chain break before 118 # copying to AlignedFragments data structure # naming current conformation Phyre-2_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_816931962.pdb -s /var/tmp/to_scwrl_816931962.seq -o /var/tmp/from_scwrl_816931962.pdb > /var/tmp/scwrl_816931962.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_816931962.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 # Found a chain break before 151 # copying to AlignedFragments data structure # naming current conformation Phyre-2_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1267705789.pdb -s /var/tmp/to_scwrl_1267705789.seq -o /var/tmp/from_scwrl_1267705789.pdb > /var/tmp/scwrl_1267705789.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1267705789.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 # Found a chain break before 167 # copying to AlignedFragments data structure # naming current conformation Phyre-2_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_581475835.pdb -s /var/tmp/to_scwrl_581475835.seq -o /var/tmp/from_scwrl_581475835.pdb > /var/tmp/scwrl_581475835.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_581475835.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 # Found a chain break before 125 # copying to AlignedFragments data structure # naming current conformation Phyre-2_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_538501576.pdb -s /var/tmp/to_scwrl_538501576.seq -o /var/tmp/from_scwrl_538501576.pdb > /var/tmp/scwrl_538501576.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_538501576.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 # naming current conformation Pmodeller6_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1344516925.pdb -s /var/tmp/to_scwrl_1344516925.seq -o /var/tmp/from_scwrl_1344516925.pdb > /var/tmp/scwrl_1344516925.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1344516925.pdb # conformation set from SCWRL output # naming current conformation Pmodeller6_TS1-scwrl # ReadConformPDB reading from PDB file servers/Pmodeller6_TS2.pdb.gz looking for model 1 # Found a chain break before 1 # copying to AlignedFragments data structure # naming current conformation Pmodeller6_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_93110962.pdb -s /var/tmp/to_scwrl_93110962.seq -o /var/tmp/from_scwrl_93110962.pdb > /var/tmp/scwrl_93110962.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_93110962.pdb # conformation set from SCWRL output # naming current conformation Pmodeller6_TS2-scwrl # ReadConformPDB reading from PDB file servers/Pmodeller6_TS3.pdb.gz looking for model 1 # Found a chain break before 127 # copying to AlignedFragments data structure # naming current conformation Pmodeller6_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1022115392.pdb -s /var/tmp/to_scwrl_1022115392.seq -o /var/tmp/from_scwrl_1022115392.pdb > /var/tmp/scwrl_1022115392.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1022115392.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 # Found a chain break before 146 # copying to AlignedFragments data structure # naming current conformation Pmodeller6_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1092275336.pdb -s /var/tmp/to_scwrl_1092275336.seq -o /var/tmp/from_scwrl_1092275336.pdb > /var/tmp/scwrl_1092275336.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1092275336.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 T0361 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation Pmodeller6_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_361422886.pdb -s /var/tmp/to_scwrl_361422886.seq -o /var/tmp/from_scwrl_361422886.pdb > /var/tmp/scwrl_361422886.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_361422886.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 164 # copying to AlignedFragments data structure # naming current conformation RAPTOR-ACE_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_683737961.pdb -s /var/tmp/to_scwrl_683737961.seq -o /var/tmp/from_scwrl_683737961.pdb > /var/tmp/scwrl_683737961.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_683737961.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 154 # copying to AlignedFragments data structure # naming current conformation RAPTOR-ACE_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_2064291908.pdb -s /var/tmp/to_scwrl_2064291908.seq -o /var/tmp/from_scwrl_2064291908.pdb > /var/tmp/scwrl_2064291908.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2064291908.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 130 # copying to AlignedFragments data structure # naming current conformation RAPTOR-ACE_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1413643248.pdb -s /var/tmp/to_scwrl_1413643248.seq -o /var/tmp/from_scwrl_1413643248.pdb > /var/tmp/scwrl_1413643248.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1413643248.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 147 # copying to AlignedFragments data structure # naming current conformation RAPTOR-ACE_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_747208199.pdb -s /var/tmp/to_scwrl_747208199.seq -o /var/tmp/from_scwrl_747208199.pdb > /var/tmp/scwrl_747208199.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_747208199.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 127 # copying to AlignedFragments data structure # naming current conformation RAPTOR-ACE_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_811320656.pdb -s /var/tmp/to_scwrl_811320656.seq -o /var/tmp/from_scwrl_811320656.pdb > /var/tmp/scwrl_811320656.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_811320656.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 168 # copying to AlignedFragments data structure # naming current conformation RAPTORESS_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1440674423.pdb -s /var/tmp/to_scwrl_1440674423.seq -o /var/tmp/from_scwrl_1440674423.pdb > /var/tmp/scwrl_1440674423.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1440674423.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 160 # copying to AlignedFragments data structure # naming current conformation RAPTORESS_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_759433876.pdb -s /var/tmp/to_scwrl_759433876.seq -o /var/tmp/from_scwrl_759433876.pdb > /var/tmp/scwrl_759433876.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_759433876.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 159 # copying to AlignedFragments data structure # naming current conformation RAPTORESS_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_944224434.pdb -s /var/tmp/to_scwrl_944224434.seq -o /var/tmp/from_scwrl_944224434.pdb > /var/tmp/scwrl_944224434.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_944224434.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 104 # copying to AlignedFragments data structure # naming current conformation RAPTORESS_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_415583143.pdb -s /var/tmp/to_scwrl_415583143.seq -o /var/tmp/from_scwrl_415583143.pdb > /var/tmp/scwrl_415583143.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_415583143.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 168 # copying to AlignedFragments data structure # naming current conformation RAPTORESS_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_262604594.pdb -s /var/tmp/to_scwrl_262604594.seq -o /var/tmp/from_scwrl_262604594.pdb > /var/tmp/scwrl_262604594.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_262604594.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 145 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_603631416.pdb -s /var/tmp/to_scwrl_603631416.seq -o /var/tmp/from_scwrl_603631416.pdb > /var/tmp/scwrl_603631416.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_603631416.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 160 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1891600802.pdb -s /var/tmp/to_scwrl_1891600802.seq -o /var/tmp/from_scwrl_1891600802.pdb > /var/tmp/scwrl_1891600802.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1891600802.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 168 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_262961981.pdb -s /var/tmp/to_scwrl_262961981.seq -o /var/tmp/from_scwrl_262961981.pdb > /var/tmp/scwrl_262961981.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_262961981.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 142 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_2050075371.pdb -s /var/tmp/to_scwrl_2050075371.seq -o /var/tmp/from_scwrl_2050075371.pdb > /var/tmp/scwrl_2050075371.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2050075371.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 153 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1151032493.pdb -s /var/tmp/to_scwrl_1151032493.seq -o /var/tmp/from_scwrl_1151032493.pdb > /var/tmp/scwrl_1151032493.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1151032493.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 150 # copying to AlignedFragments data structure # naming current conformation ROBETTA_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_2037064118.pdb -s /var/tmp/to_scwrl_2037064118.seq -o /var/tmp/from_scwrl_2037064118.pdb > /var/tmp/scwrl_2037064118.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2037064118.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 # naming current conformation ROBETTA_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_924908593.pdb -s /var/tmp/to_scwrl_924908593.seq -o /var/tmp/from_scwrl_924908593.pdb > /var/tmp/scwrl_924908593.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_924908593.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 152 # copying to AlignedFragments data structure # naming current conformation ROBETTA_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_719936758.pdb -s /var/tmp/to_scwrl_719936758.seq -o /var/tmp/from_scwrl_719936758.pdb > /var/tmp/scwrl_719936758.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_719936758.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 136 # copying to AlignedFragments data structure # naming current conformation ROBETTA_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_748737814.pdb -s /var/tmp/to_scwrl_748737814.seq -o /var/tmp/from_scwrl_748737814.pdb > /var/tmp/scwrl_748737814.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_748737814.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 146 # copying to AlignedFragments data structure # naming current conformation ROBETTA_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1357228965.pdb -s /var/tmp/to_scwrl_1357228965.seq -o /var/tmp/from_scwrl_1357228965.pdb > /var/tmp/scwrl_1357228965.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1357228965.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 81 # copying to AlignedFragments data structure # naming current conformation ROKKY_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1778945434.pdb -s /var/tmp/to_scwrl_1778945434.seq -o /var/tmp/from_scwrl_1778945434.pdb > /var/tmp/scwrl_1778945434.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1778945434.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 141 # copying to AlignedFragments data structure # naming current conformation ROKKY_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_233025234.pdb -s /var/tmp/to_scwrl_233025234.seq -o /var/tmp/from_scwrl_233025234.pdb > /var/tmp/scwrl_233025234.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_233025234.pdb # conformation set from SCWRL output # naming current conformation ROKKY_TS2-scwrl # ReadConformPDB reading from PDB file servers/SAM-T02_AL1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0361 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_26677280.pdb -s /var/tmp/to_scwrl_26677280.seq -o /var/tmp/from_scwrl_26677280.pdb > /var/tmp/scwrl_26677280.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_26677280.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 T0361 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_899167577.pdb -s /var/tmp/to_scwrl_899167577.seq -o /var/tmp/from_scwrl_899167577.pdb > /var/tmp/scwrl_899167577.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_899167577.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 T0361 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_814501069.pdb -s /var/tmp/to_scwrl_814501069.seq -o /var/tmp/from_scwrl_814501069.pdb > /var/tmp/scwrl_814501069.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_814501069.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 T0361 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_565178856.pdb -s /var/tmp/to_scwrl_565178856.seq -o /var/tmp/from_scwrl_565178856.pdb > /var/tmp/scwrl_565178856.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_565178856.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 T0361 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_96200856.pdb -s /var/tmp/to_scwrl_96200856.seq -o /var/tmp/from_scwrl_96200856.pdb > /var/tmp/scwrl_96200856.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_96200856.pdb # conformation set from SCWRL output # naming current conformation SAM-T02_AL5-scwrl # ReadConformPDB reading from PDB file servers/SAM_T06_server_TS1.pdb.gz looking for model 1 # Found a chain break before 137 # copying to AlignedFragments data structure # naming current conformation SAM_T06_server_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_907612031.pdb -s /var/tmp/to_scwrl_907612031.seq -o /var/tmp/from_scwrl_907612031.pdb > /var/tmp/scwrl_907612031.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_907612031.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 T0361 can't currently be optimized by undertaker # naming current conformation SAM_T06_server_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1587294248.pdb -s /var/tmp/to_scwrl_1587294248.seq -o /var/tmp/from_scwrl_1587294248.pdb > /var/tmp/scwrl_1587294248.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1587294248.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 T0361 can't currently be optimized by undertaker # naming current conformation SAM_T06_server_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1188476192.pdb -s /var/tmp/to_scwrl_1188476192.seq -o /var/tmp/from_scwrl_1188476192.pdb > /var/tmp/scwrl_1188476192.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1188476192.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 T0361 can't currently be optimized by undertaker # naming current conformation SAM_T06_server_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1269034916.pdb -s /var/tmp/to_scwrl_1269034916.seq -o /var/tmp/from_scwrl_1269034916.pdb > /var/tmp/scwrl_1269034916.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1269034916.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 T0361 can't currently be optimized by undertaker # naming current conformation SAM_T06_server_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_123548562.pdb -s /var/tmp/to_scwrl_123548562.seq -o /var/tmp/from_scwrl_123548562.pdb > /var/tmp/scwrl_123548562.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_123548562.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 100 # copying to AlignedFragments data structure # naming current conformation SP3_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1105284453.pdb -s /var/tmp/to_scwrl_1105284453.seq -o /var/tmp/from_scwrl_1105284453.pdb > /var/tmp/scwrl_1105284453.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1105284453.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 149 # copying to AlignedFragments data structure # naming current conformation SP3_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_535194518.pdb -s /var/tmp/to_scwrl_535194518.seq -o /var/tmp/from_scwrl_535194518.pdb > /var/tmp/scwrl_535194518.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_535194518.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 38 # copying to AlignedFragments data structure # naming current conformation SP3_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_870756761.pdb -s /var/tmp/to_scwrl_870756761.seq -o /var/tmp/from_scwrl_870756761.pdb > /var/tmp/scwrl_870756761.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_870756761.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 142 # copying to AlignedFragments data structure # naming current conformation SP3_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1916605110.pdb -s /var/tmp/to_scwrl_1916605110.seq -o /var/tmp/from_scwrl_1916605110.pdb > /var/tmp/scwrl_1916605110.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1916605110.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 149 # copying to AlignedFragments data structure # naming current conformation SP3_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1975868941.pdb -s /var/tmp/to_scwrl_1975868941.seq -o /var/tmp/from_scwrl_1975868941.pdb > /var/tmp/scwrl_1975868941.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1975868941.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 134 # copying to AlignedFragments data structure # naming current conformation SP4_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1630190637.pdb -s /var/tmp/to_scwrl_1630190637.seq -o /var/tmp/from_scwrl_1630190637.pdb > /var/tmp/scwrl_1630190637.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1630190637.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 161 # copying to AlignedFragments data structure # naming current conformation SP4_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_713345897.pdb -s /var/tmp/to_scwrl_713345897.seq -o /var/tmp/from_scwrl_713345897.pdb > /var/tmp/scwrl_713345897.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_713345897.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 110 # copying to AlignedFragments data structure # naming current conformation SP4_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_243968438.pdb -s /var/tmp/to_scwrl_243968438.seq -o /var/tmp/from_scwrl_243968438.pdb > /var/tmp/scwrl_243968438.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_243968438.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 107 # copying to AlignedFragments data structure # naming current conformation SP4_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1892795231.pdb -s /var/tmp/to_scwrl_1892795231.seq -o /var/tmp/from_scwrl_1892795231.pdb > /var/tmp/scwrl_1892795231.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1892795231.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 # Found a chain break before 47 # copying to AlignedFragments data structure # naming current conformation SP4_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1316977312.pdb -s /var/tmp/to_scwrl_1316977312.seq -o /var/tmp/from_scwrl_1316977312.pdb > /var/tmp/scwrl_1316977312.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1316977312.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 44 # copying to AlignedFragments data structure # naming current conformation SPARKS2_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_2135569240.pdb -s /var/tmp/to_scwrl_2135569240.seq -o /var/tmp/from_scwrl_2135569240.pdb > /var/tmp/scwrl_2135569240.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2135569240.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 61 # copying to AlignedFragments data structure # naming current conformation SPARKS2_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_8273565.pdb -s /var/tmp/to_scwrl_8273565.seq -o /var/tmp/from_scwrl_8273565.pdb > /var/tmp/scwrl_8273565.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_8273565.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 151 # copying to AlignedFragments data structure # naming current conformation SPARKS2_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1219569036.pdb -s /var/tmp/to_scwrl_1219569036.seq -o /var/tmp/from_scwrl_1219569036.pdb > /var/tmp/scwrl_1219569036.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1219569036.pdb # conformation set from SCWRL output # naming current conformation SPARKS2_TS3-scwrl # ReadConformPDB reading from PDB file servers/SPARKS2_TS4.pdb.gz looking for model 1 # Found a chain break before 161 # copying to AlignedFragments data structure # naming current conformation SPARKS2_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1139118086.pdb -s /var/tmp/to_scwrl_1139118086.seq -o /var/tmp/from_scwrl_1139118086.pdb > /var/tmp/scwrl_1139118086.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1139118086.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 150 # copying to AlignedFragments data structure # naming current conformation SPARKS2_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_2045337683.pdb -s /var/tmp/to_scwrl_2045337683.seq -o /var/tmp/from_scwrl_2045337683.pdb > /var/tmp/scwrl_2045337683.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2045337683.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 T0361 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation UNI-EID_bnmx_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_2144477630.pdb -s /var/tmp/to_scwrl_2144477630.seq -o /var/tmp/from_scwrl_2144477630.pdb > /var/tmp/scwrl_2144477630.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2144477630.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 T0361 can't currently be optimized by undertaker # naming current conformation UNI-EID_bnmx_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1859054844.pdb -s /var/tmp/to_scwrl_1859054844.seq -o /var/tmp/from_scwrl_1859054844.pdb > /var/tmp/scwrl_1859054844.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1859054844.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 T0361 can't currently be optimized by undertaker # naming current conformation UNI-EID_bnmx_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_646591851.pdb -s /var/tmp/to_scwrl_646591851.seq -o /var/tmp/from_scwrl_646591851.pdb > /var/tmp/scwrl_646591851.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_646591851.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 T0361 can't currently be optimized by undertaker # naming current conformation UNI-EID_bnmx_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1354222948.pdb -s /var/tmp/to_scwrl_1354222948.seq -o /var/tmp/from_scwrl_1354222948.pdb > /var/tmp/scwrl_1354222948.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1354222948.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 T0361 can't currently be optimized by undertaker # naming current conformation UNI-EID_bnmx_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1490516631.pdb -s /var/tmp/to_scwrl_1490516631.seq -o /var/tmp/from_scwrl_1490516631.pdb > /var/tmp/scwrl_1490516631.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1490516631.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 T0361 can't currently be optimized by undertaker # naming current conformation UNI-EID_expm_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_879617085.pdb -s /var/tmp/to_scwrl_879617085.seq -o /var/tmp/from_scwrl_879617085.pdb > /var/tmp/scwrl_879617085.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_879617085.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 T0361 can't currently be optimized by undertaker # naming current conformation UNI-EID_sfst_AL1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1380900228.pdb -s /var/tmp/to_scwrl_1380900228.seq -o /var/tmp/from_scwrl_1380900228.pdb > /var/tmp/scwrl_1380900228.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1380900228.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 T0361 can't currently be optimized by undertaker # naming current conformation UNI-EID_sfst_AL2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_242200562.pdb -s /var/tmp/to_scwrl_242200562.seq -o /var/tmp/from_scwrl_242200562.pdb > /var/tmp/scwrl_242200562.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_242200562.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 T0361 can't currently be optimized by undertaker # naming current conformation UNI-EID_sfst_AL3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1694118153.pdb -s /var/tmp/to_scwrl_1694118153.seq -o /var/tmp/from_scwrl_1694118153.pdb > /var/tmp/scwrl_1694118153.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1694118153.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 T0361 can't currently be optimized by undertaker # naming current conformation UNI-EID_sfst_AL4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1946079084.pdb -s /var/tmp/to_scwrl_1946079084.seq -o /var/tmp/from_scwrl_1946079084.pdb > /var/tmp/scwrl_1946079084.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1946079084.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 T0361 can't currently be optimized by undertaker # naming current conformation UNI-EID_sfst_AL5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_338401418.pdb -s /var/tmp/to_scwrl_338401418.seq -o /var/tmp/from_scwrl_338401418.pdb > /var/tmp/scwrl_338401418.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_338401418.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 167 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_454246537.pdb -s /var/tmp/to_scwrl_454246537.seq -o /var/tmp/from_scwrl_454246537.pdb > /var/tmp/scwrl_454246537.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_454246537.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 168 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1385889685.pdb -s /var/tmp/to_scwrl_1385889685.seq -o /var/tmp/from_scwrl_1385889685.pdb > /var/tmp/scwrl_1385889685.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1385889685.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 162 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1526877610.pdb -s /var/tmp/to_scwrl_1526877610.seq -o /var/tmp/from_scwrl_1526877610.pdb > /var/tmp/scwrl_1526877610.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1526877610.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 168 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1723281453.pdb -s /var/tmp/to_scwrl_1723281453.seq -o /var/tmp/from_scwrl_1723281453.pdb > /var/tmp/scwrl_1723281453.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1723281453.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 168 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1509438247.pdb -s /var/tmp/to_scwrl_1509438247.seq -o /var/tmp/from_scwrl_1509438247.pdb > /var/tmp/scwrl_1509438247.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1509438247.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 168 # copying to AlignedFragments data structure # naming current conformation beautshot_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_484678417.pdb -s /var/tmp/to_scwrl_484678417.seq -o /var/tmp/from_scwrl_484678417.pdb > /var/tmp/scwrl_484678417.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_484678417.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 T0361 can't currently be optimized by undertaker # naming current conformation beautshotbase_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_110992324.pdb -s /var/tmp/to_scwrl_110992324.seq -o /var/tmp/from_scwrl_110992324.pdb > /var/tmp/scwrl_110992324.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_110992324.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 T0361 can't currently be optimized by undertaker # naming current conformation forecast-s_AL1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_232711362.pdb -s /var/tmp/to_scwrl_232711362.seq -o /var/tmp/from_scwrl_232711362.pdb > /var/tmp/scwrl_232711362.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_232711362.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 T0361 can't currently be optimized by undertaker # naming current conformation forecast-s_AL2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_253799880.pdb -s /var/tmp/to_scwrl_253799880.seq -o /var/tmp/from_scwrl_253799880.pdb > /var/tmp/scwrl_253799880.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_253799880.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 T0361 can't currently be optimized by undertaker # naming current conformation forecast-s_AL3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_2086861266.pdb -s /var/tmp/to_scwrl_2086861266.seq -o /var/tmp/from_scwrl_2086861266.pdb > /var/tmp/scwrl_2086861266.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2086861266.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 T0361 can't currently be optimized by undertaker # naming current conformation forecast-s_AL4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1862901999.pdb -s /var/tmp/to_scwrl_1862901999.seq -o /var/tmp/from_scwrl_1862901999.pdb > /var/tmp/scwrl_1862901999.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1862901999.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 T0361 can't currently be optimized by undertaker # naming current conformation forecast-s_AL5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_967145777.pdb -s /var/tmp/to_scwrl_967145777.seq -o /var/tmp/from_scwrl_967145777.pdb > /var/tmp/scwrl_967145777.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_967145777.pdb # conformation set from SCWRL output # naming current conformation forecast-s_AL5-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv.2_TS1.pdb.gz looking for model 1 # Found a chain break before 147 # copying to AlignedFragments data structure # naming current conformation karypis.srv.2_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_183346057.pdb -s /var/tmp/to_scwrl_183346057.seq -o /var/tmp/from_scwrl_183346057.pdb > /var/tmp/scwrl_183346057.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_183346057.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 144 # copying to AlignedFragments data structure # naming current conformation karypis.srv.2_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1608213583.pdb -s /var/tmp/to_scwrl_1608213583.seq -o /var/tmp/from_scwrl_1608213583.pdb > /var/tmp/scwrl_1608213583.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1608213583.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 139 # copying to AlignedFragments data structure # naming current conformation karypis.srv.2_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_136639442.pdb -s /var/tmp/to_scwrl_136639442.seq -o /var/tmp/from_scwrl_136639442.pdb > /var/tmp/scwrl_136639442.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_136639442.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 161 # copying to AlignedFragments data structure # naming current conformation karypis.srv.2_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_171431650.pdb -s /var/tmp/to_scwrl_171431650.seq -o /var/tmp/from_scwrl_171431650.pdb > /var/tmp/scwrl_171431650.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_171431650.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 147 # copying to AlignedFragments data structure # naming current conformation karypis.srv.2_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1616487148.pdb -s /var/tmp/to_scwrl_1616487148.seq -o /var/tmp/from_scwrl_1616487148.pdb > /var/tmp/scwrl_1616487148.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1616487148.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 167 # copying to AlignedFragments data structure # naming current conformation karypis.srv.4_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1356208479.pdb -s /var/tmp/to_scwrl_1356208479.seq -o /var/tmp/from_scwrl_1356208479.pdb > /var/tmp/scwrl_1356208479.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1356208479.pdb # conformation set from SCWRL output # naming current conformation karypis.srv.4_TS1-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv.4_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0361 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation karypis.srv.4_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1310549736.pdb -s /var/tmp/to_scwrl_1310549736.seq -o /var/tmp/from_scwrl_1310549736.pdb > /var/tmp/scwrl_1310549736.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1310549736.pdb # conformation set from SCWRL output # naming current conformation karypis.srv.4_TS2-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv.4_TS3.pdb.gz looking for model 1 # Found a chain break before 168 # copying to AlignedFragments data structure # naming current conformation karypis.srv.4_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1514341185.pdb -s /var/tmp/to_scwrl_1514341185.seq -o /var/tmp/from_scwrl_1514341185.pdb > /var/tmp/scwrl_1514341185.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1514341185.pdb # conformation set from SCWRL output # naming current conformation karypis.srv.4_TS3-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv.4_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0361 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation karypis.srv.4_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1353202462.pdb -s /var/tmp/to_scwrl_1353202462.seq -o /var/tmp/from_scwrl_1353202462.pdb > /var/tmp/scwrl_1353202462.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1353202462.pdb # conformation set from SCWRL output # naming current conformation karypis.srv.4_TS4-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv.4_TS5.pdb.gz looking for model 1 # Found a chain break before 168 # copying to AlignedFragments data structure # naming current conformation karypis.srv.4_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1022120935.pdb -s /var/tmp/to_scwrl_1022120935.seq -o /var/tmp/from_scwrl_1022120935.pdb > /var/tmp/scwrl_1022120935.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1022120935.pdb # conformation set from SCWRL output # naming current conformation karypis.srv.4_TS5-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0361 can't currently be optimized by undertaker # naming current conformation karypis.srv_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_13449389.pdb -s /var/tmp/to_scwrl_13449389.seq -o /var/tmp/from_scwrl_13449389.pdb > /var/tmp/scwrl_13449389.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_13449389.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 # Found a chain break before 168 # copying to AlignedFragments data structure # naming current conformation karypis.srv_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_559941764.pdb -s /var/tmp/to_scwrl_559941764.seq -o /var/tmp/from_scwrl_559941764.pdb > /var/tmp/scwrl_559941764.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_559941764.pdb # conformation set from SCWRL output # naming current conformation karypis.srv_TS2-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0361 can't currently be optimized by undertaker # naming current conformation karypis.srv_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_365153919.pdb -s /var/tmp/to_scwrl_365153919.seq -o /var/tmp/from_scwrl_365153919.pdb > /var/tmp/scwrl_365153919.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_365153919.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 T0361 can't currently be optimized by undertaker # naming current conformation karypis.srv_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_893066474.pdb -s /var/tmp/to_scwrl_893066474.seq -o /var/tmp/from_scwrl_893066474.pdb > /var/tmp/scwrl_893066474.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_893066474.pdb # conformation set from SCWRL output # naming current conformation karypis.srv_TS4-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0361 can't currently be optimized by undertaker # naming current conformation karypis.srv_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1940841992.pdb -s /var/tmp/to_scwrl_1940841992.seq -o /var/tmp/from_scwrl_1940841992.pdb > /var/tmp/scwrl_1940841992.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1940841992.pdb # conformation set from SCWRL output # naming current conformation karypis.srv_TS5-scwrl # ReadConformPDB reading from PDB file servers/keasar-server_TS1.pdb.gz looking for model 1 # naming current conformation keasar-server_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_607354481.pdb -s /var/tmp/to_scwrl_607354481.seq -o /var/tmp/from_scwrl_607354481.pdb > /var/tmp/scwrl_607354481.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_607354481.pdb # conformation set from SCWRL output # naming current conformation keasar-server_TS1-scwrl # ReadConformPDB reading from PDB file servers/keasar-server_TS2.pdb.gz looking for model 1 # naming current conformation keasar-server_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_439700980.pdb -s /var/tmp/to_scwrl_439700980.seq -o /var/tmp/from_scwrl_439700980.pdb > /var/tmp/scwrl_439700980.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_439700980.pdb # conformation set from SCWRL output # naming current conformation keasar-server_TS2-scwrl # ReadConformPDB reading from PDB file servers/keasar-server_TS3.pdb.gz looking for model 1 # naming current conformation keasar-server_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1739437429.pdb -s /var/tmp/to_scwrl_1739437429.seq -o /var/tmp/from_scwrl_1739437429.pdb > /var/tmp/scwrl_1739437429.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1739437429.pdb # conformation set from SCWRL output # naming current conformation keasar-server_TS3-scwrl # ReadConformPDB reading from PDB file servers/keasar-server_TS4.pdb.gz looking for model 1 # naming current conformation keasar-server_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_945755899.pdb -s /var/tmp/to_scwrl_945755899.seq -o /var/tmp/from_scwrl_945755899.pdb > /var/tmp/scwrl_945755899.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_945755899.pdb # conformation set from SCWRL output # naming current conformation keasar-server_TS4-scwrl # ReadConformPDB reading from PDB file servers/keasar-server_TS5.pdb.gz looking for model 1 # naming current conformation keasar-server_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_893947517.pdb -s /var/tmp/to_scwrl_893947517.seq -o /var/tmp/from_scwrl_893947517.pdb > /var/tmp/scwrl_893947517.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_893947517.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 T0361 can't currently be optimized by undertaker # naming current conformation mGen-3D_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_977843469.pdb -s /var/tmp/to_scwrl_977843469.seq -o /var/tmp/from_scwrl_977843469.pdb > /var/tmp/scwrl_977843469.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_977843469.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 T0361 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation nFOLD_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_325149862.pdb -s /var/tmp/to_scwrl_325149862.seq -o /var/tmp/from_scwrl_325149862.pdb > /var/tmp/scwrl_325149862.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_325149862.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 T0361 can't currently be optimized by undertaker # naming current conformation nFOLD_TS2 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_469745323.pdb -s /var/tmp/to_scwrl_469745323.seq -o /var/tmp/from_scwrl_469745323.pdb > /var/tmp/scwrl_469745323.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_469745323.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 T0361 can't currently be optimized by undertaker # naming current conformation nFOLD_TS3 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_339798069.pdb -s /var/tmp/to_scwrl_339798069.seq -o /var/tmp/from_scwrl_339798069.pdb > /var/tmp/scwrl_339798069.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_339798069.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 T0361 can't currently be optimized by undertaker # naming current conformation nFOLD_TS4 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_809828280.pdb -s /var/tmp/to_scwrl_809828280.seq -o /var/tmp/from_scwrl_809828280.pdb > /var/tmp/scwrl_809828280.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_809828280.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 T0361 can't currently be optimized by undertaker # naming current conformation nFOLD_TS5 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_580737647.pdb -s /var/tmp/to_scwrl_580737647.seq -o /var/tmp/from_scwrl_580737647.pdb > /var/tmp/scwrl_580737647.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_580737647.pdb # conformation set from SCWRL output # naming current conformation nFOLD_TS5-scwrl # ReadConformPDB reading from PDB file servers/panther2_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0361 can't currently be optimized by undertaker # naming current conformation panther2_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_572509431.pdb -s /var/tmp/to_scwrl_572509431.seq -o /var/tmp/from_scwrl_572509431.pdb > /var/tmp/scwrl_572509431.log Error: can't open any of /var/tmp/from_scwrl_572509431.pdb or /var/tmp/from_scwrl_572509431_b.pdb or /var/tmp/from_scwrl_572509431_a.pdb Error: no new SCWRL conformation added # naming current conformation panther2_TS1-scwrl # ReadConformPDB reading from PDB file servers/shub_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0361 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation shub_TS1 # request to SCWRL produces command: ulimit -t 153 ; scwrl -i /var/tmp/to_scwrl_1063628160.pdb -s /var/tmp/to_scwrl_1063628160.seq -o /var/tmp/from_scwrl_1063628160.pdb > /var/tmp/scwrl_1063628160.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1063628160.pdb # conformation set from SCWRL output # naming current conformation shub_TS1-scwrl # command:CPU_time= 47.754 sec, elapsed time= 543.683 sec) # command:# Prefix for output files set to decoys/ # command:# Will now start reporting costs to decoys/evaluate.predburial.rdb # command:# CostConform shub_TS1-scwrl costs 488.323 real_cost = 201.732 shub_TS1 costs 483.024 real_cost = 205.974 panther2_TS1-scwrl costs 1129.549 real_cost = 431.557 nFOLD_TS5-scwrl costs 723.470 real_cost = 371.873 nFOLD_TS5 costs 11371.777 real_cost = 440.318 nFOLD_TS4-scwrl costs 822.037 real_cost = 371.730 nFOLD_TS4 costs 92618.243 real_cost = 404.132 nFOLD_TS3-scwrl costs 537.652 real_cost = 256.222 nFOLD_TS3 costs 8257.091 real_cost = 342.600 nFOLD_TS2-scwrl costs 544.492 real_cost = 295.646 nFOLD_TS2 costs 6678.913 real_cost = 381.906 nFOLD_TS1-scwrl costs 481.058 real_cost = 262.630 nFOLD_TS1 costs 16219.061 real_cost = 353.137 mGen-3D_TS1-scwrl costs 761.808 real_cost = 272.847 mGen-3D_TS1 costs 10520.349 real_cost = 327.369 keasar-server_TS5-scwrl costs 421.505 real_cost = 263.520 keasar-server_TS5 costs 426.430 real_cost = 265.051 keasar-server_TS4-scwrl costs 432.009 real_cost = 270.172 keasar-server_TS4 costs 432.664 real_cost = 274.989 keasar-server_TS3-scwrl costs 427.545 real_cost = 242.569 keasar-server_TS3 costs 432.557 real_cost = 251.438 keasar-server_TS2-scwrl costs 419.058 real_cost = 246.811 keasar-server_TS2 costs 425.998 real_cost = 254.842 keasar-server_TS1-scwrl costs 428.825 real_cost = 246.985 keasar-server_TS1 costs 436.232 real_cost = 247.947 karypis.srv_TS5-scwrl costs 431.205 real_cost = 220.678 karypis.srv_TS5 costs 418.350 real_cost = 220.319 karypis.srv_TS4-scwrl costs 450.044 real_cost = 235.486 karypis.srv_TS4 costs 437.335 real_cost = 235.658 karypis.srv_TS3-scwrl costs 436.262 real_cost = 199.170 karypis.srv_TS3 costs 429.929 real_cost = 196.541 karypis.srv_TS2-scwrl costs 456.550 real_cost = 225.178 karypis.srv_TS2 costs 456.550 real_cost = 225.178 karypis.srv_TS1-scwrl costs 536.446 real_cost = 191.693 karypis.srv_TS1 costs 519.902 real_cost = 190.530 karypis.srv.4_TS5-scwrl costs 527.965 real_cost = 281.811 karypis.srv.4_TS5 costs 527.303 real_cost = 281.768 karypis.srv.4_TS4-scwrl costs 552.939 real_cost = 265.571 karypis.srv.4_TS4 costs 552.727 real_cost = 266.486 karypis.srv.4_TS3-scwrl costs 493.807 real_cost = 291.742 karypis.srv.4_TS3 costs 493.807 real_cost = 291.742 karypis.srv.4_TS2-scwrl costs 628.927 real_cost = 307.361 karypis.srv.4_TS2 costs 629.779 real_cost = 306.898 karypis.srv.4_TS1-scwrl costs 499.439 real_cost = 289.518 karypis.srv.4_TS1 costs 499.439 real_cost = 289.518 karypis.srv.2_TS5-scwrl costs 450.903 real_cost = 257.520 karypis.srv.2_TS5 costs 450.657 real_cost = 257.243 karypis.srv.2_TS4-scwrl costs 429.087 real_cost = 240.430 karypis.srv.2_TS4 costs 429.087 real_cost = 240.430 karypis.srv.2_TS3-scwrl costs 431.900 real_cost = 185.142 karypis.srv.2_TS3 costs 431.544 real_cost = 185.541 karypis.srv.2_TS2-scwrl costs 454.902 real_cost = 280.220 karypis.srv.2_TS2 costs 454.902 real_cost = 280.220 karypis.srv.2_TS1-scwrl costs 463.499 real_cost = 238.303 karypis.srv.2_TS1 costs 464.301 real_cost = 238.206 forecast-s_AL5-scwrl costs 1110.500 real_cost = 445.304 forecast-s_AL5 costs 12836.609 real_cost = 494.388 forecast-s_AL4-scwrl costs 943.497 real_cost = 437.815 forecast-s_AL4 costs 24774.043 real_cost = 503.087 forecast-s_AL3-scwrl costs 970.229 real_cost = 438.979 forecast-s_AL3 costs 30699.791 real_cost = 509.576 forecast-s_AL2-scwrl costs 986.424 real_cost = 451.829 forecast-s_AL2 costs 112715.251 real_cost = 507.721 forecast-s_AL1-scwrl costs 756.826 real_cost = 386.255 forecast-s_AL1 costs 66410.993 real_cost = 471.962 beautshotbase_TS1-scwrl costs 496.790 real_cost = 199.312 beautshotbase_TS1 costs 478.102 real_cost = 197.916 beautshot_TS1-scwrl costs 535.570 real_cost = 233.513 beautshot_TS1 costs 522.411 real_cost = 240.933 Zhang-Server_TS5-scwrl costs 419.670 real_cost = 143.728 Zhang-Server_TS5 costs 430.131 real_cost = 144.965 Zhang-Server_TS4-scwrl costs 428.572 real_cost = 168.143 Zhang-Server_TS4 costs 429.515 real_cost = 174.894 Zhang-Server_TS3-scwrl costs 436.274 real_cost = 147.432 Zhang-Server_TS3 costs 435.422 real_cost = 150.356 Zhang-Server_TS2-scwrl costs 428.842 real_cost = 195.300 Zhang-Server_TS2 costs 434.870 real_cost = 198.537 Zhang-Server_TS1-scwrl costs 415.637 real_cost = 188.531 Zhang-Server_TS1 costs 419.137 real_cost = 187.491 UNI-EID_sfst_AL5-scwrl costs 881.297 real_cost = 330.314 UNI-EID_sfst_AL5 costs 713762.926 real_cost = 390.065 UNI-EID_sfst_AL4-scwrl costs 795.767 real_cost = 324.070 UNI-EID_sfst_AL4 costs 36984.241 real_cost = 406.255 UNI-EID_sfst_AL3-scwrl costs 784.651 real_cost = 291.234 UNI-EID_sfst_AL3 costs 54554.497 real_cost = 363.189 UNI-EID_sfst_AL2-scwrl costs 931.245 real_cost = 326.867 UNI-EID_sfst_AL2 costs 37500.926 real_cost = 380.177 UNI-EID_sfst_AL1-scwrl costs 594.692 real_cost = 256.803 UNI-EID_sfst_AL1 costs 70830.265 real_cost = 362.611 UNI-EID_expm_TS1-scwrl costs 808.372 real_cost = 256.148 UNI-EID_expm_TS1 costs 26014.681 real_cost = 336.771 UNI-EID_bnmx_TS5-scwrl costs 580.267 real_cost = 255.772 UNI-EID_bnmx_TS5 costs 36266.920 real_cost = 361.473 UNI-EID_bnmx_TS4-scwrl costs 587.848 real_cost = 219.954 UNI-EID_bnmx_TS4 costs 60486.373 real_cost = 329.868 UNI-EID_bnmx_TS3-scwrl costs 630.925 real_cost = 283.735 UNI-EID_bnmx_TS3 costs 33548.343 real_cost = 396.488 UNI-EID_bnmx_TS2-scwrl costs 677.323 real_cost = 274.285 UNI-EID_bnmx_TS2 costs 30927.281 real_cost = 367.423 UNI-EID_bnmx_TS1-scwrl costs 472.090 real_cost = 235.892 UNI-EID_bnmx_TS1 costs 66949.120 real_cost = 369.610 SPARKS2_TS5-scwrl costs 409.257 real_cost = 249.544 SPARKS2_TS5 costs 417.344 real_cost = 258.790 SPARKS2_TS4-scwrl costs 417.582 real_cost = 258.170 SPARKS2_TS4 costs 421.352 real_cost = 259.654 SPARKS2_TS3-scwrl costs 410.513 real_cost = 212.201 SPARKS2_TS3 costs 421.192 real_cost = 221.288 SPARKS2_TS2-scwrl costs 389.853 real_cost = 213.566 SPARKS2_TS2 costs 398.106 real_cost = 213.111 SPARKS2_TS1-scwrl costs 396.184 real_cost = 204.795 SPARKS2_TS1 costs 406.973 real_cost = 205.718 SP4_TS5-scwrl costs 391.867 real_cost = 213.343 SP4_TS5 costs 402.113 real_cost = 216.289 SP4_TS4-scwrl costs 428.887 real_cost = 191.285 SP4_TS4 costs 436.396 real_cost = 197.805 SP4_TS3-scwrl costs 405.821 real_cost = 205.394 SP4_TS3 costs 415.514 real_cost = 208.215 SP4_TS2-scwrl costs 399.071 real_cost = 196.886 SP4_TS2 costs 410.214 real_cost = 204.342 SP4_TS1-scwrl costs 413.968 real_cost = 208.234 SP4_TS1 costs 417.169 real_cost = 209.705 SP3_TS5-scwrl costs 403.480 real_cost = 176.543 SP3_TS5 costs 406.006 real_cost = 181.628 SP3_TS4-scwrl costs 418.170 real_cost = 215.986 SP3_TS4 costs 420.509 real_cost = 218.926 SP3_TS3-scwrl costs 387.417 real_cost = 203.886 SP3_TS3 costs 399.758 real_cost = 205.802 SP3_TS2-scwrl costs 392.185 real_cost = 209.723 SP3_TS2 costs 404.988 real_cost = 216.779 SP3_TS1-scwrl costs 393.282 real_cost = 192.854 SP3_TS1 costs 405.691 real_cost = 200.212 SAM_T06_server_TS5-scwrl costs 827.903 real_cost = 370.150 SAM_T06_server_TS5 costs 693.590 real_cost = 331.453 SAM_T06_server_TS4-scwrl costs 791.591 real_cost = 329.015 SAM_T06_server_TS4 costs 715.783 real_cost = 309.930 SAM_T06_server_TS3-scwrl costs 647.247 real_cost = 263.651 SAM_T06_server_TS3 costs 580.385 real_cost = 244.945 SAM_T06_server_TS2-scwrl costs 1200.490 real_cost = 397.390 SAM_T06_server_TS2 costs 1139.993 real_cost = 382.204 SAM_T06_server_TS1-scwrl costs 359.000 real_cost = 208.701 SAM_T06_server_TS1 costs 354.187 real_cost = 209.027 SAM-T02_AL5-scwrl costs 1416.127 real_cost = 490.314 SAM-T02_AL5 costs 5706.320 real_cost = 547.332 SAM-T02_AL4-scwrl costs 862.571 real_cost = 362.034 SAM-T02_AL4 costs 103778.803 real_cost = 436.937 SAM-T02_AL3-scwrl costs 772.960 real_cost = 326.375 SAM-T02_AL3 costs 39783.989 real_cost = 406.722 SAM-T02_AL2-scwrl costs 922.450 real_cost = 380.372 SAM-T02_AL2 costs 17890.675 real_cost = 437.941 SAM-T02_AL1-scwrl costs 1403.968 real_cost = 490.318 SAM-T02_AL1 costs 198767.988 real_cost = 492.436 ROKKY_TS2-scwrl costs 410.070 real_cost = 222.639 ROKKY_TS2 costs 425.482 real_cost = 225.757 ROKKY_TS1-scwrl costs 403.230 real_cost = 214.217 ROKKY_TS1 costs 416.332 real_cost = 216.261 ROBETTA_TS5-scwrl costs 414.633 real_cost = 210.669 ROBETTA_TS5 costs 408.706 real_cost = 209.727 ROBETTA_TS4-scwrl costs 368.336 real_cost = 135.006 ROBETTA_TS4 costs 364.046 real_cost = 136.279 ROBETTA_TS3-scwrl costs 451.877 real_cost = 214.479 ROBETTA_TS3 costs 450.252 real_cost = 216.368 ROBETTA_TS2-scwrl costs 381.410 real_cost = 150.512 ROBETTA_TS2 costs 371.089 real_cost = 149.005 ROBETTA_TS1-scwrl costs 419.368 real_cost = 211.071 ROBETTA_TS1 costs 415.533 real_cost = 213.845 RAPTOR_TS5-scwrl costs 412.538 real_cost = 215.039 RAPTOR_TS5 costs 420.363 real_cost = 216.510 RAPTOR_TS4-scwrl costs 419.176 real_cost = 214.975 RAPTOR_TS4 costs 432.900 real_cost = 224.998 RAPTOR_TS3-scwrl costs 680.153 real_cost = 231.359 RAPTOR_TS3 costs 738.676 real_cost = 233.061 RAPTOR_TS2-scwrl costs 419.219 real_cost = 202.224 RAPTOR_TS2 costs 416.198 real_cost = 200.607 RAPTOR_TS1-scwrl costs 442.322 real_cost = 172.809 RAPTOR_TS1 costs 442.135 real_cost = 178.773 RAPTORESS_TS5-scwrl costs 408.484 real_cost = 225.310 RAPTORESS_TS5 costs 418.186 real_cost = 228.111 RAPTORESS_TS4-scwrl costs 410.195 real_cost = 243.911 RAPTORESS_TS4 costs 423.426 real_cost = 250.626 RAPTORESS_TS3-scwrl costs 427.286 real_cost = 213.135 RAPTORESS_TS3 costs 428.700 real_cost = 215.860 RAPTORESS_TS2-scwrl costs 403.494 real_cost = 212.828 RAPTORESS_TS2 costs 408.590 real_cost = 213.592 RAPTORESS_TS1-scwrl costs 424.720 real_cost = 183.343 RAPTORESS_TS1 costs 423.067 real_cost = 185.208 RAPTOR-ACE_TS5-scwrl costs 415.852 real_cost = 192.340 RAPTOR-ACE_TS5 costs 426.402 real_cost = 193.005 RAPTOR-ACE_TS4-scwrl costs 427.942 real_cost = 162.895 RAPTOR-ACE_TS4 costs 430.196 real_cost = 164.499 RAPTOR-ACE_TS3-scwrl costs 440.637 real_cost = 209.898 RAPTOR-ACE_TS3 costs 443.198 real_cost = 211.941 RAPTOR-ACE_TS2-scwrl costs 430.256 real_cost = 234.498 RAPTOR-ACE_TS2 costs 438.088 real_cost = 235.283 RAPTOR-ACE_TS1-scwrl costs 394.623 real_cost = 241.724 RAPTOR-ACE_TS1 costs 404.928 real_cost = 247.351 Pmodeller6_TS5-scwrl costs 433.122 real_cost = 201.284 Pmodeller6_TS5 costs 432.853 real_cost = 202.726 Pmodeller6_TS4-scwrl costs 414.633 real_cost = 210.669 Pmodeller6_TS4 costs 408.706 real_cost = 209.727 Pmodeller6_TS3-scwrl costs 417.613 real_cost = 193.929 Pmodeller6_TS3 costs 417.449 real_cost = 194.531 Pmodeller6_TS2-scwrl costs 360.582 real_cost = 127.079 Pmodeller6_TS2 costs 355.331 real_cost = 128.453 Pmodeller6_TS1-scwrl costs 381.410 real_cost = 150.512 Pmodeller6_TS1 costs 371.089 real_cost = 149.005 Phyre-2_TS5-scwrl costs 443.913 real_cost = 243.449 Phyre-2_TS5 costs 465.634 real_cost = 242.343 Phyre-2_TS4-scwrl costs 458.195 real_cost = 262.754 Phyre-2_TS4 costs 485.053 real_cost = 267.425 Phyre-2_TS3-scwrl costs 450.218 real_cost = 252.183 Phyre-2_TS3 costs 473.438 real_cost = 254.030 Phyre-2_TS2-scwrl costs 473.689 real_cost = 242.824 Phyre-2_TS2 costs 498.379 real_cost = 243.809 Phyre-2_TS1-scwrl costs 447.022 real_cost = 248.052 Phyre-2_TS1 costs 469.093 real_cost = 252.929 Phyre-1_TS1-scwrl costs 689.296 real_cost = 295.934 Phyre-1_TS1 costs 665.499 real_cost = 288.004 Pcons6_TS5-scwrl costs 447.160 real_cost = 246.809 Pcons6_TS5 costs 439.740 real_cost = 243.220 Pcons6_TS4-scwrl costs 449.454 real_cost = 234.509 Pcons6_TS4 costs 440.551 real_cost = 232.306 Pcons6_TS3-scwrl costs 453.272 real_cost = 218.137 Pcons6_TS3 costs 445.310 real_cost = 215.268 Pcons6_TS2-scwrl costs 452.079 real_cost = 232.765 Pcons6_TS2 costs 443.807 real_cost = 231.046 Pcons6_TS1-scwrl costs 449.383 real_cost = 216.339 Pcons6_TS1 costs 441.345 real_cost = 212.072 PROTINFO_TS5-scwrl costs 425.664 real_cost = 234.845 PROTINFO_TS5 costs 428.197 real_cost = 238.786 PROTINFO_TS4-scwrl costs 405.245 real_cost = 213.953 PROTINFO_TS4 costs 412.934 real_cost = 218.416 PROTINFO_TS3-scwrl costs 418.451 real_cost = 205.002 PROTINFO_TS3 costs 422.817 real_cost = 204.750 PROTINFO_TS2-scwrl costs 402.346 real_cost = 223.243 PROTINFO_TS2 costs 409.175 real_cost = 223.050 PROTINFO_TS1-scwrl costs 405.039 real_cost = 228.891 PROTINFO_TS1 costs 408.033 real_cost = 229.478 PROTINFO-AB_TS5-scwrl costs 410.575 real_cost = 212.384 PROTINFO-AB_TS5 costs 423.195 real_cost = 216.172 PROTINFO-AB_TS4-scwrl costs 404.806 real_cost = 218.618 PROTINFO-AB_TS4 costs 414.989 real_cost = 217.906 PROTINFO-AB_TS3-scwrl costs 413.630 real_cost = 208.246 PROTINFO-AB_TS3 costs 429.104 real_cost = 210.663 PROTINFO-AB_TS2-scwrl costs 406.747 real_cost = 217.099 PROTINFO-AB_TS2 costs 418.346 real_cost = 221.024 PROTINFO-AB_TS1-scwrl costs 413.727 real_cost = 216.135 PROTINFO-AB_TS1 costs 425.670 real_cost = 215.311 POMYSL_TS5-scwrl costs 521.921 real_cost = 297.733 POMYSL_TS5 costs 529.160 real_cost = 305.549 POMYSL_TS4-scwrl costs 494.761 real_cost = 247.493 POMYSL_TS4 costs 505.005 real_cost = 259.562 POMYSL_TS3-scwrl costs 530.470 real_cost = 254.782 POMYSL_TS3 costs 530.915 real_cost = 264.960 POMYSL_TS2-scwrl costs 525.550 real_cost = 312.466 POMYSL_TS2 costs 528.671 real_cost = 322.065 POMYSL_TS1-scwrl costs 502.077 real_cost = 296.266 POMYSL_TS1 costs 513.042 real_cost = 302.042 NN_PUT_lab_TS1-scwrl costs 396.184 real_cost = 204.795 NN_PUT_lab_TS1 costs 406.973 real_cost = 205.718 MetaTasser_TS5-scwrl costs 609.291 real_cost = 332.998 MetaTasser_TS5 costs 657.712 real_cost = 334.979 MetaTasser_TS4-scwrl costs 449.841 real_cost = 167.694 MetaTasser_TS4 costs 479.472 real_cost = 177.093 MetaTasser_TS3-scwrl costs 472.900 real_cost = 192.287 MetaTasser_TS3 costs 496.956 real_cost = 194.779 MetaTasser_TS2-scwrl costs 472.225 real_cost = 194.205 MetaTasser_TS2 costs 499.525 real_cost = 191.708 MetaTasser_TS1-scwrl costs 589.737 real_cost = 213.060 MetaTasser_TS1 costs 649.119 real_cost = 216.894 Ma-OPUS-server_TS5-scwrl costs 398.116 real_cost = 232.720 Ma-OPUS-server_TS5 costs 408.373 real_cost = 243.753 Ma-OPUS-server_TS4-scwrl costs 418.208 real_cost = 243.615 Ma-OPUS-server_TS4 costs 427.946 real_cost = 247.433 Ma-OPUS-server_TS3-scwrl costs 428.959 real_cost = 202.759 Ma-OPUS-server_TS3 costs 430.433 real_cost = 206.584 Ma-OPUS-server_TS2-scwrl costs 399.090 real_cost = 188.978 Ma-OPUS-server_TS2 costs 403.667 real_cost = 195.182 Ma-OPUS-server_TS1-scwrl costs 416.398 real_cost = 180.232 Ma-OPUS-server_TS1 costs 420.611 real_cost = 187.092 Ma-OPUS-server2_TS5-scwrl costs 423.609 real_cost = 230.098 Ma-OPUS-server2_TS5 costs 433.287 real_cost = 231.705 Ma-OPUS-server2_TS4-scwrl costs 421.109 real_cost = 224.044 Ma-OPUS-server2_TS4 costs 430.042 real_cost = 237.432 Ma-OPUS-server2_TS3-scwrl costs 458.763 real_cost = 221.085 Ma-OPUS-server2_TS3 costs 452.713 real_cost = 222.494 Ma-OPUS-server2_TS2-scwrl costs 443.833 real_cost = 244.739 Ma-OPUS-server2_TS2 costs 451.264 real_cost = 249.247 Ma-OPUS-server2_TS1-scwrl costs 400.003 real_cost = 184.923 Ma-OPUS-server2_TS1 costs 405.962 real_cost = 184.620 MIG_FROST_AL1-scwrl costs 1506.866 real_cost = 402.769 MIG_FROST_AL1 costs 3900.468 real_cost = 414.792 LOOPP_TS5-scwrl costs 490.424 real_cost = 231.041 LOOPP_TS5 costs 477.420 real_cost = 231.321 LOOPP_TS4-scwrl costs 599.046 real_cost = 219.362 LOOPP_TS4 costs 585.163 real_cost = 218.940 LOOPP_TS3-scwrl costs 428.150 real_cost = 150.444 LOOPP_TS3 costs 413.099 real_cost = 153.837 LOOPP_TS2-scwrl costs 567.584 real_cost = 228.112 LOOPP_TS2 costs 551.392 real_cost = 228.638 LOOPP_TS1-scwrl costs 560.184 real_cost = 244.321 LOOPP_TS1 costs 549.984 real_cost = 243.591 Huber-Torda-Server_TS5-scwrl costs 654.794 real_cost = 289.605 Huber-Torda-Server_TS5 costs 11275.923 real_cost = 349.746 Huber-Torda-Server_TS4-scwrl costs 726.598 real_cost = 306.149 Huber-Torda-Server_TS4 costs 4355.696 real_cost = 368.884 Huber-Torda-Server_TS3-scwrl costs 692.578 real_cost = 289.347 Huber-Torda-Server_TS3 costs 5146.727 real_cost = 353.335 Huber-Torda-Server_TS2-scwrl costs 597.629 real_cost = 280.491 Huber-Torda-Server_TS2 costs 24776.094 real_cost = 367.606 Huber-Torda-Server_TS1-scwrl costs 767.876 real_cost = 344.088 Huber-Torda-Server_TS1 costs 24782.125 real_cost = 377.131 HHpred3_TS1-scwrl costs 502.926 real_cost = 234.365 HHpred3_TS1 costs 513.119 real_cost = 243.876 HHpred2_TS1-scwrl costs 433.371 real_cost = 213.988 HHpred2_TS1 costs 441.411 real_cost = 215.431 HHpred1_TS1-scwrl costs 440.876 real_cost = 211.429 HHpred1_TS1 costs 449.366 real_cost = 222.855 GeneSilicoMetaServer_TS5-scwrl costs 411.072 real_cost = 187.181 GeneSilicoMetaServer_TS5 costs 428.678 real_cost = 192.208 GeneSilicoMetaServer_TS4-scwrl costs 395.564 real_cost = 242.545 GeneSilicoMetaServer_TS4 costs 405.109 real_cost = 244.559 GeneSilicoMetaServer_TS3-scwrl costs 416.961 real_cost = 233.210 GeneSilicoMetaServer_TS3 costs 430.332 real_cost = 237.064 GeneSilicoMetaServer_TS2-scwrl costs 422.572 real_cost = 192.016 GeneSilicoMetaServer_TS2 costs 426.955 real_cost = 193.443 GeneSilicoMetaServer_TS1-scwrl costs 460.733 real_cost = 231.995 GeneSilicoMetaServer_TS1 costs 474.610 real_cost = 236.041 FUNCTION_TS5-scwrl costs 435.541 real_cost = 246.833 FUNCTION_TS5 costs 439.871 real_cost = 247.706 FUNCTION_TS4-scwrl costs 474.293 real_cost = 252.224 FUNCTION_TS4 costs 469.153 real_cost = 246.536 FUNCTION_TS3-scwrl costs 445.275 real_cost = 215.191 FUNCTION_TS3 costs 451.999 real_cost = 226.751 FUNCTION_TS2-scwrl costs 454.165 real_cost = 200.397 FUNCTION_TS2 costs 459.749 real_cost = 199.103 FUNCTION_TS1-scwrl costs 452.785 real_cost = 209.934 FUNCTION_TS1 costs 462.933 real_cost = 214.671 FUGUE_AL5-scwrl costs 1462.601 real_cost = 513.777 FUGUE_AL5 costs 2270.622 real_cost = 521.627 FUGUE_AL4-scwrl costs 633.706 real_cost = 305.430 FUGUE_AL4 costs 9092.116 real_cost = 404.183 FUGUE_AL3-scwrl costs 495.932 real_cost = 219.943 FUGUE_AL3 costs 25602.621 real_cost = 337.337 FUGUE_AL2-scwrl costs 1184.682 real_cost = 357.071 FUGUE_AL2 costs 53816.918 real_cost = 357.071 FUGUE_AL1-scwrl costs 1189.015 real_cost = 323.066 FUGUE_AL1 costs 30398.688 real_cost = 323.066 FUGMOD_TS5-scwrl costs 1443.859 real_cost = 517.087 FUGMOD_TS5 costs 1434.561 real_cost = 527.979 FUGMOD_TS4-scwrl costs 480.967 real_cost = 265.027 FUGMOD_TS4 costs 478.687 real_cost = 268.255 FUGMOD_TS3-scwrl costs 419.783 real_cost = 211.804 FUGMOD_TS3 costs 432.271 real_cost = 217.828 FUGMOD_TS2-scwrl costs 397.995 real_cost = 237.978 FUGMOD_TS2 costs 408.125 real_cost = 239.900 FUGMOD_TS1-scwrl costs 421.992 real_cost = 195.889 FUGMOD_TS1 costs 427.508 real_cost = 195.075 FPSOLVER-SERVER_TS5-scwrl costs 477.103 real_cost = 284.018 FPSOLVER-SERVER_TS5 costs 477.691 real_cost = 289.295 FPSOLVER-SERVER_TS4-scwrl costs 473.455 real_cost = 295.553 FPSOLVER-SERVER_TS4 costs 472.982 real_cost = 304.727 FPSOLVER-SERVER_TS3-scwrl costs 480.714 real_cost = 317.035 FPSOLVER-SERVER_TS3 costs 483.091 real_cost = 324.516 FPSOLVER-SERVER_TS2-scwrl costs 450.470 real_cost = 222.250 FPSOLVER-SERVER_TS2 costs 452.780 real_cost = 233.070 FPSOLVER-SERVER_TS1-scwrl costs 458.762 real_cost = 247.124 FPSOLVER-SERVER_TS1 costs 461.398 real_cost = 249.616 FORTE2_AL5-scwrl costs 620.463 real_cost = 315.591 FORTE2_AL5 costs 37084.157 real_cost = 425.740 FORTE2_AL4-scwrl costs 570.412 real_cost = 288.162 FORTE2_AL4 costs 234930.803 real_cost = 408.785 FORTE2_AL3-scwrl costs 472.537 real_cost = 231.187 FORTE2_AL3 costs 38070.690 real_cost = 356.221 FORTE2_AL2-scwrl costs 675.916 real_cost = 329.138 FORTE2_AL2 costs 41456.702 real_cost = 436.785 FORTE2_AL1-scwrl costs 582.849 real_cost = 262.051 FORTE2_AL1 costs 25625.313 real_cost = 363.233 FORTE1_AL5-scwrl costs 472.537 real_cost = 231.187 FORTE1_AL5 costs 38070.690 real_cost = 356.221 FORTE1_AL4-scwrl costs 546.711 real_cost = 315.567 FORTE1_AL4 costs 22779.491 real_cost = 420.554 FORTE1_AL3-scwrl costs 626.701 real_cost = 344.689 FORTE1_AL3 costs 111274.891 real_cost = 463.261 FORTE1_AL2-scwrl costs 675.916 real_cost = 329.138 FORTE1_AL2 costs 41456.702 real_cost = 436.785 FORTE1_AL1-scwrl costs 582.849 real_cost = 262.051 FORTE1_AL1 costs 25625.313 real_cost = 363.233 FOLDpro_TS5-scwrl costs 420.246 real_cost = 217.016 FOLDpro_TS5 costs 422.569 real_cost = 226.622 FOLDpro_TS4-scwrl costs 486.042 real_cost = 286.463 FOLDpro_TS4 costs 501.778 real_cost = 291.350 FOLDpro_TS3-scwrl costs 455.755 real_cost = 288.162 FOLDpro_TS3 costs 460.934 real_cost = 290.238 FOLDpro_TS2-scwrl costs 395.474 real_cost = 223.490 FOLDpro_TS2 costs 404.736 real_cost = 231.968 FOLDpro_TS1-scwrl costs 406.448 real_cost = 206.328 FOLDpro_TS1 costs 417.567 real_cost = 212.580 FAMS_TS5-scwrl costs 532.337 real_cost = 231.856 FAMS_TS5 costs 503.720 real_cost = 237.397 FAMS_TS4-scwrl costs 467.541 real_cost = 215.179 FAMS_TS4 costs 474.473 real_cost = 226.123 FAMS_TS3-scwrl costs 416.943 real_cost = 199.858 FAMS_TS3 costs 425.978 real_cost = 204.228 FAMS_TS2-scwrl costs 422.111 real_cost = 179.791 FAMS_TS2 costs 423.626 real_cost = 184.005 FAMS_TS1-scwrl costs 438.675 real_cost = 230.426 FAMS_TS1 costs 446.567 real_cost = 229.311 FAMSD_TS5-scwrl costs 476.935 real_cost = 226.877 FAMSD_TS5 costs 475.486 real_cost = 228.009 FAMSD_TS4-scwrl costs 527.274 real_cost = 236.264 FAMSD_TS4 costs 506.355 real_cost = 236.548 FAMSD_TS3-scwrl costs 445.030 real_cost = 235.441 FAMSD_TS3 costs 444.843 real_cost = 242.262 FAMSD_TS2-scwrl costs 532.337 real_cost = 231.856 FAMSD_TS2 costs 503.720 real_cost = 237.397 FAMSD_TS1-scwrl costs 467.541 real_cost = 215.179 FAMSD_TS1 costs 474.473 real_cost = 226.123 Distill_TS5-scwrl costs 2529.038 real_cost = 461.325 Distill_TS4-scwrl costs 2525.802 real_cost = 459.373 Distill_TS3-scwrl costs 2524.802 real_cost = 470.257 Distill_TS2-scwrl costs 2522.666 real_cost = 462.059 Distill_TS1-scwrl costs 2524.178 real_cost = 461.466 CaspIta-FOX_TS5-scwrl costs 491.964 real_cost = 248.283 CaspIta-FOX_TS5 costs 483.324 real_cost = 244.871 CaspIta-FOX_TS4-scwrl costs 724.849 real_cost = 246.956 CaspIta-FOX_TS4 costs 636.668 real_cost = 240.465 CaspIta-FOX_TS3-scwrl costs 643.726 real_cost = 273.887 CaspIta-FOX_TS3 costs 606.821 real_cost = 270.312 CaspIta-FOX_TS2-scwrl costs 468.788 real_cost = 239.272 CaspIta-FOX_TS2 costs 458.924 real_cost = 239.494 CaspIta-FOX_TS1-scwrl costs 856.788 real_cost = 354.963 CaspIta-FOX_TS1 costs 812.692 real_cost = 337.513 CIRCLE_TS5-scwrl costs 453.218 real_cost = 210.853 CIRCLE_TS5 costs 456.560 real_cost = 208.731 CIRCLE_TS4-scwrl costs 428.176 real_cost = 215.859 CIRCLE_TS4 costs 430.679 real_cost = 214.461 CIRCLE_TS3-scwrl costs 422.111 real_cost = 179.791 CIRCLE_TS3 costs 423.626 real_cost = 184.005 CIRCLE_TS2-scwrl costs 501.896 real_cost = 236.021 CIRCLE_TS2 costs 494.920 real_cost = 239.660 CIRCLE_TS1-scwrl costs 416.943 real_cost = 199.858 CIRCLE_TS1 costs 425.978 real_cost = 204.228 Bilab-ENABLE_TS5-scwrl costs 496.408 real_cost = 198.379 Bilab-ENABLE_TS5 costs 495.830 real_cost = 198.385 Bilab-ENABLE_TS4-scwrl costs 416.615 real_cost = 209.044 Bilab-ENABLE_TS4 costs 416.615 real_cost = 209.044 Bilab-ENABLE_TS3-scwrl costs 389.940 real_cost = 234.458 Bilab-ENABLE_TS3 costs 389.914 real_cost = 234.244 Bilab-ENABLE_TS2-scwrl costs 511.223 real_cost = 198.894 Bilab-ENABLE_TS2 costs 509.079 real_cost = 198.930 Bilab-ENABLE_TS1-scwrl costs 562.373 real_cost = 180.444 Bilab-ENABLE_TS1 costs 562.373 real_cost = 180.444 BayesHH_TS1-scwrl costs 721.759 real_cost = 190.123 BayesHH_TS1 costs 683.934 real_cost = 188.739 ABIpro_TS5-scwrl costs 450.981 real_cost = 208.195 ABIpro_TS5 costs 450.981 real_cost = 208.195 ABIpro_TS4-scwrl costs 456.989 real_cost = 208.140 ABIpro_TS4 costs 455.805 real_cost = 207.491 ABIpro_TS3-scwrl costs 515.742 real_cost = 206.200 ABIpro_TS3 costs 516.426 real_cost = 205.970 ABIpro_TS2-scwrl costs 425.621 real_cost = 208.254 ABIpro_TS2 costs 426.190 real_cost = 208.255 ABIpro_TS1-scwrl costs 449.364 real_cost = 237.135 ABIpro_TS1 costs 448.241 real_cost = 237.193 3Dpro_TS5-scwrl costs 427.855 real_cost = 207.279 3Dpro_TS5 costs 436.737 real_cost = 221.699 3Dpro_TS4-scwrl costs 442.736 real_cost = 270.856 3Dpro_TS4 costs 456.651 real_cost = 274.211 3Dpro_TS3-scwrl costs 425.621 real_cost = 208.254 3Dpro_TS3 costs 426.190 real_cost = 208.255 3Dpro_TS2-scwrl costs 458.602 real_cost = 234.794 3Dpro_TS2 costs 469.065 real_cost = 251.424 3Dpro_TS1-scwrl costs 449.364 real_cost = 237.135 3Dpro_TS1 costs 448.241 real_cost = 237.193 3D-JIGSAW_TS5-scwrl costs 504.527 real_cost = 256.288 3D-JIGSAW_TS5 costs 491.316 real_cost = 257.317 3D-JIGSAW_TS4-scwrl costs 560.735 real_cost = 286.976 3D-JIGSAW_TS4 costs 539.658 real_cost = 283.247 3D-JIGSAW_TS3-scwrl costs 614.371 real_cost = 263.078 3D-JIGSAW_TS3 costs 584.001 real_cost = 263.971 3D-JIGSAW_TS2-scwrl costs 575.682 real_cost = 243.194 3D-JIGSAW_TS2 costs 538.649 real_cost = 248.203 3D-JIGSAW_TS1-scwrl costs 566.731 real_cost = 274.761 3D-JIGSAW_TS1 costs 541.178 real_cost = 281.866 3D-JIGSAW_RECOM_TS5-scwrl costs 618.641 real_cost = 268.251 3D-JIGSAW_RECOM_TS5 costs 576.474 real_cost = 260.441 3D-JIGSAW_RECOM_TS4-scwrl costs 619.906 real_cost = 264.471 3D-JIGSAW_RECOM_TS4 costs 583.185 real_cost = 259.470 3D-JIGSAW_RECOM_TS3-scwrl costs 612.298 real_cost = 265.657 3D-JIGSAW_RECOM_TS3 costs 570.214 real_cost = 258.565 3D-JIGSAW_RECOM_TS2-scwrl costs 485.757 real_cost = 226.754 3D-JIGSAW_RECOM_TS2 costs 492.336 real_cost = 231.896 3D-JIGSAW_RECOM_TS1-scwrl costs 560.850 real_cost = 217.570 3D-JIGSAW_RECOM_TS1 costs 519.203 real_cost = 222.672 3D-JIGSAW_POPULUS_TS5-scwrl costs 482.006 real_cost = 223.070 3D-JIGSAW_POPULUS_TS5 costs 464.239 real_cost = 221.685 3D-JIGSAW_POPULUS_TS4-scwrl costs 446.544 real_cost = 224.167 3D-JIGSAW_POPULUS_TS4 costs 446.436 real_cost = 224.315 3D-JIGSAW_POPULUS_TS3-scwrl costs 463.823 real_cost = 204.074 3D-JIGSAW_POPULUS_TS3 costs 449.845 real_cost = 201.715 3D-JIGSAW_POPULUS_TS2-scwrl costs 466.407 real_cost = 225.203 3D-JIGSAW_POPULUS_TS2 costs 448.516 real_cost = 223.133 3D-JIGSAW_POPULUS_TS1-scwrl costs 465.373 real_cost = 204.172 3D-JIGSAW_POPULUS_TS1 costs 448.840 real_cost = 202.600 T0361.try9-opt2.repack-nonPC.pdb.gz costs 351.092 real_cost = 198.551 T0361.try9-opt2.pdb.gz costs 347.344 real_cost = 200.829 T0361.try9-opt2.gromacs0.repack-nonPC.pdb.gz costs 359.590 real_cost = 202.576 T0361.try9-opt2.gromacs0.pdb.gz costs 355.891 real_cost = 202.906 T0361.try9-opt1.pdb.gz costs 353.918 real_cost = 201.174 T0361.try9-opt1-scwrl.pdb.gz costs 355.507 real_cost = 199.721 T0361.try8-opt2.repack-nonPC.pdb.gz costs 333.659 real_cost = 123.274 T0361.try8-opt2.pdb.gz costs 330.315 real_cost = 121.664 T0361.try8-opt2.gromacs0.repack-nonPC.pdb.gz costs 340.184 real_cost = 123.724 T0361.try8-opt2.gromacs0.pdb.gz costs 338.468 real_cost = 123.439 T0361.try8-opt1.pdb.gz costs 335.162 real_cost = 123.083 T0361.try8-opt1-scwrl.pdb.gz costs 341.983 real_cost = 121.816 T0361.try7-opt2.repack-nonPC.pdb.gz costs 355.845 real_cost = 212.195 T0361.try7-opt2.pdb.gz costs 353.373 real_cost = 213.268 T0361.try7-opt2.gromacs0.repack-nonPC.pdb.gz costs 368.775 real_cost = 213.325 T0361.try7-opt2.gromacs0.pdb.gz costs 366.547 real_cost = 214.753 T0361.try7-opt1.pdb.gz costs 359.807 real_cost = 212.915 T0361.try7-opt1-scwrl.pdb.gz costs 361.184 real_cost = 213.432 T0361.try6-opt2.repack-nonPC.pdb.gz costs 351.385 real_cost = 198.686 T0361.try6-opt2.ps.pdb.gz costs 378.156 real_cost = 217.574 T0361.try6-opt2.pdb.gz costs 347.221 real_cost = 199.429 T0361.try6-opt2.gromacs0.repack-nonPC.pdb.gz costs 360.100 real_cost = 197.040 T0361.try6-opt2.gromacs0.pdb.gz costs 356.964 real_cost = 199.306 T0361.try6-opt1.pdb.gz costs 351.564 real_cost = 200.295 T0361.try6-opt1-scwrl.pdb.gz costs 355.274 real_cost = 199.049 T0361.try5-opt2.repack-nonPC.pdb.gz costs 354.344 real_cost = 203.517 T0361.try5-opt2.pdb.gz costs 349.993 real_cost = 204.812 T0361.try5-opt2.gromacs0.repack-nonPC.pdb.gz costs 362.678 real_cost = 206.477 T0361.try5-opt2.gromacs0.pdb.gz costs 360.599 real_cost = 205.780 T0361.try5-opt1.pdb.gz costs 349.529 real_cost = 203.202 T0361.try5-opt1-scwrl.pdb.gz costs 355.423 real_cost = 202.467 T0361.try4-opt2.repack-nonPC.pdb.gz costs 362.840 real_cost = 210.718 T0361.try4-opt2.pdb.gz costs 358.672 real_cost = 211.045 T0361.try4-opt2.gromacs0.repack-nonPC.pdb.gz costs 378.852 real_cost = 209.459 T0361.try4-opt2.gromacs0.pdb.gz costs 376.089 real_cost = 210.041 T0361.try4-opt1.pdb.gz costs 361.227 real_cost = 209.716 T0361.try4-opt1-scwrl.pdb.gz costs 366.634 real_cost = 208.325 T0361.try3-opt2.repack-nonPC.pdb.gz costs 364.128 real_cost = 210.471 T0361.try3-opt2.pdb.gz costs 361.240 real_cost = 211.365 T0361.try3-opt2.gromacs0.repack-nonPC.pdb.gz costs 379.253 real_cost = 210.408 T0361.try3-opt2.gromacs0.pdb.gz costs 377.031 real_cost = 209.651 T0361.try3-opt1.pdb.gz costs 364.202 real_cost = 211.093 T0361.try3-opt1-scwrl.pdb.gz costs 369.760 real_cost = 211.000 T0361.try20-opt2.repack-nonPC.pdb.gz costs 372.428 real_cost = 192.746 T0361.try20-opt2.pdb.gz costs 369.465 real_cost = 195.484 T0361.try20-opt2.gromacs0.repack-nonPC.pdb.gz costs 381.689 real_cost = 193.015 T0361.try20-opt2.gromacs0.pdb.gz costs 380.738 real_cost = 194.776 T0361.try20-opt1.pdb.gz costs 376.920 real_cost = 193.926 T0361.try20-opt1-scwrl.pdb.gz costs 378.273 real_cost = 193.669 T0361.try2-opt2.repack-nonPC.pdb.gz costs 354.159 real_cost = 204.170 T0361.try2-opt2.pdb.gz costs 350.109 real_cost = 202.441 T0361.try2-opt2.gromacs0.repack-nonPC.pdb.gz costs 364.142 real_cost = 202.864 T0361.try2-opt2.gromacs0.pdb.gz costs 361.089 real_cost = 204.289 T0361.try2-opt1.pdb.gz costs 353.108 real_cost = 207.452 T0361.try2-opt1-scwrl.pdb.gz costs 359.136 real_cost = 204.802 T0361.try19-opt2.repack-nonPC.pdb.gz costs 353.828 real_cost = 180.577 T0361.try19-opt2.pdb.gz costs 348.239 real_cost = 179.595 T0361.try19-opt2.gromacs0.repack-nonPC.pdb.gz costs 360.938 real_cost = 182.308 T0361.try19-opt2.gromacs0.pdb.gz costs 357.905 real_cost = 181.660 T0361.try19-opt1.pdb.gz costs 355.901 real_cost = 181.365 T0361.try19-opt1-scwrl.pdb.gz costs 356.860 real_cost = 181.664 T0361.try18-opt2.repack-nonPC.pdb.gz costs 350.021 real_cost = 195.336 T0361.try18-opt2.pdb.gz costs 346.652 real_cost = 197.788 T0361.try18-opt2.gromacs0.repack-nonPC.pdb.gz costs 359.566 real_cost = 196.738 T0361.try18-opt2.gromacs0.pdb.gz costs 356.640 real_cost = 198.108 T0361.try18-opt1.pdb.gz costs 348.846 real_cost = 195.703 T0361.try18-opt1-scwrl.pdb.gz costs 353.753 real_cost = 194.115 T0361.try17-opt2.repack-nonPC.pdb.gz costs 371.762 real_cost = 206.472 T0361.try17-opt2.pdb.gz costs 369.637 real_cost = 208.700 T0361.try17-opt2.gromacs0.repack-nonPC.pdb.gz costs 377.405 real_cost = 204.892 T0361.try17-opt2.gromacs0.pdb.gz costs 376.408 real_cost = 206.936 T0361.try17-opt1.pdb.gz costs 375.310 real_cost = 209.539 T0361.try17-opt1-scwrl.pdb.gz costs 375.798 real_cost = 208.458 T0361.try16-opt2.repack-nonPC.pdb.gz costs 367.309 real_cost = 174.302 T0361.try16-opt2.pdb.gz costs 363.283 real_cost = 170.297 T0361.try16-opt2.gromacs0.repack-nonPC.pdb.gz costs 376.345 real_cost = 172.791 T0361.try16-opt2.gromacs0.pdb.gz costs 375.410 real_cost = 170.168 T0361.try16-opt1.pdb.gz costs 368.171 real_cost = 173.812 T0361.try16-opt1-scwrl.pdb.gz costs 368.480 real_cost = 173.614 T0361.try15-opt2.repack-nonPC.pdb.gz costs 367.731 real_cost = 188.504 T0361.try15-opt2.pdb.gz costs 366.422 real_cost = 188.741 T0361.try15-opt2.gromacs0.repack-nonPC.pdb.gz costs 375.317 real_cost = 186.934 T0361.try15-opt2.gromacs0.pdb.gz costs 375.525 real_cost = 187.738 T0361.try15-opt1.pdb.gz costs 376.386 real_cost = 181.432 T0361.try15-opt1-scwrl.pdb.gz costs 377.919 real_cost = 181.051 T0361.try14-opt2.repack-nonPC.pdb.gz costs 348.479 real_cost = 201.048 T0361.try14-opt2.pdb.gz costs 343.869 real_cost = 202.569 T0361.try14-opt2.gromacs0.repack-nonPC.pdb.gz costs 358.121 real_cost = 198.866 T0361.try14-opt2.gromacs0.pdb.gz costs 355.964 real_cost = 199.881 T0361.try14-opt1.pdb.gz costs 346.842 real_cost = 201.073 T0361.try14-opt1-scwrl.pdb.gz costs 350.833 real_cost = 200.359 T0361.try13-opt2.repack-nonPC.pdb.gz costs 348.487 real_cost = 209.268 T0361.try13-opt2.pdb.gz costs 343.055 real_cost = 212.558 T0361.try13-opt2.gromacs0.repack-nonPC.pdb.gz costs 356.712 real_cost = 211.214 T0361.try13-opt2.gromacs0.pdb.gz costs 354.200 real_cost = 213.350 T0361.try13-opt1.pdb.gz costs 346.834 real_cost = 211.345 T0361.try13-opt1-scwrl.pdb.gz costs 350.648 real_cost = 209.442 T0361.try12-opt2.repack-nonPC.pdb.gz costs 362.410 real_cost = 201.908 T0361.try12-opt2.pdb.gz costs 360.534 real_cost = 201.556 T0361.try12-opt2.gromacs0.repack-nonPC.pdb.gz costs 373.566 real_cost = 203.159 T0361.try12-opt2.gromacs0.pdb.gz costs 372.193 real_cost = 203.766 T0361.try12-opt1.pdb.gz costs 367.952 real_cost = 198.630 T0361.try12-opt1-scwrl.pdb.gz costs 371.287 real_cost = 199.788 T0361.try11-opt2.repack-nonPC.pdb.gz costs 360.254 real_cost = 185.560 T0361.try11-opt2.pdb.gz costs 358.653 real_cost = 189.850 T0361.try11-opt2.gromacs0.repack-nonPC.pdb.gz costs 373.928 real_cost = 185.003 T0361.try11-opt2.gromacs0.pdb.gz costs 372.310 real_cost = 190.816 T0361.try11-opt1.pdb.gz costs 367.321 real_cost = 188.726 T0361.try11-opt1-scwrl.pdb.gz costs 367.837 real_cost = 183.293 T0361.try10-opt2.repack-nonPC.pdb.gz costs 355.737 real_cost = 229.212 T0361.try10-opt2.pdb.gz costs 353.799 real_cost = 228.484 T0361.try10-opt2.gromacs0.repack-nonPC.pdb.gz costs 371.450 real_cost = 227.619 T0361.try10-opt2.gromacs0.pdb.gz costs 368.676 real_cost = 229.954 T0361.try10-opt1.pdb.gz costs 362.080 real_cost = 230.031 T0361.try10-opt1-scwrl.pdb.gz costs 364.163 real_cost = 229.625 T0361.try1-opt2.repack-nonPC.pdb.gz costs 354.573 real_cost = 204.418 T0361.try1-opt2.pdb.gz costs 352.577 real_cost = 202.852 T0361.try1-opt2.gromacs0.repack-nonPC.pdb.gz costs 367.331 real_cost = 205.188 T0361.try1-opt2.gromacs0.pdb.gz costs 365.686 real_cost = 202.219 T0361.try1-opt1.pdb.gz costs 358.861 real_cost = 204.036 T0361.try1-opt1-scwrl.pdb.gz costs 363.380 real_cost = 204.652 ROBETTA_parent5.repack.pdb.gz costs 409.075 real_cost = 214.989 ROBETTA_parent4.repack.pdb.gz costs 405.626 real_cost = 205.922 ROBETTA_parent3.repack.pdb.gz costs 408.706 real_cost = 209.727 ROBETTA_parent2.repack.pdb.gz costs 450.252 real_cost = 216.368 ROBETTA_parent1.repack.pdb.gz costs 415.533 real_cost = 213.845 ROBETTA_deNovo9.repack.pdb.gz costs 355.059 real_cost = 132.912 ROBETTA_deNovo8.repack.pdb.gz costs 372.586 real_cost = 163.743 ROBETTA_deNovo7.repack.pdb.gz costs 372.425 real_cost = 140.733 ROBETTA_deNovo6.repack.pdb.gz costs 363.340 real_cost = 51.647 ROBETTA_deNovo5.repack.pdb.gz costs 349.047 real_cost = 126.327 ROBETTA_deNovo4.repack.pdb.gz costs 355.331 real_cost = 128.453 ROBETTA_deNovo3.repack.pdb.gz costs 361.984 real_cost = 99.521 ROBETTA_deNovo2.repack.pdb.gz costs 364.046 real_cost = 136.279 ROBETTA_deNovo10.repack.pdb.gz costs 345.257 real_cost = 169.948 ROBETTA_deNovo1.repack.pdb.gz costs 371.089 real_cost = 149.005 ../model5.ts-submitted costs 343.872 real_cost = 202.564 ../model4.ts-submitted costs 346.658 real_cost = 197.825 ../model3.ts-submitted costs 350.638 real_cost = 204.835 ../model2.ts-submitted costs 367.351 real_cost = 205.220 ../model1.ts-submitted costs 330.722 real_cost = 121.682 align5 costs 1179.558 real_cost = 397.100 align4 costs 709.115 real_cost = 235.765 align3 costs 1495.917 real_cost = 328.181 align2 costs 882.828 real_cost = 312.521 align1 costs 1439.197 real_cost = 385.347 T0361.try1-opt2.pdb costs 352.577 real_cost = 202.852 model5-scwrl costs 348.690 real_cost = 200.307 model5.ts-submitted costs 343.872 real_cost = 202.564 model4-scwrl costs 352.108 real_cost = 195.827 model4.ts-submitted costs 346.658 real_cost = 197.825 model3-scwrl costs 357.162 real_cost = 202.677 model3.ts-submitted costs 350.638 real_cost = 204.835 model2-scwrl costs 371.980 real_cost = 203.208 model2.ts-submitted costs 367.351 real_cost = 205.220 model1-scwrl costs 338.364 real_cost = 120.909 model1.ts-submitted costs 330.721 real_cost = 121.685 2hktA costs 409.011 real_cost = -887.800 # command:CPU_time= 614.164 sec, elapsed time= 1754.903 sec) # command:rm -f sort.tmp /projects/compbio/bin/sorttbl real_cost < decoys/evaluate.predburial.rdb > sort.tmp mv -f sort.tmp decoys/evaluate.predburial.rdb mv -f decoys/evaluate.predburial.pretty decoys/evaluate.predburial.pretty.old /projects/compbio/experiments/protein-predict/casp7/scripts/prettyscore -terse -targpfx -decpoint < decoys/evaluate.predburial.rdb > decoys/evaluate.predburial.pretty make[1]: Leaving directory `/projects/compbio/experiments/protein-predict/casp7/T0361'