make[1]: Entering directory `/projects/compbio/experiments/protein-predict/casp7/T0378' /projects/compbio/experiments/protein-predict/casp7/starter-directory/Make.main:725: SECONDARY_TARGET = T0378.t06.str2 mkdir -p decoys rm decoys/read-pdb+servers.under cd decoys; shopt -s nullglob ; for x in ../*.ts-submitted* ; do echo ReadConformPDB $x >> read-pdb+servers.under ; done cd decoys; shopt -s nullglob ; for x in *.pdb* ; do echo ReadConformPDB $x >> read-pdb+servers.under ; done cd decoys; shopt -s nullglob ; for x in ../*mer/decoys/*.pdb* ; \ do echo ReadConformPDB $x chain A >> read-pdb+servers.under ; \ y=${x#../} ;\ z=${y/decoys} ;\ a=${z/T0378.} ;\ b=${a%.gz} ;\ c=${b%.pdb} ;\ echo NameConform $c >> read-pdb+servers.under ; \ done cd decoys; shopt -s nullglob ; for x in servers/*.pdb.gz ; do \ echo ReadConformPDB $x >> read-pdb+servers.under ; \ y=${x%.pdb.gz} ; \ z=${y#servers/} ; \ echo NameConform $z >> read-pdb+servers.under ; \ echo SCWRLConform >> read-pdb+servers.under ; \ echo NameConform $z-scwrl >> read-pdb+servers.under ; \ done chgrp protein decoys/read-pdb+servers.under chmod g+w decoys/read-pdb+servers.under rm -f decoys/evaluate.anglevector.rdb sed -e s/XXX0000/T0378/ -e s/START_COL/1/ \ -e s/COSTFCN/anglevector/ \ -e s/_domain// \ -e s/read-pdb/read-pdb+servers/ \ -e s/REAL_PDB/2i6dA/ \ < /projects/compbio/experiments/protein-predict/casp7/starter-directory/evaluate.under \ | nice -2 /cse/grads/jarchie/projects/cvs/karplus/undertaker/undertaker # command:# Seed set to 1182940191 # command:# Prefix for input files set to /projects/compbio/experiments/undertaker/atoms-inputs/ # command:# reading monomeric-50pc.atoms # #computed average backbone with maximum peptide_sq_deviance = 0.002 # computed average trans backbone unit from 8101 examples # computed average cis backbone unit from 20 examples # computed average trans backbone unit before proline from 332 examples # trans (non-proline) backbone unit: # CA= -2.2101 1.0129 -0.0033 # O= -0.1508 2.2440 0.0016 # C= -0.6897 1.1364 -0.0000 # N+1= 0.0000 0.0000 0.0000 # CA+1= 1.4583 -0.0000 -0.0000 # cis backbone unit: # CA= -0.1438 2.4522 0.0007 # O= -2.0283 0.9702 0.0005 # C= -0.8017 1.0759 0.0000 # N+1= 0.0000 0.0000 0.0000 # CA+1= 1.4664 -0.0000 0.0000 # trans backbone unit before proline: # CA= -2.2110 1.0636 -0.0014 # O= -0.1234 2.2469 0.0075 # C= -0.6877 1.1518 0.0000 # N+1= 0.0000 0.0000 0.0000 # CA+1= 1.4665 0.0000 0.0000 # After reading monomeric-50pc.atoms have 448 chains in training database # Count of chains,residues,atoms: 448,112605,876684 # 111048 residues have no bad marker # 665 residues lack atoms needed to compute omega # 322 residues have cis peptide # number of each bad type: # NON_STANDARD_RESIDUE 6 # HAS_OXT 325 # TOO_MANY_ATOMS 1 # TOO_FEW_ATOMS 523 # HAS_UNKNOWN_ATOMS 2 # HAS_DUPLICATE_ATOMS 0 # CHAIN_BREAK_BEFORE 208 # NON_PLANAR_PEPTIDE 143 # BAD_PEPTIDE 685 # Note: may sum to more than number of residues, # because one residue may have multiple problems # command:# Reading rotamer library from dunbrack-1332.rot # command:# Prefix for input files set to /projects/compbio/experiments/undertaker/spots/ # command:# ReadAtomType exp-pdb.types Read AtomType exp-pdb with 49 types. # command:# ReadClashTable exp-pdb-2191-2symm.clash # Read ClashTable exp-pdb-2191-2symm checking bonds symmetric at MaxSep 2 # command:# command:CPU_time= 9.461 sec, elapsed time= 9.590 sec. # command:# Reading spots from monomeric-50pc-dry-5.spot Read prototypes from /projects/compbio/experiments/undertaker/spots/../normalize_prototypes/prototypes # reading histogram from smoothed-monomeric-50pc-dry-5.hist # created burial cost function dry5 with radius 5.000 with spots at monomeric-50pc-dry-5.spot # command:# Reading spots from monomeric-50pc-wet-6.5.spot Read prototypes from /projects/compbio/experiments/undertaker/spots/../normalize_prototypes/prototypes # reading histogram from smoothed-monomeric-50pc-wet-6.5.hist # created burial cost function wet6.5 with radius 6.500 with spots at monomeric-50pc-wet-6.5.spot # command:# Reading spots from monomeric-50pc-dry-6.5.spot Read prototypes from /projects/compbio/experiments/undertaker/spots/../normalize_prototypes/prototypes # reading histogram from smoothed-monomeric-50pc-dry-6.5.hist # created burial cost function dry6.5 with radius 6.500 with spots at monomeric-50pc-dry-6.5.spot # command:# Reading spots from monomeric-50pc-generic-6.5.spot Read prototypes from /projects/compbio/experiments/undertaker/spots/../normalize_prototypes/prototypes # reading histogram from smoothed-monomeric-50pc-generic-6.5.hist # created burial cost function gen6.5 with radius 6.500 with spots at monomeric-50pc-generic-6.5.spot # command:# Reading spots from near-backbone-center.spot # reading histogram from smoothed-near-backbone-2spot.hist # Reading spots from near-backbone-count.spot # created burial cost function near_backbone with radius 9.650 with spots at near-backbone-center.spot counting only near-backbone-count.spot # command:# Reading spots from way-back-center.spot # reading histogram from smoothed-way-back-2spot.hist # Reading spots from way-back-count.spot # created burial cost function way_back with radius 8.900 with spots at way-back-center.spot counting only way-back-count.spot # command:# Reading spots from monomeric-50pc-dry-8.spot Read prototypes from /projects/compbio/experiments/undertaker/spots/../normalize_prototypes/prototypes # reading histogram from smoothed-monomeric-50pc-dry-8.hist # created burial cost function dry8 with radius 8.000 with spots at monomeric-50pc-dry-8.spot # command:# Reading spots from monomeric-50pc-dry-10.spot Read prototypes from /projects/compbio/experiments/undertaker/spots/../normalize_prototypes/prototypes # reading histogram from smoothed-monomeric-50pc-dry-10.hist # created burial cost function dry10 with radius 10.000 with spots at monomeric-50pc-dry-10.spot # command:# Reading spots from monomeric-50pc-dry-12.spot Read prototypes from /projects/compbio/experiments/undertaker/spots/../normalize_prototypes/prototypes # reading histogram from smoothed-monomeric-50pc-dry-12.hist # created burial cost function dry12 with radius 12.000 with spots at monomeric-50pc-dry-12.spot # command:# reading histogram from dunbrack-2191-alpha.hist # created alpha cost function alpha with offset 0 and 360 bins # command:# reading histogram from dunbrack-2191-alpha-1.hist # created alpha cost function alpha_prev with offset -1 and 360 bins # command:# Prefix for input files set to /projects/compbio/lib/alphabet/ # command:# Read 3 alphabets from alpha.alphabet # command:CPU_time= 9.575 sec, elapsed time= 9.725 sec. # command:# Prefix for input files set to # command:# Making conformation for sequence T0378 numbered 1 through 254 Created new target T0378 from T0378.a2m # command:# command:# No conformations to remove in PopConform # command:# cleared Id set # command:# command:2i6dA expands to /projects/compbio/data/pdb/2i6d.pdb.gz 2i6dA:Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Skipped atom 297, because occupancy 0.5 <= existing 0.500 in 2i6dA Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Skipped atom 299, because occupancy 0.500 <= existing 0.500 in 2i6dA Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Skipped atom 301, because occupancy 0.500 <= existing 0.500 in 2i6dA Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Skipped atom 303, because occupancy 0.500 <= existing 0.500 in 2i6dA Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Skipped atom 305, because occupancy 0.500 <= existing 0.500 in 2i6dA Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Skipped atom 307, because occupancy 0.500 <= existing 0.500 in 2i6dA Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Skipped atom 309, because occupancy 0.500 <= existing 0.500 in 2i6dA Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Skipped atom 311, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 369, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 373, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 375, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 377, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 379, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 381, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 383, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 385, because occupancy 0.500 <= existing 0.500 in 2i6dA Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Skipped atom 491, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 495, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 497, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 499, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 501, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 503, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 505, because occupancy 0.500 <= existing 0.500 in 2i6dA Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Skipped atom 848, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 850, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 852, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 854, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 856, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 858, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 860, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 862, because occupancy 0.500 <= existing 0.500 in 2i6dA Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Skipped atom 1187, because occupancy 0.500 <= existing 0.500 in 2i6dA Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Skipped atom 1189, because occupancy 0.500 <= existing 0.500 in 2i6dA Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Skipped atom 1191, because occupancy 0.500 <= existing 0.500 in 2i6dA Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Skipped atom 1193, because occupancy 0.500 <= existing 0.500 in 2i6dA Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Skipped atom 1195, because occupancy 0.500 <= existing 0.500 in 2i6dA Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Skipped atom 1197, because occupancy 0.500 <= existing 0.500 in 2i6dA Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Skipped atom 1199, because occupancy 0.500 <= existing 0.500 in 2i6dA Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Skipped atom 1201, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1375, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1379, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1381, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1383, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1385, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1387, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1389, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1391, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1469, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1473, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1475, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1477, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1479, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1500, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1502, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1504, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1506, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1508, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1510, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1512, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1514, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1666, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1670, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1672, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1674, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1676, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1678, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1680, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1682, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1710, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1714, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1716, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1718, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1720, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1722, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1940, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1942, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1944, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1946, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1948, because occupancy 0.500 <= existing 0.500 in 2i6dA Skipped atom 1950, because occupancy 0.500 <= existing 0.500 in 2i6dA Read 251 residues and 1933 atoms. # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # command:# Saving current conformation as real # command:# Prefix for output files set to decoys/ # command:# SetRealCost created real_cost = # ( 50.000 * real_hbond + 50.000 * real_hbond_u + 50.000 * decoy_hbond + 50.000 * decoy_hbond_u + 10.000 * real_NO_hbond + 10.000 * real_NO_hbond_u + 10.000 * decoy_NO_hbond + 10.000 * decoy_NO_hbond_u + 10.000 * knot + 200.000 * clens + 0.000 * rmsd + 35.000 * log_rmsd + 0.000 * rmsd_ca + 30.000 * log_rmsd_ca + 1.000 * GDT + 1.000 * smooth_GDT + 0.200 * missing_atoms ) # command:# SetCost created cost = # ) # command:# reading script from file anglevector.costfcn # Prefix for input files set to /projects/compbio/lib/alphabet/ # Read 2 alphabets from anglevector.alphabet # Prefix for input files set to # CreateCombinedNNet created CombinedNNet bys_t2k # CreateCombinedNNet created CombinedNNet bys_t04 # CreateCombinedNNet created CombinedNNet bys_t06 # CreateCombinedNNet created CombinedNNet bys_mean # created predicted AngleVectorPredCostFcn pred_bys_t2k # created predicted AngleVectorPredCostFcn pred_bys_t04 # created predicted AngleVectorPredCostFcn pred_bys_t06 # created predicted AngleVectorPredCostFcn pred_bys_mean # CreateCombinedNNet created CombinedNNet pb_t2k # CreateCombinedNNet created CombinedNNet pb_t04 # CreateCombinedNNet created CombinedNNet pb_t06 # CreateCombinedNNet created CombinedNNet pb_mean # created predicted AngleVectorPredCostFcn pred_pb_t2k # created predicted AngleVectorPredCostFcn pred_pb_t04 # created predicted AngleVectorPredCostFcn pred_pb_t06 # created predicted AngleVectorPredCostFcn pred_pb_mean # SetCost created cost = # ( 5.000 * bystroff + 5.000 * pred_bys_t2k + 5.000 * pred_bys_t04 + 5.000 * pred_bys_t06 + 5.000 * pred_bys_mean + 5.000 * pred_pb_t2k + 5.000 * pred_pb_t04 + 5.000 * pred_pb_t06 + 5.000 * pred_pb_mean ) # command:CPU_time= 13.810 sec, elapsed time= 14.138 sec. # command:# Prefix for input files set to # command:# ReadConformPDB reading from PDB file model1.ts-submitted looking for model 1 # choosing archetypes in rotamer library # Found a chain break before 237 # copying to AlignedFragments data structure # command:Warning: Couldn't open file decoys/model1.gdt for output # fraction of real conformation used = 1.000 # GDT_score = -45.800 # GDT_score(maxd=8.000,maxw=2.900)= -47.015 # GDT_score(maxd=8.000,maxw=3.200)= -45.342 # GDT_score(maxd=8.000,maxw=3.500)= -43.628 # GDT_score(maxd=10.000,maxw=3.800)= -45.960 # GDT_score(maxd=10.000,maxw=4.000)= -44.778 # GDT_score(maxd=10.000,maxw=4.200)= -43.595 # GDT_score(maxd=12.000,maxw=4.300)= -46.920 # GDT_score(maxd=12.000,maxw=4.500)= -45.698 # GDT_score(maxd=12.000,maxw=4.700)= -44.419 # GDT_score(maxd=14.000,maxw=5.200)= -44.646 # GDT_score(maxd=14.000,maxw=5.500)= -42.798 # command:# Prefix for output files set to # command:Warning: Couldn't open file T0378.model1-real.pdb for output Error: Couldn't open file T0378.model1-real.pdb for output superimposing iter= 0 total_weight= 2927.000 rmsd (weighted)= 10.214 (unweighted)= 12.915 superimposing iter= 1 total_weight= 5652.914 rmsd (weighted)= 5.757 (unweighted)= 13.004 superimposing iter= 2 total_weight= 2619.894 rmsd (weighted)= 4.886 (unweighted)= 13.053 superimposing iter= 3 total_weight= 2117.998 rmsd (weighted)= 4.627 (unweighted)= 13.078 superimposing iter= 4 total_weight= 2011.171 rmsd (weighted)= 4.498 (unweighted)= 13.095 superimposing iter= 5 total_weight= 1991.810 rmsd (weighted)= 4.393 (unweighted)= 13.112 EXPDTA model1.ts-submitted MODEL 1 REMARK 44 REMARK 44 model 1 is called model1.ts-submitted ATOM 1 N MET A 1 34.476 23.449 50.985 1.00 0.00 ATOM 2 CA MET A 1 35.650 24.295 51.130 1.00 0.00 ATOM 3 CB MET A 1 36.738 23.448 50.157 1.00 0.00 ATOM 4 CG MET A 1 38.206 23.446 50.403 1.00 0.00 ATOM 5 SD MET A 1 39.190 22.491 49.274 1.00 0.00 ATOM 6 CE MET A 1 39.814 23.759 48.204 1.00 0.00 ATOM 7 O MET A 1 35.795 26.599 50.586 1.00 0.00 ATOM 8 C MET A 1 35.583 25.475 50.158 1.00 0.00 ATOM 9 N LEU A 2 35.176 25.247 48.907 1.00 0.00 ATOM 10 CA LEU A 2 35.047 26.344 47.908 1.00 0.00 ATOM 11 CB LEU A 2 34.966 25.750 46.494 1.00 0.00 ATOM 12 CG LEU A 2 36.092 24.849 45.983 1.00 0.00 ATOM 13 CD1 LEU A 2 35.744 24.298 44.572 1.00 0.00 ATOM 14 CD2 LEU A 2 37.406 25.598 45.971 1.00 0.00 ATOM 15 O LEU A 2 32.834 26.809 48.684 1.00 0.00 ATOM 16 C LEU A 2 33.906 27.277 48.266 1.00 0.00 ATOM 17 N SER A 3 34.079 28.610 48.095 1.00 0.00 ATOM 18 CA SER A 3 33.050 29.580 48.463 1.00 0.00 ATOM 19 CB SER A 3 33.428 30.968 47.983 1.00 0.00 ATOM 20 OG SER A 3 34.611 31.425 48.578 1.00 0.00 ATOM 21 O SER A 3 30.754 28.986 48.862 1.00 0.00 ATOM 22 C SER A 3 31.652 29.135 48.029 1.00 0.00 ATOM 23 N ALA A 4 31.426 28.877 46.700 1.00 0.00 ATOM 24 CA ALA A 4 30.117 28.465 46.211 1.00 0.00 ATOM 25 CB ALA A 4 30.096 28.370 44.685 1.00 0.00 ATOM 26 O ALA A 4 28.613 26.906 47.242 1.00 0.00 ATOM 27 C ALA A 4 29.732 27.106 46.791 1.00 0.00 ATOM 28 N ASN A 5 30.702 26.197 46.849 1.00 0.00 ATOM 29 CA ASN A 5 30.470 24.866 47.430 1.00 0.00 ATOM 30 CB ASN A 5 31.705 23.981 47.298 1.00 0.00 ATOM 31 CG ASN A 5 31.921 23.542 45.848 1.00 0.00 ATOM 32 ND2 ASN A 5 33.100 23.077 45.613 1.00 0.00 ATOM 33 OD1 ASN A 5 31.109 23.631 44.942 1.00 0.00 ATOM 34 O ASN A 5 29.094 24.340 49.355 1.00 0.00 ATOM 35 C ASN A 5 30.096 24.935 48.902 1.00 0.00 ATOM 36 N GLN A 6 30.852 25.716 49.692 1.00 0.00 ATOM 37 CA GLN A 6 30.571 25.883 51.099 1.00 0.00 ATOM 38 CB GLN A 6 31.711 26.705 51.705 1.00 0.00 ATOM 39 CG GLN A 6 31.632 26.854 53.216 1.00 0.00 ATOM 40 CD GLN A 6 31.754 25.526 53.936 1.00 0.00 ATOM 41 OE1 GLN A 6 32.619 24.706 53.620 1.00 0.00 ATOM 42 NE2 GLN A 6 30.878 25.302 54.911 1.00 0.00 ATOM 43 O GLN A 6 28.426 26.095 52.220 1.00 0.00 ATOM 44 C GLN A 6 29.195 26.533 51.337 1.00 0.00 ATOM 45 N ILE A 7 28.886 27.579 50.554 1.00 0.00 ATOM 46 CA ILE A 7 27.622 28.296 50.707 1.00 0.00 ATOM 47 CB ILE A 7 27.553 29.516 49.770 1.00 0.00 ATOM 48 CG1 ILE A 7 28.547 30.592 50.220 1.00 0.00 ATOM 49 CG2 ILE A 7 26.142 30.076 49.726 1.00 0.00 ATOM 50 CD1 ILE A 7 28.742 31.702 49.214 1.00 0.00 ATOM 51 O ILE A 7 25.423 27.343 51.069 1.00 0.00 ATOM 52 C ILE A 7 26.451 27.345 50.393 1.00 0.00 ATOM 53 N LYS A 8 26.573 26.664 49.270 1.00 0.00 ATOM 54 CA LYS A 8 25.501 25.796 48.774 1.00 0.00 ATOM 55 CB LYS A 8 25.879 25.199 47.418 1.00 0.00 ATOM 56 CG LYS A 8 25.715 26.153 46.245 1.00 0.00 ATOM 57 CD LYS A 8 26.116 25.493 44.934 1.00 0.00 ATOM 58 CE LYS A 8 25.956 26.446 43.761 1.00 0.00 ATOM 59 NZ LYS A 8 26.373 25.823 42.474 1.00 0.00 ATOM 60 O LYS A 8 24.022 24.280 49.913 1.00 0.00 ATOM 61 C LYS A 8 25.178 24.671 49.769 1.00 0.00 ATOM 62 N PHE A 9 26.197 24.262 50.526 1.00 0.00 ATOM 63 CA PHE A 9 26.013 23.266 51.598 1.00 0.00 ATOM 64 CB PHE A 9 27.342 22.770 52.207 1.00 0.00 ATOM 65 CG PHE A 9 27.058 21.597 53.150 1.00 0.00 ATOM 66 CD1 PHE A 9 26.866 20.307 52.714 1.00 0.00 ATOM 67 CD2 PHE A 9 26.983 21.841 54.521 1.00 0.00 ATOM 68 CE1 PHE A 9 26.567 19.302 53.626 1.00 0.00 ATOM 69 CE2 PHE A 9 26.652 20.859 55.418 1.00 0.00 ATOM 70 CZ PHE A 9 26.442 19.566 54.973 1.00 0.00 ATOM 71 O PHE A 9 24.195 23.029 53.182 1.00 0.00 ATOM 72 C PHE A 9 25.051 23.759 52.694 1.00 0.00 ATOM 73 N LEU A 10 25.132 25.043 53.018 1.00 0.00 ATOM 74 CA LEU A 10 24.236 25.638 54.022 1.00 0.00 ATOM 75 CB LEU A 10 24.659 27.082 54.320 1.00 0.00 ATOM 76 CG LEU A 10 25.972 27.231 55.097 1.00 0.00 ATOM 77 CD1 LEU A 10 26.376 28.697 55.167 1.00 0.00 ATOM 78 CD2 LEU A 10 25.807 26.650 56.494 1.00 0.00 ATOM 79 O LEU A 10 21.887 25.262 54.341 1.00 0.00 ATOM 80 C LEU A 10 22.779 25.598 53.560 1.00 0.00 ATOM 81 N ARG A 11 22.541 25.975 52.300 1.00 0.00 ATOM 82 CA ARG A 11 21.198 25.988 51.721 1.00 0.00 ATOM 83 CB ARG A 11 21.289 26.614 50.333 1.00 0.00 ATOM 84 CG ARG A 11 19.977 26.627 49.545 1.00 0.00 ATOM 85 CD ARG A 11 20.228 27.151 48.151 1.00 0.00 ATOM 86 NE ARG A 11 19.075 27.196 47.291 1.00 0.00 ATOM 87 CZ ARG A 11 18.531 26.127 46.698 1.00 0.00 ATOM 88 NH1 ARG A 11 19.012 24.889 46.878 1.00 0.00 ATOM 89 NH2 ARG A 11 17.488 26.308 45.906 1.00 0.00 ATOM 90 O ARG A 11 19.444 24.381 52.043 1.00 0.00 ATOM 91 C ARG A 11 20.613 24.579 51.714 1.00 0.00 ATOM 92 N SER A 12 21.436 23.592 51.333 1.00 0.00 ATOM 93 CA SER A 12 20.983 22.206 51.296 1.00 0.00 ATOM 94 CB SER A 12 21.946 21.240 50.648 1.00 0.00 ATOM 95 OG SER A 12 23.154 21.138 51.346 1.00 0.00 ATOM 96 O SER A 12 19.572 21.085 52.917 1.00 0.00 ATOM 97 C SER A 12 20.596 21.769 52.712 1.00 0.00 ATOM 98 N LEU A 13 21.392 22.221 53.702 1.00 0.00 ATOM 99 CA LEU A 13 21.114 21.914 55.107 1.00 0.00 ATOM 100 CB LEU A 13 22.261 22.436 55.981 1.00 0.00 ATOM 101 CG LEU A 13 22.078 22.230 57.490 1.00 0.00 ATOM 102 CD1 LEU A 13 21.984 20.744 57.807 1.00 0.00 ATOM 103 CD2 LEU A 13 23.238 22.868 58.237 1.00 0.00 ATOM 104 O LEU A 13 18.935 21.926 56.114 1.00 0.00 ATOM 105 C LEU A 13 19.804 22.575 55.535 1.00 0.00 ATOM 106 N ARG A 14 19.648 23.868 55.243 1.00 0.00 ATOM 107 CA ARG A 14 18.429 24.577 55.620 1.00 0.00 ATOM 108 CB ARG A 14 18.465 26.071 55.396 1.00 0.00 ATOM 109 CG ARG A 14 19.212 26.765 56.551 1.00 0.00 ATOM 110 CD ARG A 14 19.200 28.292 56.449 1.00 0.00 ATOM 111 NE ARG A 14 19.942 28.715 55.263 1.00 0.00 ATOM 112 CZ ARG A 14 19.422 28.899 54.052 1.00 0.00 ATOM 113 NH1 ARG A 14 18.112 28.743 53.894 1.00 0.00 ATOM 114 NH2 ARG A 14 20.216 29.227 53.052 1.00 0.00 ATOM 115 O ARG A 14 16.165 23.784 55.697 1.00 0.00 ATOM 116 C ARG A 14 17.184 23.960 54.995 1.00 0.00 ATOM 117 N GLU A 15 17.262 23.657 53.693 1.00 0.00 ATOM 118 CA GLU A 15 16.137 23.070 52.976 1.00 0.00 ATOM 119 CB GLU A 15 16.475 22.958 51.490 1.00 0.00 ATOM 120 CG GLU A 15 16.419 24.277 50.730 1.00 0.00 ATOM 121 CD GLU A 15 15.054 24.902 50.821 1.00 0.00 ATOM 122 OE1 GLU A 15 14.094 24.236 50.516 1.00 0.00 ATOM 123 OE2 GLU A 15 14.959 26.007 51.302 1.00 0.00 ATOM 124 O GLU A 15 14.511 21.364 53.527 1.00 0.00 ATOM 125 C GLU A 15 15.701 21.690 53.498 1.00 0.00 ATOM 126 N ARG A 16 16.651 20.964 54.094 1.00 0.00 ATOM 127 CA ARG A 16 16.355 19.666 54.744 1.00 0.00 ATOM 128 CB ARG A 16 17.620 18.897 55.097 1.00 0.00 ATOM 129 CG ARG A 16 17.396 17.644 55.929 1.00 0.00 ATOM 130 CD ARG A 16 18.642 16.922 56.294 1.00 0.00 ATOM 131 NE ARG A 16 19.378 16.384 55.162 1.00 0.00 ATOM 132 CZ ARG A 16 20.683 16.046 55.189 1.00 0.00 ATOM 133 NH1 ARG A 16 21.404 16.217 56.276 1.00 0.00 ATOM 134 NH2 ARG A 16 21.225 15.554 54.089 1.00 0.00 ATOM 135 O ARG A 16 14.559 19.002 56.200 1.00 0.00 ATOM 136 C ARG A 16 15.473 19.800 55.985 1.00 0.00 ATOM 137 N LYS A 17 15.760 20.818 56.801 1.00 0.00 ATOM 138 CA LYS A 17 14.982 21.058 58.027 1.00 0.00 ATOM 139 CB LYS A 17 15.607 22.191 58.844 1.00 0.00 ATOM 140 CG LYS A 17 16.930 21.834 59.504 1.00 0.00 ATOM 141 CD LYS A 17 17.486 23.007 60.298 1.00 0.00 ATOM 142 CE LYS A 17 18.822 22.658 60.941 1.00 0.00 ATOM 143 NZ LYS A 17 19.391 23.809 61.696 1.00 0.00 ATOM 144 O LYS A 17 12.641 20.966 58.520 1.00 0.00 ATOM 145 C LYS A 17 13.520 21.374 57.760 1.00 0.00 ATOM 146 N TYR A 18 13.235 22.150 56.663 1.00 0.00 ATOM 147 CA TYR A 18 11.870 22.524 56.323 1.00 0.00 ATOM 148 CB TYR A 18 11.880 23.468 55.119 1.00 0.00 ATOM 149 CG TYR A 18 10.500 23.854 54.630 1.00 0.00 ATOM 150 CD1 TYR A 18 9.757 24.824 55.287 1.00 0.00 ATOM 151 CD2 TYR A 18 9.947 23.247 53.512 1.00 0.00 ATOM 152 CE1 TYR A 18 8.497 25.178 54.845 1.00 0.00 ATOM 153 CE2 TYR A 18 8.690 23.594 53.061 1.00 0.00 ATOM 154 CZ TYR A 18 7.966 24.559 53.731 1.00 0.00 ATOM 155 OH TYR A 18 6.713 24.913 53.283 1.00 0.00 ATOM 156 O TYR A 18 10.003 21.037 56.583 1.00 0.00 ATOM 157 C TYR A 18 11.106 21.243 56.036 1.00 0.00 ATOM 158 N ARG A 19 11.678 20.355 55.205 1.00 0.00 ATOM 159 CA ARG A 19 10.985 19.095 54.897 1.00 0.00 ATOM 160 CB ARG A 19 11.752 18.329 53.829 1.00 0.00 ATOM 161 CG ARG A 19 11.959 19.084 52.525 1.00 0.00 ATOM 162 CD ARG A 19 10.713 19.345 51.763 1.00 0.00 ATOM 163 NE ARG A 19 10.921 19.963 50.463 1.00 0.00 ATOM 164 CZ ARG A 19 9.935 20.419 49.667 1.00 0.00 ATOM 165 NH1 ARG A 19 8.673 20.298 50.014 1.00 0.00 ATOM 166 NH2 ARG A 19 10.268 20.975 48.514 1.00 0.00 ATOM 167 O ARG A 19 9.810 17.571 56.329 1.00 0.00 ATOM 168 C ARG A 19 10.858 18.187 56.130 1.00 0.00 ATOM 169 N LEU A 20 11.842 18.223 57.016 1.00 0.00 ATOM 170 CA LEU A 20 11.769 17.389 58.221 1.00 0.00 ATOM 171 CB LEU A 20 13.099 17.413 58.950 1.00 0.00 ATOM 172 CG LEU A 20 13.194 16.533 60.201 1.00 0.00 ATOM 173 CD1 LEU A 20 12.835 15.089 59.892 1.00 0.00 ATOM 174 CD2 LEU A 20 14.599 16.631 60.792 1.00 0.00 ATOM 175 O LEU A 20 9.885 16.974 59.628 1.00 0.00 ATOM 176 C LEU A 20 10.676 17.808 59.203 1.00 0.00 ATOM 177 N ARG A 21 10.617 19.105 59.483 1.00 0.00 ATOM 178 CA ARG A 21 9.629 19.611 60.453 1.00 0.00 ATOM 179 CB ARG A 21 9.887 21.060 60.834 1.00 0.00 ATOM 180 CG ARG A 21 11.113 21.285 61.703 1.00 0.00 ATOM 181 CD ARG A 21 11.397 22.711 62.006 1.00 0.00 ATOM 182 NE ARG A 21 12.579 22.931 62.824 1.00 0.00 ATOM 183 CZ ARG A 21 13.072 24.143 63.146 1.00 0.00 ATOM 184 NH1 ARG A 21 12.516 25.244 62.692 1.00 0.00 ATOM 185 NH2 ARG A 21 14.148 24.194 63.912 1.00 0.00 ATOM 186 O ARG A 21 7.386 18.859 60.740 1.00 0.00 ATOM 187 C ARG A 21 8.181 19.410 59.991 1.00 0.00 ATOM 188 N GLU A 22 7.977 19.649 58.699 1.00 0.00 ATOM 189 CA GLU A 22 6.673 19.428 58.041 1.00 0.00 ATOM 190 CB GLU A 22 6.631 20.141 56.687 1.00 0.00 ATOM 191 CG GLU A 22 6.685 21.661 56.775 1.00 0.00 ATOM 192 CD GLU A 22 5.516 22.203 57.549 1.00 0.00 ATOM 193 OE1 GLU A 22 4.402 21.920 57.184 1.00 0.00 ATOM 194 OE2 GLU A 22 5.739 22.809 58.571 1.00 0.00 ATOM 195 O GLU A 22 5.201 17.587 57.572 1.00 0.00 ATOM 196 C GLU A 22 6.336 17.938 57.862 1.00 0.00 ATOM 197 N GLN A 23 7.379 17.102 57.900 1.00 0.00 ATOM 198 CA GLN A 23 7.281 15.647 57.726 1.00 0.00 ATOM 199 CB GLN A 23 6.543 15.057 59.116 1.00 0.00 ATOM 200 CG GLN A 23 6.515 16.027 60.296 1.00 0.00 ATOM 201 CD GLN A 23 5.083 16.264 60.741 1.00 0.00 ATOM 202 OE1 GLN A 23 4.564 17.378 60.672 1.00 0.00 ATOM 203 NE2 GLN A 23 4.442 15.188 61.193 1.00 0.00 ATOM 204 O GLN A 23 6.115 14.275 56.111 1.00 0.00 ATOM 205 C GLN A 23 6.761 15.287 56.331 1.00 0.00 ATOM 206 N ALA A 24 7.287 15.986 55.328 1.00 0.00 ATOM 207 CA ALA A 24 6.851 15.792 53.944 1.00 0.00 ATOM 208 CB ALA A 24 5.558 16.545 53.668 1.00 0.00 ATOM 209 O ALA A 24 8.593 17.243 53.168 1.00 0.00 ATOM 210 C ALA A 24 7.816 16.333 52.898 1.00 0.00 ATOM 211 N PHE A 25 7.721 15.746 51.755 1.00 0.00 ATOM 212 CA PHE A 25 8.566 16.141 50.625 1.00 0.00 ATOM 213 CB PHE A 25 9.787 15.229 50.499 1.00 0.00 ATOM 214 CG PHE A 25 9.479 13.754 50.411 1.00 0.00 ATOM 215 CD1 PHE A 25 9.432 13.115 49.181 1.00 0.00 ATOM 216 CD2 PHE A 25 9.247 13.007 51.563 1.00 0.00 ATOM 217 CE1 PHE A 25 9.153 11.745 49.089 1.00 0.00 ATOM 218 CE2 PHE A 25 8.949 11.629 51.477 1.00 0.00 ATOM 219 CZ PHE A 25 8.902 11.003 50.240 1.00 0.00 ATOM 220 O PHE A 25 6.703 15.450 49.292 1.00 0.00 ATOM 221 C PHE A 25 7.768 16.065 49.334 1.00 0.00 ATOM 222 N ALA A 26 8.266 16.656 48.284 1.00 0.00 ATOM 223 CA ALA A 26 7.638 16.653 46.971 1.00 0.00 ATOM 224 CB ALA A 26 7.622 18.088 46.398 1.00 0.00 ATOM 225 O ALA A 26 9.412 15.577 45.781 1.00 0.00 ATOM 226 C ALA A 26 8.200 15.664 45.971 1.00 0.00 ATOM 227 N VAL A 27 7.303 14.924 45.320 1.00 0.00 ATOM 228 CA VAL A 27 7.692 13.953 44.312 1.00 0.00 ATOM 229 CB VAL A 27 7.602 12.453 44.830 1.00 0.00 ATOM 230 CG1 VAL A 27 7.985 11.451 43.719 1.00 0.00 ATOM 231 CG2 VAL A 27 8.530 12.210 46.011 1.00 0.00 ATOM 232 O VAL A 27 5.771 14.316 42.991 1.00 0.00 ATOM 233 C VAL A 27 6.970 14.202 42.973 1.00 0.00 ATOM 234 N GLU A 28 7.754 14.404 41.999 1.00 0.00 ATOM 235 CA GLU A 28 7.205 14.873 40.731 1.00 0.00 ATOM 236 CB GLU A 28 8.041 16.061 40.248 1.00 0.00 ATOM 237 CG GLU A 28 9.542 15.815 40.251 1.00 0.00 ATOM 238 CD GLU A 28 10.296 17.032 39.789 1.00 0.00 ATOM 239 OE1 GLU A 28 9.675 18.048 39.581 1.00 0.00 ATOM 240 OE2 GLU A 28 11.504 16.981 39.754 1.00 0.00 ATOM 241 O GLU A 28 8.154 12.930 39.716 1.00 0.00 ATOM 242 C GLU A 28 7.228 13.731 39.746 1.00 0.00 ATOM 243 N GLY A 29 6.094 13.658 39.086 1.00 0.00 ATOM 244 CA GLY A 29 5.913 12.675 38.035 1.00 0.00 ATOM 245 O GLY A 29 4.985 11.045 39.366 1.00 0.00 ATOM 246 C GLY A 29 4.952 11.585 38.267 1.00 0.00 ATOM 247 N PRO A 30 4.323 11.162 37.168 1.00 0.00 ATOM 248 CA PRO A 30 3.370 10.059 37.281 1.00 0.00 ATOM 249 CB PRO A 30 2.787 9.906 35.917 1.00 0.00 ATOM 250 CG PRO A 30 2.699 11.328 35.459 1.00 0.00 ATOM 251 CD PRO A 30 4.053 11.870 35.855 1.00 0.00 ATOM 252 O PRO A 30 3.523 7.957 38.451 1.00 0.00 ATOM 253 C PRO A 30 4.039 8.721 37.640 1.00 0.00 ATOM 254 N LYS A 31 5.296 8.536 37.222 1.00 0.00 ATOM 255 CA LYS A 31 6.047 7.306 37.515 1.00 0.00 ATOM 256 CB LYS A 31 7.267 7.180 36.601 1.00 0.00 ATOM 257 CG LYS A 31 6.931 6.943 35.133 1.00 0.00 ATOM 258 CD LYS A 31 8.192 6.834 34.288 1.00 0.00 ATOM 259 CE LYS A 31 7.856 6.640 32.816 1.00 0.00 ATOM 260 NZ LYS A 31 9.081 6.555 31.975 1.00 0.00 ATOM 261 O LYS A 31 6.195 6.218 39.648 1.00 0.00 ATOM 262 C LYS A 31 6.464 7.217 38.976 1.00 0.00 ATOM 263 N LEU A 32 7.108 8.261 39.474 1.00 0.00 ATOM 264 CA LEU A 32 7.572 8.272 40.861 1.00 0.00 ATOM 265 CB LEU A 32 8.456 9.481 41.196 1.00 0.00 ATOM 266 CG LEU A 32 9.367 10.125 40.148 1.00 0.00 ATOM 267 CD1 LEU A 32 10.165 11.231 40.802 1.00 0.00 ATOM 268 CD2 LEU A 32 10.481 9.303 39.556 1.00 0.00 ATOM 269 O LEU A 32 6.311 7.360 42.711 1.00 0.00 ATOM 270 C LEU A 32 6.348 8.184 41.787 1.00 0.00 ATOM 271 N VAL A 33 5.352 9.057 41.610 1.00 0.00 ATOM 272 CA VAL A 33 4.137 9.006 42.433 1.00 0.00 ATOM 273 CB VAL A 33 3.084 10.009 41.920 1.00 0.00 ATOM 274 CG1 VAL A 33 1.781 9.851 42.689 1.00 0.00 ATOM 275 CG2 VAL A 33 3.603 11.433 42.037 1.00 0.00 ATOM 276 O VAL A 33 3.040 7.025 43.349 1.00 0.00 ATOM 277 C VAL A 33 3.509 7.605 42.344 1.00 0.00 ATOM 278 N GLY A 34 3.489 7.047 41.123 1.00 0.00 ATOM 279 CA GLY A 34 2.892 5.724 40.925 1.00 0.00 ATOM 280 O GLY A 34 3.408 3.400 41.312 1.00 0.00 ATOM 281 C GLY A 34 3.738 4.581 41.488 1.00 0.00 ATOM 282 N GLU A 35 4.919 4.887 42.005 1.00 0.00 ATOM 283 CA GLU A 35 5.771 3.869 42.615 1.00 0.00 ATOM 284 CB GLU A 35 7.239 3.951 42.173 1.00 0.00 ATOM 285 CG GLU A 35 7.525 3.483 40.753 1.00 0.00 ATOM 286 CD GLU A 35 7.285 2.001 40.568 1.00 0.00 ATOM 287 OE1 GLU A 35 7.673 1.218 41.464 1.00 0.00 ATOM 288 OE2 GLU A 35 6.723 1.611 39.523 1.00 0.00 ATOM 289 O GLU A 35 5.683 3.159 44.940 1.00 0.00 ATOM 290 C GLU A 35 5.746 4.081 44.124 1.00 0.00 ATOM 291 N MET A 36 5.538 5.320 44.527 1.00 0.00 ATOM 292 CA MET A 36 5.352 5.633 45.953 1.00 0.00 ATOM 293 CB MET A 36 5.290 7.146 46.156 1.00 0.00 ATOM 294 CG MET A 36 6.504 7.901 45.634 1.00 0.00 ATOM 295 SD MET A 36 7.900 7.854 46.775 1.00 0.00 ATOM 296 CE MET A 36 9.194 8.547 45.755 1.00 0.00 ATOM 297 O MET A 36 4.092 4.302 47.520 1.00 0.00 ATOM 298 C MET A 36 4.086 4.946 46.468 1.00 0.00 ATOM 299 N LEU A 37 2.989 5.044 45.681 1.00 0.00 ATOM 300 CA LEU A 37 1.716 4.443 46.062 1.00 0.00 ATOM 301 CB LEU A 37 0.641 4.924 45.071 1.00 0.00 ATOM 302 CG LEU A 37 -0.740 4.308 45.340 1.00 0.00 ATOM 303 CD1 LEU A 37 -1.344 4.733 46.673 1.00 0.00 ATOM 304 CD2 LEU A 37 -1.671 4.491 44.145 1.00 0.00 ATOM 305 O LEU A 37 1.554 2.279 47.148 1.00 0.00 ATOM 306 C LEU A 37 1.844 2.900 46.112 1.00 0.00 ATOM 307 N PRO A 38 2.375 2.257 45.065 1.00 0.00 ATOM 308 CA PRO A 38 2.523 0.783 45.142 1.00 0.00 ATOM 309 CB PRO A 38 2.822 0.504 43.606 1.00 0.00 ATOM 310 CG PRO A 38 2.049 1.576 42.904 1.00 0.00 ATOM 311 CD PRO A 38 2.354 2.803 43.743 1.00 0.00 ATOM 312 O PRO A 38 3.268 -0.749 46.714 1.00 0.00 ATOM 313 C PRO A 38 3.467 0.346 46.242 1.00 0.00 ATOM 314 N PHE A 39 4.426 1.169 46.681 1.00 0.00 ATOM 315 CA PHE A 39 5.307 0.721 47.776 1.00 0.00 ATOM 316 CB PHE A 39 6.746 1.184 47.539 1.00 0.00 ATOM 317 CG PHE A 39 7.393 0.566 46.331 1.00 0.00 ATOM 318 CD1 PHE A 39 6.879 -0.594 45.772 1.00 0.00 ATOM 319 CD2 PHE A 39 8.510 1.146 45.753 1.00 0.00 ATOM 320 CE1 PHE A 39 7.472 -1.162 44.660 1.00 0.00 ATOM 321 CE2 PHE A 39 9.105 0.579 44.642 1.00 0.00 ATOM 322 CZ PHE A 39 8.585 -0.577 44.095 1.00 0.00 ATOM 323 O PHE A 39 5.627 1.116 50.113 1.00 0.00 ATOM 324 C PHE A 39 4.852 1.179 49.158 1.00 0.00 ATOM 325 N TYR A 40 3.663 1.791 49.199 1.00 0.00 ATOM 326 CA TYR A 40 2.955 2.144 50.449 1.00 0.00 ATOM 327 CB TYR A 40 3.083 1.019 51.483 1.00 0.00 ATOM 328 CG TYR A 40 2.557 -0.314 51.004 1.00 0.00 ATOM 329 CD1 TYR A 40 3.425 -1.352 50.699 1.00 0.00 ATOM 330 CD2 TYR A 40 1.196 -0.533 50.864 1.00 0.00 ATOM 331 CE1 TYR A 40 2.950 -2.574 50.262 1.00 0.00 ATOM 332 CE2 TYR A 40 0.709 -1.750 50.429 1.00 0.00 ATOM 333 CZ TYR A 40 1.592 -2.769 50.128 1.00 0.00 ATOM 334 OH TYR A 40 1.113 -3.984 49.695 1.00 0.00 ATOM 335 O TYR A 40 3.286 3.614 52.355 1.00 0.00 ATOM 336 C TYR A 40 3.421 3.436 51.143 1.00 0.00 ATOM 337 N ARG A 41 3.876 4.400 50.354 1.00 0.00 ATOM 338 CA ARG A 41 4.254 5.687 50.959 1.00 0.00 ATOM 339 CB ARG A 41 5.577 6.246 50.338 1.00 0.00 ATOM 340 CG ARG A 41 6.789 5.355 50.421 1.00 0.00 ATOM 341 CD ARG A 41 7.909 5.966 49.594 1.00 0.00 ATOM 342 NE ARG A 41 9.158 5.250 49.811 1.00 0.00 ATOM 343 CZ ARG A 41 9.511 4.170 49.128 1.00 0.00 ATOM 344 NH1 ARG A 41 8.702 3.694 48.186 1.00 0.00 ATOM 345 NH2 ARG A 41 10.652 3.557 49.410 1.00 0.00 ATOM 346 O ARG A 41 2.430 6.820 49.881 1.00 0.00 ATOM 347 C ARG A 41 3.016 6.591 50.941 1.00 0.00 ATOM 348 N CYS A 42 2.581 6.965 52.132 1.00 0.00 ATOM 349 CA CYS A 42 1.432 7.873 52.338 1.00 0.00 ATOM 350 CB CYS A 42 1.206 8.202 53.815 1.00 0.00 ATOM 351 SG CYS A 42 -0.375 9.110 54.019 1.00 0.00 ATOM 352 O CYS A 42 2.655 9.880 51.670 1.00 0.00 ATOM 353 C CYS A 42 1.635 9.195 51.593 1.00 0.00 ATOM 354 N ARG A 43 0.611 9.486 50.804 1.00 0.00 ATOM 355 CA ARG A 43 0.539 10.742 50.053 1.00 0.00 ATOM 356 CB ARG A 43 0.351 10.501 48.563 1.00 0.00 ATOM 357 CG ARG A 43 0.085 11.752 47.740 1.00 0.00 ATOM 358 CD ARG A 43 0.176 11.551 46.272 1.00 0.00 ATOM 359 NE ARG A 43 -0.856 10.691 45.717 1.00 0.00 ATOM 360 CZ ARG A 43 -0.664 9.410 45.344 1.00 0.00 ATOM 361 NH1 ARG A 43 0.521 8.848 45.434 1.00 0.00 ATOM 362 NH2 ARG A 43 -1.698 8.737 44.868 1.00 0.00 ATOM 363 O ARG A 43 -1.714 11.323 50.774 1.00 0.00 ATOM 364 C ARG A 43 -0.548 11.681 50.607 1.00 0.00 ATOM 365 N MET A 44 -0.060 12.814 51.112 1.00 0.00 ATOM 366 CA MET A 44 -0.839 13.779 51.901 1.00 0.00 ATOM 367 CB MET A 44 0.096 14.643 52.745 1.00 0.00 ATOM 368 CG MET A 44 -0.614 15.631 53.661 1.00 0.00 ATOM 369 SD MET A 44 -1.668 14.814 54.878 1.00 0.00 ATOM 370 CE MET A 44 -0.441 14.129 55.985 1.00 0.00 ATOM 371 O MET A 44 -2.864 14.926 51.281 1.00 0.00 ATOM 372 C MET A 44 -1.695 14.663 51.004 1.00 0.00 ATOM 373 N LEU A 45 -1.076 15.050 49.902 1.00 0.00 ATOM 374 CA LEU A 45 -1.698 15.932 48.927 1.00 0.00 ATOM 375 CB LEU A 45 -1.349 17.393 49.268 1.00 0.00 ATOM 376 CG LEU A 45 -1.886 18.423 48.264 1.00 0.00 ATOM 377 CD1 LEU A 45 -3.394 18.506 48.312 1.00 0.00 ATOM 378 CD2 LEU A 45 -1.327 19.809 48.565 1.00 0.00 ATOM 379 O LEU A 45 -0.009 15.795 47.226 1.00 0.00 ATOM 380 C LEU A 45 -1.213 15.817 47.483 1.00 0.00 ATOM 381 N VAL A 46 -2.157 15.784 46.594 1.00 0.00 ATOM 382 CA VAL A 46 -1.838 15.670 45.171 1.00 0.00 ATOM 383 CB VAL A 46 -2.611 14.501 44.532 1.00 0.00 ATOM 384 CG1 VAL A 46 -4.106 14.777 44.557 1.00 0.00 ATOM 385 CG2 VAL A 46 -2.137 14.265 43.106 1.00 0.00 ATOM 386 O VAL A 46 -3.350 17.314 44.308 1.00 0.00 ATOM 387 C VAL A 46 -2.176 16.939 44.387 1.00 0.00 ATOM 388 N GLY A 47 -1.148 17.604 43.823 1.00 0.00 ATOM 389 CA GLY A 47 -1.341 18.812 43.084 1.00 0.00 ATOM 390 O GLY A 47 -0.362 17.976 41.071 1.00 0.00 ATOM 391 C GLY A 47 -1.340 18.504 41.602 1.00 0.00 ATOM 392 N THR A 48 -2.460 18.810 40.985 1.00 0.00 ATOM 393 CA THR A 48 -2.643 18.561 39.539 1.00 0.00 ATOM 394 CB THR A 48 -3.905 17.720 39.294 1.00 0.00 ATOM 395 CG2 THR A 48 -5.137 18.439 39.821 1.00 0.00 ATOM 396 OG1 THR A 48 -4.061 17.482 37.888 1.00 0.00 ATOM 397 O THR A 48 -3.734 20.544 38.993 1.00 0.00 ATOM 398 C THR A 48 -2.732 19.853 38.804 1.00 0.00 ATOM 399 N ALA A 49 -2.025 19.850 37.700 1.00 0.00 ATOM 400 CA ALA A 49 -2.216 20.943 36.723 1.00 0.00 ATOM 401 CB ALA A 49 -1.533 20.601 35.407 1.00 0.00 ATOM 402 O ALA A 49 -4.462 20.257 36.198 1.00 0.00 ATOM 403 C ALA A 49 -3.714 21.171 36.461 1.00 0.00 ATOM 404 N ALA A 50 -4.212 22.347 36.811 1.00 0.00 ATOM 405 CA ALA A 50 -5.660 22.629 36.701 1.00 0.00 ATOM 406 CB ALA A 50 -5.942 24.051 37.180 1.00 0.00 ATOM 407 O ALA A 50 -7.281 21.950 35.060 1.00 0.00 ATOM 408 C ALA A 50 -6.147 22.389 35.273 1.00 0.00 ATOM 409 N MET A 51 -5.297 22.655 34.290 1.00 0.00 ATOM 410 CA MET A 51 -5.660 22.469 32.883 1.00 0.00 ATOM 411 CB MET A 51 -4.517 22.974 32.004 1.00 0.00 ATOM 412 CG MET A 51 -4.765 22.839 30.509 1.00 0.00 ATOM 413 SD MET A 51 -3.374 23.419 29.517 1.00 0.00 ATOM 414 CE MET A 51 -2.187 22.110 29.800 1.00 0.00 ATOM 415 O MET A 51 -6.977 20.731 31.949 1.00 0.00 ATOM 416 C MET A 51 -5.953 21.023 32.547 1.00 0.00 ATOM 417 N LEU A 52 -5.138 20.131 33.072 1.00 0.00 ATOM 418 CA LEU A 52 -5.344 18.701 32.856 1.00 0.00 ATOM 419 CB LEU A 52 -4.057 18.049 32.333 1.00 0.00 ATOM 420 CG LEU A 52 -3.540 18.603 30.999 1.00 0.00 ATOM 421 CD1 LEU A 52 -2.221 17.933 30.633 1.00 0.00 ATOM 422 CD2 LEU A 52 -4.581 18.368 29.915 1.00 0.00 ATOM 423 O LEU A 52 -4.798 17.661 34.931 1.00 0.00 ATOM 424 C LEU A 52 -5.669 17.897 34.100 1.00 0.00 ATOM 425 N ARG A 53 -6.938 17.499 34.232 1.00 0.00 ATOM 426 CA ARG A 53 -7.387 16.701 35.362 1.00 0.00 ATOM 427 CB ARG A 53 -8.864 16.684 35.370 1.00 0.00 ATOM 428 CG ARG A 53 -9.316 17.931 36.112 1.00 0.00 ATOM 429 CD ARG A 53 -10.582 17.681 36.903 1.00 0.00 ATOM 430 NE ARG A 53 -10.311 16.897 38.103 1.00 0.00 ATOM 431 CZ ARG A 53 -11.205 16.650 39.055 1.00 0.00 ATOM 432 NH1 ARG A 53 -12.439 17.125 38.952 1.00 0.00 ATOM 433 NH2 ARG A 53 -10.863 15.933 40.116 1.00 0.00 ATOM 434 O ARG A 53 -7.644 14.536 34.408 1.00 0.00 ATOM 435 C ARG A 53 -7.037 15.243 35.216 1.00 0.00 ATOM 436 N ALA A 54 -6.044 14.743 36.010 1.00 0.00 ATOM 437 CA ALA A 54 -5.701 13.339 35.964 1.00 0.00 ATOM 438 CB ALA A 54 -4.253 13.099 36.192 1.00 0.00 ATOM 439 O ALA A 54 -7.126 12.974 37.807 1.00 0.00 ATOM 440 C ALA A 54 -6.712 12.519 36.756 1.00 0.00 ATOM 441 N VAL A 55 -7.107 11.376 36.224 1.00 0.00 ATOM 442 CA VAL A 55 -8.085 10.497 36.896 1.00 0.00 ATOM 443 CB VAL A 55 -8.551 9.355 35.973 1.00 0.00 ATOM 444 CG1 VAL A 55 -9.386 8.348 36.753 1.00 0.00 ATOM 445 CG2 VAL A 55 -9.345 9.909 34.800 1.00 0.00 ATOM 446 O VAL A 55 -8.138 9.893 39.218 1.00 0.00 ATOM 447 C VAL A 55 -7.489 9.888 38.176 1.00 0.00 ATOM 448 N SER A 56 -6.250 9.386 38.069 1.00 0.00 ATOM 449 CA SER A 56 -5.556 8.802 39.239 1.00 0.00 ATOM 450 CB SER A 56 -4.192 8.279 38.830 1.00 0.00 ATOM 451 OG SER A 56 -3.493 7.729 39.914 1.00 0.00 ATOM 452 O SER A 56 -5.444 9.514 41.537 1.00 0.00 ATOM 453 C SER A 56 -5.335 9.829 40.344 1.00 0.00 ATOM 454 N THR A 57 -5.148 11.091 39.961 1.00 0.00 ATOM 455 CA THR A 57 -4.852 12.111 40.956 1.00 0.00 ATOM 456 CB THR A 57 -4.945 13.511 40.268 1.00 0.00 ATOM 457 CG2 THR A 57 -4.475 14.628 41.206 1.00 0.00 ATOM 458 OG1 THR A 57 -4.138 13.520 39.092 1.00 0.00 ATOM 459 O THR A 57 -5.540 11.985 43.242 1.00 0.00 ATOM 460 C THR A 57 -5.908 12.191 42.086 1.00 0.00 ATOM 461 N PRO A 58 -7.141 12.654 41.805 1.00 0.00 ATOM 462 CA PRO A 58 -8.148 12.865 42.842 1.00 0.00 ATOM 463 CB PRO A 58 -9.359 13.338 42.065 1.00 0.00 ATOM 464 CG PRO A 58 -8.716 14.175 40.983 1.00 0.00 ATOM 465 CD PRO A 58 -7.584 13.277 40.528 1.00 0.00 ATOM 466 O PRO A 58 -8.699 11.589 44.798 1.00 0.00 ATOM 467 C PRO A 58 -8.538 11.603 43.593 1.00 0.00 ATOM 468 N HIS A 59 -8.774 10.537 42.853 1.00 0.00 ATOM 469 CA HIS A 59 -9.222 9.279 43.475 1.00 0.00 ATOM 470 CB HIS A 59 -9.551 8.234 42.406 1.00 0.00 ATOM 471 CG HIS A 59 -10.800 8.534 41.634 1.00 0.00 ATOM 472 CD2 HIS A 59 -11.790 9.428 41.853 1.00 0.00 ATOM 473 ND1 HIS A 59 -11.136 7.870 40.475 1.00 0.00 ATOM 474 CE1 HIS A 59 -12.281 8.343 40.014 1.00 0.00 ATOM 475 NE2 HIS A 59 -12.699 9.290 40.835 1.00 0.00 ATOM 476 O HIS A 59 -8.460 8.247 45.493 1.00 0.00 ATOM 477 C HIS A 59 -8.150 8.764 44.424 1.00 0.00 ATOM 478 N ASP A 60 -6.920 8.959 44.048 1.00 0.00 ATOM 479 CA ASP A 60 -5.807 8.505 44.856 1.00 0.00 ATOM 480 CB ASP A 60 -4.749 7.886 43.905 1.00 0.00 ATOM 481 CG ASP A 60 -5.332 6.751 43.086 1.00 0.00 ATOM 482 OD1 ASP A 60 -5.942 5.895 43.877 1.00 0.00 ATOM 483 OD2 ASP A 60 -5.238 6.638 41.861 1.00 0.00 ATOM 484 O ASP A 60 -3.961 9.956 45.473 1.00 0.00 ATOM 485 C ASP A 60 -5.129 9.609 45.672 1.00 0.00 ATOM 486 N ALA A 61 -5.941 10.175 46.547 1.00 0.00 ATOM 487 CA ALA A 61 -5.511 11.246 47.441 1.00 0.00 ATOM 488 CB ALA A 61 -5.117 12.493 46.667 1.00 0.00 ATOM 489 O ALA A 61 -7.694 11.785 48.430 1.00 0.00 ATOM 490 C ALA A 61 -6.476 11.622 48.546 1.00 0.00 ATOM 491 N GLU A 62 -5.814 11.904 49.647 1.00 0.00 ATOM 492 CA GLU A 62 -6.564 12.266 50.837 1.00 0.00 ATOM 493 CB GLU A 62 -5.740 11.977 52.093 1.00 0.00 ATOM 494 CG GLU A 62 -5.458 10.500 52.335 1.00 0.00 ATOM 495 CD GLU A 62 -4.625 10.296 53.571 1.00 0.00 ATOM 496 OE1 GLU A 62 -4.320 11.263 54.225 1.00 0.00 ATOM 497 OE2 GLU A 62 -4.393 9.165 53.927 1.00 0.00 ATOM 498 O GLU A 62 -8.080 14.120 51.029 1.00 0.00 ATOM 499 C GLU A 62 -7.034 13.681 50.543 1.00 0.00 ATOM 500 N VAL A 63 -6.163 14.377 49.713 1.00 0.00 ATOM 501 CA VAL A 63 -6.457 15.748 49.334 1.00 0.00 ATOM 502 CB VAL A 63 -5.837 16.825 50.188 1.00 0.00 ATOM 503 CG1 VAL A 63 -6.320 18.181 49.669 1.00 0.00 ATOM 504 CG2 VAL A 63 -6.270 16.664 51.641 1.00 0.00 ATOM 505 O VAL A 63 -4.814 15.510 47.595 1.00 0.00 ATOM 506 C VAL A 63 -5.924 15.943 47.925 1.00 0.00 ATOM 507 N VAL A 64 -6.741 16.588 47.010 1.00 0.00 ATOM 508 CA VAL A 64 -6.357 16.847 45.633 1.00 0.00 ATOM 509 CB VAL A 64 -7.154 15.991 44.631 1.00 0.00 ATOM 510 CG1 VAL A 64 -8.648 16.205 44.818 1.00 0.00 ATOM 511 CG2 VAL A 64 -6.746 16.321 43.204 1.00 0.00 ATOM 512 O VAL A 64 -7.751 18.779 45.447 1.00 0.00 ATOM 513 C VAL A 64 -6.621 18.328 45.357 1.00 0.00 ATOM 514 N GLU A 65 -5.630 18.945 44.753 1.00 0.00 ATOM 515 CA GLU A 65 -5.776 20.376 44.463 1.00 0.00 ATOM 516 CB GLU A 65 -4.882 21.202 45.400 1.00 0.00 ATOM 517 CG GLU A 65 -5.108 21.092 46.897 1.00 0.00 ATOM 518 CD GLU A 65 -6.221 21.993 47.401 1.00 0.00 ATOM 519 OE1 GLU A 65 -6.345 23.146 46.918 1.00 0.00 ATOM 520 OE2 GLU A 65 -6.961 21.543 48.299 1.00 0.00 ATOM 521 O GLU A 65 -4.390 20.140 42.522 1.00 0.00 ATOM 522 C GLU A 65 -5.384 20.678 43.022 1.00 0.00 ATOM 523 N LEU A 66 -6.159 21.580 42.312 1.00 0.00 ATOM 524 CA LEU A 66 -5.826 21.966 40.943 1.00 0.00 ATOM 525 CB LEU A 66 -7.141 22.222 40.195 1.00 0.00 ATOM 526 CG LEU A 66 -7.842 20.965 39.661 1.00 0.00 ATOM 527 CD1 LEU A 66 -8.088 19.983 40.797 1.00 0.00 ATOM 528 CD2 LEU A 66 -9.151 21.357 38.994 1.00 0.00 ATOM 529 O LEU A 66 -5.485 24.340 40.990 1.00 0.00 ATOM 530 C LEU A 66 -4.948 23.239 40.888 1.00 0.00 ATOM 531 N PRO A 67 -3.616 23.140 40.729 1.00 0.00 ATOM 532 CA PRO A 67 -2.748 24.312 40.615 1.00 0.00 ATOM 533 CB PRO A 67 -1.374 23.845 41.097 1.00 0.00 ATOM 534 CG PRO A 67 -1.368 22.374 40.715 1.00 0.00 ATOM 535 CD PRO A 67 -2.773 22.036 41.205 1.00 0.00 ATOM 536 O PRO A 67 -2.571 24.181 38.205 1.00 0.00 ATOM 537 C PRO A 67 -2.623 24.888 39.206 1.00 0.00 ATOM 538 N GLU A 68 -2.418 26.202 39.202 1.00 0.00 ATOM 539 CA GLU A 68 -1.985 26.893 37.981 1.00 0.00 ATOM 540 CB GLU A 68 -1.895 28.400 38.223 1.00 0.00 ATOM 541 CG GLU A 68 -1.511 29.211 36.996 1.00 0.00 ATOM 542 CD GLU A 68 -1.494 30.683 37.297 1.00 0.00 ATOM 543 OE1 GLU A 68 -1.770 31.046 38.415 1.00 0.00 ATOM 544 OE2 GLU A 68 -1.097 31.442 36.442 1.00 0.00 ATOM 545 O GLU A 68 0.200 25.892 38.381 1.00 0.00 ATOM 546 C GLU A 68 -0.630 26.287 37.559 1.00 0.00 ATOM 547 N SER A 69 -0.468 26.115 36.258 1.00 0.00 ATOM 548 CA SER A 69 0.723 25.442 35.717 1.00 0.00 ATOM 549 CB SER A 69 0.596 25.287 34.185 1.00 0.00 ATOM 550 OG SER A 69 0.578 26.573 33.572 1.00 0.00 ATOM 551 O SER A 69 3.092 25.451 36.211 1.00 0.00 ATOM 552 C SER A 69 2.063 26.125 36.080 1.00 0.00 ATOM 553 N PHE A 70 2.029 27.444 36.237 1.00 0.00 ATOM 554 CA PHE A 70 3.228 28.246 36.576 1.00 0.00 ATOM 555 CB PHE A 70 2.919 29.739 36.590 1.00 0.00 ATOM 556 CG PHE A 70 3.976 30.569 35.897 1.00 0.00 ATOM 557 CD1 PHE A 70 5.212 30.854 36.475 1.00 0.00 ATOM 558 CD2 PHE A 70 3.706 31.073 34.624 1.00 0.00 ATOM 559 CE1 PHE A 70 6.165 31.605 35.818 1.00 0.00 ATOM 560 CE2 PHE A 70 4.681 31.794 33.950 1.00 0.00 ATOM 561 CZ PHE A 70 5.895 32.020 34.526 1.00 0.00 ATOM 562 O PHE A 70 4.927 27.745 38.192 1.00 0.00 ATOM 563 C PHE A 70 3.725 27.889 37.976 1.00 0.00 ATOM 564 N ASP A 71 2.803 27.769 38.905 1.00 0.00 ATOM 565 CA ASP A 71 3.192 27.409 40.267 1.00 0.00 ATOM 566 CB ASP A 71 2.030 27.306 41.207 1.00 0.00 ATOM 567 CG ASP A 71 1.587 28.673 41.703 1.00 0.00 ATOM 568 OD1 ASP A 71 2.446 29.584 41.764 1.00 0.00 ATOM 569 OD2 ASP A 71 0.397 28.839 42.048 1.00 0.00 ATOM 570 O ASP A 71 4.976 25.945 40.908 1.00 0.00 ATOM 571 C ASP A 71 3.941 26.076 40.254 1.00 0.00 ATOM 572 N PHE A 72 3.417 25.084 39.497 1.00 0.00 ATOM 573 CA PHE A 72 4.031 23.774 39.366 1.00 0.00 ATOM 574 CB PHE A 72 3.169 22.808 38.548 1.00 0.00 ATOM 575 CG PHE A 72 3.914 21.480 38.284 1.00 0.00 ATOM 576 CD1 PHE A 72 4.032 20.507 39.270 1.00 0.00 ATOM 577 CD2 PHE A 72 4.538 21.264 37.062 1.00 0.00 ATOM 578 CE1 PHE A 72 4.765 19.356 39.077 1.00 0.00 ATOM 579 CE2 PHE A 72 5.261 20.096 36.855 1.00 0.00 ATOM 580 CZ PHE A 72 5.377 19.141 37.858 1.00 0.00 ATOM 581 O PHE A 72 6.330 23.143 39.212 1.00 0.00 ATOM 582 C PHE A 72 5.416 23.804 38.722 1.00 0.00 ATOM 583 N LYS A 73 5.605 24.548 37.592 1.00 0.00 ATOM 584 CA LYS A 73 6.915 24.581 36.955 1.00 0.00 ATOM 585 CB LYS A 73 6.719 25.207 35.516 1.00 0.00 ATOM 586 CG LYS A 73 7.754 24.778 34.462 1.00 0.00 ATOM 587 CD LYS A 73 9.188 25.211 34.786 1.00 0.00 ATOM 588 CE LYS A 73 9.377 26.732 34.794 1.00 0.00 ATOM 589 NZ LYS A 73 9.090 27.391 33.477 1.00 0.00 ATOM 590 O LYS A 73 9.075 24.921 37.870 1.00 0.00 ATOM 591 C LYS A 73 7.891 25.150 37.985 1.00 0.00 ATOM 592 N ARG A 74 7.343 25.853 39.053 1.00 0.00 ATOM 593 CA ARG A 74 8.194 26.358 40.126 1.00 0.00 ATOM 594 CB ARG A 74 7.501 27.575 40.845 1.00 0.00 ATOM 595 CG ARG A 74 7.280 28.906 40.048 1.00 0.00 ATOM 596 CD ARG A 74 6.343 29.915 40.740 1.00 0.00 ATOM 597 NE ARG A 74 6.064 31.154 39.972 1.00 0.00 ATOM 598 CZ ARG A 74 5.340 32.192 40.422 1.00 0.00 ATOM 599 NH1 ARG A 74 5.279 33.303 39.736 1.00 0.00 ATOM 600 NH2 ARG A 74 4.757 32.191 41.612 1.00 0.00 ATOM 601 O ARG A 74 10.428 25.739 40.657 1.00 0.00 ATOM 602 C ARG A 74 9.280 25.347 40.477 1.00 0.00 ATOM 603 N ILE A 75 8.874 24.031 40.432 1.00 0.00 ATOM 604 CA ILE A 75 9.835 22.935 40.506 1.00 0.00 ATOM 605 CB ILE A 75 9.702 21.843 41.584 1.00 0.00 ATOM 606 CG1 ILE A 75 8.299 21.233 41.555 1.00 0.00 ATOM 607 CG2 ILE A 75 10.006 22.416 42.961 1.00 0.00 ATOM 608 CD1 ILE A 75 8.141 20.020 42.443 1.00 0.00 ATOM 609 O ILE A 75 8.976 21.790 38.584 1.00 0.00 ATOM 610 C ILE A 75 9.963 22.255 39.149 1.00 0.00 ATOM 611 N SER A 76 11.248 22.217 38.593 1.00 0.00 ATOM 612 CA SER A 76 11.489 21.622 37.285 1.00 0.00 ATOM 613 CB SER A 76 12.729 22.252 36.644 1.00 0.00 ATOM 614 OG SER A 76 13.883 21.873 37.376 1.00 0.00 ATOM 615 O SER A 76 11.971 19.624 38.511 1.00 0.00 ATOM 616 C SER A 76 11.528 20.113 37.473 1.00 0.00 ATOM 617 N THR A 77 11.064 19.378 36.456 1.00 0.00 ATOM 618 CA THR A 77 11.071 17.928 36.533 1.00 0.00 ATOM 619 CB THR A 77 9.650 17.435 35.675 1.00 0.00 ATOM 620 CG2 THR A 77 8.277 17.848 36.149 1.00 0.00 ATOM 621 OG1 THR A 77 9.904 18.048 34.412 1.00 0.00 ATOM 622 O THR A 77 12.542 16.125 35.953 1.00 0.00 ATOM 623 C THR A 77 12.340 17.337 35.946 1.00 0.00 ATOM 624 N GLN A 78 13.203 18.228 35.466 1.00 0.00 ATOM 625 CA GLN A 78 14.462 17.875 34.802 1.00 0.00 ATOM 626 CB GLN A 78 15.252 19.137 34.443 1.00 0.00 ATOM 627 CG GLN A 78 16.561 18.869 33.725 1.00 0.00 ATOM 628 CD GLN A 78 17.301 20.145 33.368 1.00 0.00 ATOM 629 OE1 GLN A 78 16.876 21.246 33.734 1.00 0.00 ATOM 630 NE2 GLN A 78 18.407 20.008 32.648 1.00 0.00 ATOM 631 O GLN A 78 16.297 16.368 35.146 1.00 0.00 ATOM 632 C GLN A 78 15.446 17.079 35.648 1.00 0.00 ATOM 633 N THR A 79 15.373 17.280 36.935 1.00 0.00 ATOM 634 CA THR A 79 16.329 16.712 37.891 1.00 0.00 ATOM 635 CB THR A 79 16.138 17.592 39.093 1.00 0.00 ATOM 636 CG2 THR A 79 16.486 19.049 38.774 1.00 0.00 ATOM 637 OG1 THR A 79 14.878 17.451 39.744 1.00 0.00 ATOM 638 O THR A 79 16.774 14.383 38.486 1.00 0.00 ATOM 639 C THR A 79 15.962 15.266 38.224 1.00 0.00 ATOM 640 N THR A 80 14.653 15.102 38.246 1.00 0.00 ATOM 641 CA THR A 80 14.002 13.825 38.435 1.00 0.00 ATOM 642 CB THR A 80 12.906 13.857 39.500 1.00 0.00 ATOM 643 CG2 THR A 80 13.257 14.648 40.742 1.00 0.00 ATOM 644 OG1 THR A 80 11.830 14.561 38.930 1.00 0.00 ATOM 645 O THR A 80 13.258 14.146 36.181 1.00 0.00 ATOM 646 C THR A 80 13.311 13.387 37.149 1.00 0.00 ATOM 647 N PRO A 81 12.441 12.351 37.009 1.00 0.00 ATOM 648 CA PRO A 81 11.625 12.065 35.827 1.00 0.00 ATOM 649 CB PRO A 81 11.626 10.433 35.940 1.00 0.00 ATOM 650 CG PRO A 81 12.702 10.126 36.945 1.00 0.00 ATOM 651 CD PRO A 81 12.586 11.275 37.917 1.00 0.00 ATOM 652 O PRO A 81 9.800 12.316 34.362 1.00 0.00 ATOM 653 C PRO A 81 10.313 12.717 35.407 1.00 0.00 ATOM 654 N GLN A 82 9.192 13.706 36.170 1.00 0.00 ATOM 655 CA GLN A 82 7.805 13.926 35.760 1.00 0.00 ATOM 656 CB GLN A 82 7.099 12.957 35.075 1.00 0.00 ATOM 657 CG GLN A 82 7.502 13.101 33.593 1.00 0.00 ATOM 658 CD GLN A 82 6.822 12.140 32.630 1.00 0.00 ATOM 659 OE1 GLN A 82 7.008 12.249 31.415 1.00 0.00 ATOM 660 NE2 GLN A 82 6.047 11.202 33.155 1.00 0.00 ATOM 661 O GLN A 82 6.910 15.444 37.393 1.00 0.00 ATOM 662 C GLN A 82 6.785 14.936 36.273 1.00 0.00 ATOM 663 N PRO A 83 5.682 15.248 35.503 1.00 0.00 ATOM 664 CA PRO A 83 4.677 16.236 35.903 1.00 0.00 ATOM 665 CB PRO A 83 3.823 16.410 34.645 1.00 0.00 ATOM 666 CG PRO A 83 4.774 16.122 33.535 1.00 0.00 ATOM 667 CD PRO A 83 5.554 14.944 34.056 1.00 0.00 ATOM 668 O PRO A 83 4.405 15.121 37.909 1.00 0.00 ATOM 669 C PRO A 83 3.883 15.915 37.161 1.00 0.00 ATOM 670 N LEU A 84 2.654 16.454 37.538 1.00 0.00 ATOM 671 CA LEU A 84 1.946 16.202 38.778 1.00 0.00 ATOM 672 CB LEU A 84 0.916 15.027 38.680 1.00 0.00 ATOM 673 CG LEU A 84 -0.118 15.118 37.556 1.00 0.00 ATOM 674 CD1 LEU A 84 -0.842 13.772 37.396 1.00 0.00 ATOM 675 CD2 LEU A 84 -1.131 16.241 37.810 1.00 0.00 ATOM 676 O LEU A 84 3.801 15.171 39.920 1.00 0.00 ATOM 677 C LEU A 84 2.890 16.001 39.954 1.00 0.00 ATOM 678 N MET A 85 2.751 16.737 40.972 1.00 0.00 ATOM 679 CA MET A 85 3.553 16.692 42.189 1.00 0.00 ATOM 680 CB MET A 85 4.168 18.079 42.372 1.00 0.00 ATOM 681 CG MET A 85 5.165 18.179 43.516 1.00 0.00 ATOM 682 SD MET A 85 4.364 18.294 45.129 1.00 0.00 ATOM 683 CE MET A 85 3.786 19.988 45.098 1.00 0.00 ATOM 684 O MET A 85 1.562 16.439 43.522 1.00 0.00 ATOM 685 C MET A 85 2.749 16.174 43.381 1.00 0.00 ATOM 686 N ALA A 86 3.425 15.378 44.221 1.00 0.00 ATOM 687 CA ALA A 86 2.772 14.889 45.440 1.00 0.00 ATOM 688 CB ALA A 86 2.659 13.359 45.383 1.00 0.00 ATOM 689 O ALA A 86 4.770 15.417 46.676 1.00 0.00 ATOM 690 C ALA A 86 3.538 15.363 46.671 1.00 0.00 ATOM 691 N VAL A 87 2.757 15.718 47.669 1.00 0.00 ATOM 692 CA VAL A 87 3.260 15.995 49.029 1.00 0.00 ATOM 693 CB VAL A 87 2.454 17.118 49.708 1.00 0.00 ATOM 694 CG1 VAL A 87 2.971 17.370 51.117 1.00 0.00 ATOM 695 CG2 VAL A 87 2.520 18.396 48.883 1.00 0.00 ATOM 696 O VAL A 87 2.051 14.167 49.974 1.00 0.00 ATOM 697 C VAL A 87 3.156 14.667 49.777 1.00 0.00 ATOM 698 N PHE A 88 4.311 14.060 50.020 1.00 0.00 ATOM 699 CA PHE A 88 4.390 12.730 50.650 1.00 0.00 ATOM 700 CB PHE A 88 5.643 12.140 50.090 1.00 0.00 ATOM 701 CG PHE A 88 5.271 11.508 48.777 1.00 0.00 ATOM 702 CD1 PHE A 88 5.710 12.055 47.570 1.00 0.00 ATOM 703 CD2 PHE A 88 4.409 10.414 48.743 1.00 0.00 ATOM 704 CE1 PHE A 88 5.290 11.525 46.352 1.00 0.00 ATOM 705 CE2 PHE A 88 3.981 9.874 47.523 1.00 0.00 ATOM 706 CZ PHE A 88 4.424 10.433 46.329 1.00 0.00 ATOM 707 O PHE A 88 5.803 13.627 52.356 1.00 0.00 ATOM 708 C PHE A 88 4.850 12.893 52.086 1.00 0.00 ATOM 709 N ASP A 89 4.321 12.001 52.898 1.00 0.00 ATOM 710 CA ASP A 89 4.713 11.994 54.301 1.00 0.00 ATOM 711 CB ASP A 89 3.692 11.269 55.132 1.00 0.00 ATOM 712 CG ASP A 89 2.368 11.970 55.398 1.00 0.00 ATOM 713 OD1 ASP A 89 2.314 13.187 55.113 1.00 0.00 ATOM 714 OD2 ASP A 89 1.468 11.276 55.926 1.00 0.00 ATOM 715 O ASP A 89 6.371 10.253 53.884 1.00 0.00 ATOM 716 C ASP A 89 6.071 11.329 54.425 1.00 0.00 ATOM 717 N LEU A 90 6.860 12.035 55.202 1.00 0.00 ATOM 718 CA LEU A 90 8.148 11.558 55.636 1.00 0.00 ATOM 719 CB LEU A 90 8.862 12.633 56.462 1.00 0.00 ATOM 720 CG LEU A 90 10.231 12.226 57.019 1.00 0.00 ATOM 721 CD1 LEU A 90 10.941 13.439 57.602 1.00 0.00 ATOM 722 CD2 LEU A 90 10.051 11.147 58.078 1.00 0.00 ATOM 723 O LEU A 90 8.768 9.269 56.099 1.00 0.00 ATOM 724 C LEU A 90 7.991 10.193 56.371 1.00 0.00 ATOM 725 N PRO A 91 7.001 10.010 57.288 1.00 0.00 ATOM 726 CA PRO A 91 6.861 8.691 57.930 1.00 0.00 ATOM 727 CB PRO A 91 5.734 8.926 58.944 1.00 0.00 ATOM 728 CG PRO A 91 4.936 10.038 58.333 1.00 0.00 ATOM 729 CD PRO A 91 6.007 10.955 57.802 1.00 0.00 ATOM 730 O PRO A 91 7.112 6.453 57.111 1.00 0.00 ATOM 731 C PRO A 91 6.535 7.546 56.978 1.00 0.00 ATOM 732 N ALA A 92 5.660 7.826 56.028 1.00 0.00 ATOM 733 CA ALA A 92 5.281 6.839 55.017 1.00 0.00 ATOM 734 CB ALA A 92 4.320 7.458 54.039 1.00 0.00 ATOM 735 O ALA A 92 6.666 5.256 53.854 1.00 0.00 ATOM 736 C ALA A 92 6.517 6.427 54.224 1.00 0.00 ATOM 737 N GLU A 93 7.418 7.419 53.963 1.00 0.00 ATOM 738 CA GLU A 93 8.616 7.188 53.166 1.00 0.00 ATOM 739 CB GLU A 93 9.377 8.511 53.028 1.00 0.00 ATOM 740 CG GLU A 93 10.817 8.363 52.560 1.00 0.00 ATOM 741 CD GLU A 93 11.463 9.703 52.344 1.00 0.00 ATOM 742 OE1 GLU A 93 11.511 10.474 53.273 1.00 0.00 ATOM 743 OE2 GLU A 93 12.004 9.916 51.286 1.00 0.00 ATOM 744 O GLU A 93 10.205 5.394 53.279 1.00 0.00 ATOM 745 C GLU A 93 9.624 6.285 53.893 1.00 0.00 ATOM 746 N PRO A 94 9.933 6.439 55.268 1.00 0.00 ATOM 747 CA PRO A 94 10.897 5.579 55.965 1.00 0.00 ATOM 748 CB PRO A 94 10.935 6.168 57.371 1.00 0.00 ATOM 749 CG PRO A 94 10.634 7.616 57.133 1.00 0.00 ATOM 750 CD PRO A 94 9.519 7.567 56.120 1.00 0.00 ATOM 751 O PRO A 94 11.624 3.315 56.026 1.00 0.00 ATOM 752 C PRO A 94 10.654 4.073 56.073 1.00 0.00 ATOM 753 N GLU A 95 9.463 3.711 56.220 1.00 0.00 ATOM 754 CA GLU A 95 9.132 2.299 56.360 1.00 0.00 ATOM 755 CB GLU A 95 7.687 2.126 56.784 1.00 0.00 ATOM 756 CG GLU A 95 7.404 2.469 58.247 1.00 0.00 ATOM 757 CD GLU A 95 6.074 1.940 58.771 1.00 0.00 ATOM 758 OE1 GLU A 95 5.653 0.854 58.341 1.00 0.00 ATOM 759 OE2 GLU A 95 5.449 2.630 59.607 1.00 0.00 ATOM 760 O GLU A 95 10.020 0.406 55.182 1.00 0.00 ATOM 761 C GLU A 95 9.548 1.541 55.093 1.00 0.00 ATOM 762 N PRO A 96 9.381 2.156 53.923 1.00 0.00 ATOM 763 CA PRO A 96 9.758 1.477 52.674 1.00 0.00 ATOM 764 CB PRO A 96 8.551 1.752 51.761 1.00 0.00 ATOM 765 CG PRO A 96 7.907 2.970 52.350 1.00 0.00 ATOM 766 CD PRO A 96 8.086 2.792 53.847 1.00 0.00 ATOM 767 O PRO A 96 11.708 1.020 51.296 1.00 0.00 ATOM 768 C PRO A 96 11.234 1.647 52.233 1.00 0.00 ATOM 769 N VAL A 97 12.002 2.411 52.976 1.00 0.00 ATOM 770 CA VAL A 97 13.471 2.479 52.783 1.00 0.00 ATOM 771 CB VAL A 97 14.100 3.320 53.897 1.00 0.00 ATOM 772 CG1 VAL A 97 15.605 3.126 53.917 1.00 0.00 ATOM 773 CG2 VAL A 97 13.725 4.782 53.682 1.00 0.00 ATOM 774 O VAL A 97 13.830 0.309 53.788 1.00 0.00 ATOM 775 C VAL A 97 14.119 1.087 52.891 1.00 0.00 ATOM 776 N VAL A 98 15.208 0.956 52.154 1.00 0.00 ATOM 777 CA VAL A 98 16.030 -0.265 52.146 1.00 0.00 ATOM 778 CB VAL A 98 16.364 -0.697 50.727 1.00 0.00 ATOM 779 CG1 VAL A 98 17.042 -2.070 50.687 1.00 0.00 ATOM 780 CG2 VAL A 98 15.066 -0.636 49.962 1.00 0.00 ATOM 781 O VAL A 98 18.295 0.520 52.214 1.00 0.00 ATOM 782 C VAL A 98 17.322 0.112 52.836 1.00 0.00 ATOM 783 N GLU A 99 17.313 -0.147 54.139 1.00 0.00 ATOM 784 CA GLU A 99 18.504 0.083 54.969 1.00 0.00 ATOM 785 CB GLU A 99 18.204 -0.234 56.433 1.00 0.00 ATOM 786 CG GLU A 99 17.288 0.769 57.119 1.00 0.00 ATOM 787 CD GLU A 99 16.964 0.340 58.526 1.00 0.00 ATOM 788 OE1 GLU A 99 17.370 -0.731 58.908 1.00 0.00 ATOM 789 OE2 GLU A 99 16.407 1.130 59.251 1.00 0.00 ATOM 790 O GLU A 99 20.839 -0.414 54.744 1.00 0.00 ATOM 791 C GLU A 99 19.695 -0.758 54.485 1.00 0.00 ATOM 792 N GLY A 100 19.387 -1.828 53.744 1.00 0.00 ATOM 793 CA GLY A 100 20.398 -2.775 53.245 1.00 0.00 ATOM 794 O GLY A 100 21.907 -3.192 51.495 1.00 0.00 ATOM 795 C GLY A 100 20.964 -2.483 51.872 1.00 0.00 ATOM 796 N LEU A 101 20.432 -1.561 51.115 1.00 0.00 ATOM 797 CA LEU A 101 20.894 -1.147 49.798 1.00 0.00 ATOM 798 CB LEU A 101 19.753 -0.990 48.786 1.00 0.00 ATOM 799 CG LEU A 101 20.142 -0.326 47.461 1.00 0.00 ATOM 800 CD1 LEU A 101 21.014 -1.266 46.641 1.00 0.00 ATOM 801 CD2 LEU A 101 18.885 0.052 46.692 1.00 0.00 ATOM 802 O LEU A 101 21.069 1.179 50.398 1.00 0.00 ATOM 803 C LEU A 101 21.645 0.163 50.012 1.00 0.00 ATOM 804 N THR A 102 22.946 0.086 49.790 1.00 0.00 ATOM 805 CA THR A 102 23.785 1.285 49.975 1.00 0.00 ATOM 806 CB THR A 102 24.878 0.969 50.989 1.00 0.00 ATOM 807 CG2 THR A 102 25.940 2.051 51.082 1.00 0.00 ATOM 808 OG1 THR A 102 24.375 0.535 52.256 1.00 0.00 ATOM 809 O THR A 102 24.534 0.891 47.721 1.00 0.00 ATOM 810 C THR A 102 24.411 1.705 48.642 1.00 0.00 ATOM 811 N LEU A 103 24.714 2.979 48.542 1.00 0.00 ATOM 812 CA LEU A 103 25.292 3.527 47.314 1.00 0.00 ATOM 813 CB LEU A 103 24.291 4.420 46.571 1.00 0.00 ATOM 814 CG LEU A 103 24.840 5.020 45.266 1.00 0.00 ATOM 815 CD1 LEU A 103 25.078 3.964 44.196 1.00 0.00 ATOM 816 CD2 LEU A 103 23.841 6.054 44.770 1.00 0.00 ATOM 817 O LEU A 103 26.541 5.018 48.733 1.00 0.00 ATOM 818 C LEU A 103 26.548 4.290 47.738 1.00 0.00 ATOM 819 N LEU A 104 27.590 4.083 46.967 1.00 0.00 ATOM 820 CA LEU A 104 28.877 4.784 47.154 1.00 0.00 ATOM 821 CB LEU A 104 29.949 3.789 47.594 1.00 0.00 ATOM 822 CG LEU A 104 31.321 4.454 47.768 1.00 0.00 ATOM 823 CD1 LEU A 104 31.349 5.416 48.931 1.00 0.00 ATOM 824 CD2 LEU A 104 32.377 3.417 48.031 1.00 0.00 ATOM 825 O LEU A 104 29.493 4.813 44.825 1.00 0.00 ATOM 826 C LEU A 104 29.282 5.481 45.843 1.00 0.00 ATOM 827 N LEU A 105 29.267 6.787 45.894 1.00 0.00 ATOM 828 CA LEU A 105 29.679 7.625 44.753 1.00 0.00 ATOM 829 CB LEU A 105 28.876 8.933 44.762 1.00 0.00 ATOM 830 CG LEU A 105 27.357 8.767 44.868 1.00 0.00 ATOM 831 CD1 LEU A 105 26.673 10.120 44.731 1.00 0.00 ATOM 832 CD2 LEU A 105 26.873 7.805 43.794 1.00 0.00 ATOM 833 O LEU A 105 31.660 8.626 45.665 1.00 0.00 ATOM 834 C LEU A 105 31.181 7.894 44.798 1.00 0.00 ATOM 835 N ASP A 106 31.891 7.282 43.855 1.00 0.00 ATOM 836 CA ASP A 106 33.356 7.383 43.783 1.00 0.00 ATOM 837 CB ASP A 106 33.880 6.117 43.207 1.00 0.00 ATOM 838 CG ASP A 106 35.359 6.255 42.939 1.00 0.00 ATOM 839 OD1 ASP A 106 36.031 7.007 43.681 1.00 0.00 ATOM 840 OD2 ASP A 106 35.853 5.603 41.996 1.00 0.00 ATOM 841 O ASP A 106 33.822 8.283 41.583 1.00 0.00 ATOM 842 C ASP A 106 33.827 8.464 42.800 1.00 0.00 ATOM 843 N GLY A 107 34.043 9.641 43.377 1.00 0.00 ATOM 844 CA GLY A 107 34.615 10.804 42.667 1.00 0.00 ATOM 845 O GLY A 107 34.179 11.297 40.346 1.00 0.00 ATOM 846 C GLY A 107 33.731 11.224 41.493 1.00 0.00 ATOM 847 N VAL A 108 32.446 11.403 41.769 1.00 0.00 ATOM 848 CA VAL A 108 31.525 11.903 40.728 1.00 0.00 ATOM 849 CB VAL A 108 30.047 11.838 41.158 1.00 0.00 ATOM 850 CG1 VAL A 108 29.128 12.329 40.036 1.00 0.00 ATOM 851 CG2 VAL A 108 29.652 10.390 41.469 1.00 0.00 ATOM 852 O VAL A 108 32.252 14.130 41.264 1.00 0.00 ATOM 853 C VAL A 108 32.001 13.323 40.375 1.00 0.00 ATOM 854 N GLN A 109 32.055 13.601 39.080 1.00 0.00 ATOM 855 CA GLN A 109 32.607 14.855 38.559 1.00 0.00 ATOM 856 CB GLN A 109 32.659 14.826 37.031 1.00 0.00 ATOM 857 CG GLN A 109 33.614 13.790 36.462 1.00 0.00 ATOM 858 CD GLN A 109 33.650 13.806 34.946 1.00 0.00 ATOM 859 OE1 GLN A 109 32.966 14.608 34.303 1.00 0.00 ATOM 860 NE2 GLN A 109 34.447 12.919 34.364 1.00 0.00 ATOM 861 O GLN A 109 32.228 16.754 39.924 1.00 0.00 ATOM 862 C GLN A 109 31.819 16.090 38.994 1.00 0.00 ATOM 863 N ASP A 110 30.664 16.303 38.363 1.00 0.00 ATOM 864 CA ASP A 110 29.869 17.511 38.582 1.00 0.00 ATOM 865 CB ASP A 110 29.553 18.144 37.184 1.00 0.00 ATOM 866 CG ASP A 110 30.786 18.418 36.339 1.00 0.00 ATOM 867 OD1 ASP A 110 31.798 18.917 36.885 1.00 0.00 ATOM 868 OD2 ASP A 110 30.742 18.144 35.119 1.00 0.00 ATOM 869 O ASP A 110 28.012 16.309 39.545 1.00 0.00 ATOM 870 C ASP A 110 28.657 17.363 39.500 1.00 0.00 ATOM 871 N PRO A 111 28.364 18.449 40.239 1.00 0.00 ATOM 872 CA PRO A 111 27.234 18.461 41.173 1.00 0.00 ATOM 873 CB PRO A 111 27.186 19.908 41.650 1.00 0.00 ATOM 874 CG PRO A 111 28.595 20.331 41.573 1.00 0.00 ATOM 875 CD PRO A 111 29.068 19.744 40.263 1.00 0.00 ATOM 876 O PRO A 111 25.017 17.559 41.217 1.00 0.00 ATOM 877 C PRO A 111 25.888 18.116 40.553 1.00 0.00 ATOM 878 N GLY A 112 25.670 18.458 39.250 1.00 0.00 ATOM 879 CA GLY A 112 24.422 18.167 38.569 1.00 0.00 ATOM 880 O GLY A 112 23.141 16.165 38.941 1.00 0.00 ATOM 881 C GLY A 112 24.212 16.654 38.575 1.00 0.00 ATOM 882 N ASN A 113 25.234 15.902 38.132 1.00 0.00 ATOM 883 CA ASN A 113 25.156 14.457 38.127 1.00 0.00 ATOM 884 CB ASN A 113 26.391 13.878 37.464 1.00 0.00 ATOM 885 CG ASN A 113 26.406 14.036 35.969 1.00 0.00 ATOM 886 ND2 ASN A 113 27.569 13.863 35.395 1.00 0.00 ATOM 887 OD1 ASN A 113 25.364 14.244 35.335 1.00 0.00 ATOM 888 O ASN A 113 24.238 12.957 39.754 1.00 0.00 ATOM 889 C ASN A 113 25.003 13.901 39.531 1.00 0.00 ATOM 890 N VAL A 114 25.720 14.492 40.484 1.00 0.00 ATOM 891 CA VAL A 114 25.625 14.033 41.862 1.00 0.00 ATOM 892 CB VAL A 114 26.616 14.832 42.708 1.00 0.00 ATOM 893 CG1 VAL A 114 26.341 14.425 44.130 1.00 0.00 ATOM 894 CG2 VAL A 114 28.074 14.479 42.461 1.00 0.00 ATOM 895 O VAL A 114 23.632 13.331 43.039 1.00 0.00 ATOM 896 C VAL A 114 24.207 14.229 42.423 1.00 0.00 ATOM 897 N GLY A 115 23.609 15.435 42.191 1.00 0.00 ATOM 898 CA GLY A 115 22.275 15.750 42.663 1.00 0.00 ATOM 899 O GLY A 115 20.376 14.277 42.802 1.00 0.00 ATOM 900 C GLY A 115 21.228 14.802 42.071 1.00 0.00 ATOM 901 N THR A 116 21.430 14.461 40.805 1.00 0.00 ATOM 902 CA THR A 116 20.559 13.496 40.097 1.00 0.00 ATOM 903 CB THR A 116 20.938 13.385 38.625 1.00 0.00 ATOM 904 CG2 THR A 116 20.054 12.437 37.832 1.00 0.00 ATOM 905 OG1 THR A 116 20.771 14.681 38.092 1.00 0.00 ATOM 906 O THR A 116 19.623 11.435 40.881 1.00 0.00 ATOM 907 C THR A 116 20.642 12.101 40.708 1.00 0.00 ATOM 908 N ILE A 117 21.851 11.725 41.097 1.00 0.00 ATOM 909 CA ILE A 117 22.078 10.431 41.750 1.00 0.00 ATOM 910 CB ILE A 117 23.583 10.146 41.921 1.00 0.00 ATOM 911 CG1 ILE A 117 24.265 9.986 40.554 1.00 0.00 ATOM 912 CG2 ILE A 117 23.751 8.854 42.733 1.00 0.00 ATOM 913 CD1 ILE A 117 25.794 10.012 40.630 1.00 0.00 ATOM 914 O ILE A 117 20.826 9.350 43.495 1.00 0.00 ATOM 915 C ILE A 117 21.373 10.381 43.105 1.00 0.00 ATOM 916 N LEU A 118 21.388 11.511 43.802 1.00 0.00 ATOM 917 CA LEU A 118 20.703 11.603 45.100 1.00 0.00 ATOM 918 CB LEU A 118 21.102 12.853 45.921 1.00 0.00 ATOM 919 CG LEU A 118 22.594 12.982 46.251 1.00 0.00 ATOM 920 CD1 LEU A 118 22.896 14.284 46.917 1.00 0.00 ATOM 921 CD2 LEU A 118 23.115 11.813 47.144 1.00 0.00 ATOM 922 O LEU A 118 18.537 10.715 45.649 1.00 0.00 ATOM 923 C LEU A 118 19.198 11.427 44.894 1.00 0.00 ATOM 924 N ARG A 119 18.712 12.060 43.892 1.00 0.00 ATOM 925 CA ARG A 119 17.288 11.921 43.615 1.00 0.00 ATOM 926 CB ARG A 119 16.901 13.165 42.730 1.00 0.00 ATOM 927 CG ARG A 119 15.425 13.501 42.621 1.00 0.00 ATOM 928 CD ARG A 119 14.748 13.621 43.977 1.00 0.00 ATOM 929 NE ARG A 119 13.302 13.780 43.799 1.00 0.00 ATOM 930 CZ ARG A 119 12.401 13.664 44.771 1.00 0.00 ATOM 931 NH1 ARG A 119 12.782 13.380 46.012 1.00 0.00 ATOM 932 NH2 ARG A 119 11.113 13.833 44.500 1.00 0.00 ATOM 933 O ARG A 119 15.914 9.962 43.626 1.00 0.00 ATOM 934 C ARG A 119 16.944 10.483 43.228 1.00 0.00 ATOM 935 N THR A 120 17.806 9.815 42.503 1.00 0.00 ATOM 936 CA THR A 120 17.577 8.421 42.087 1.00 0.00 ATOM 937 CB THR A 120 18.441 7.922 40.957 1.00 0.00 ATOM 938 CG2 THR A 120 18.498 8.911 39.905 1.00 0.00 ATOM 939 OG1 THR A 120 19.764 8.128 41.397 1.00 0.00 ATOM 940 O THR A 120 16.687 6.681 43.487 1.00 0.00 ATOM 941 C THR A 120 17.571 7.529 43.328 1.00 0.00 ATOM 942 N ALA A 121 18.562 7.722 44.224 1.00 0.00 ATOM 943 CA ALA A 121 18.647 6.934 45.454 1.00 0.00 ATOM 944 CB ALA A 121 19.801 7.416 46.321 1.00 0.00 ATOM 945 O ALA A 121 16.767 6.038 46.652 1.00 0.00 ATOM 946 C ALA A 121 17.328 7.045 46.224 1.00 0.00 ATOM 947 N ASP A 122 16.817 8.269 46.396 1.00 0.00 ATOM 948 CA ASP A 122 15.552 8.480 47.101 1.00 0.00 ATOM 949 CB ASP A 122 15.306 10.016 47.197 1.00 0.00 ATOM 950 CG ASP A 122 13.972 10.302 47.848 1.00 0.00 ATOM 951 OD1 ASP A 122 13.887 10.230 49.084 1.00 0.00 ATOM 952 OD2 ASP A 122 13.003 10.560 47.120 1.00 0.00 ATOM 953 O ASP A 122 13.543 7.107 47.105 1.00 0.00 ATOM 954 C ASP A 122 14.350 7.777 46.445 1.00 0.00 ATOM 955 N TRP A 123 14.385 7.763 45.118 1.00 0.00 ATOM 956 CA TRP A 123 13.342 7.116 44.294 1.00 0.00 ATOM 957 CB TRP A 123 13.580 7.375 42.814 1.00 0.00 ATOM 958 CG TRP A 123 12.355 6.932 42.013 1.00 0.00 ATOM 959 CD1 TRP A 123 11.267 7.659 41.855 1.00 0.00 ATOM 960 CD2 TRP A 123 12.127 5.797 41.269 1.00 0.00 ATOM 961 CE2 TRP A 123 10.921 5.949 40.616 1.00 0.00 ATOM 962 CE3 TRP A 123 12.775 4.587 41.205 1.00 0.00 ATOM 963 NE1 TRP A 123 10.409 7.078 41.019 1.00 0.00 ATOM 964 CZ2 TRP A 123 10.379 4.967 39.815 1.00 0.00 ATOM 965 CZ3 TRP A 123 12.208 3.577 40.455 1.00 0.00 ATOM 966 CH2 TRP A 123 11.033 3.753 39.742 1.00 0.00 ATOM 967 O TRP A 123 12.154 5.044 44.160 1.00 0.00 ATOM 968 C TRP A 123 13.217 5.595 44.412 1.00 0.00 ATOM 969 N PHE A 124 14.334 4.954 44.729 1.00 0.00 ATOM 970 CA PHE A 124 14.391 3.471 44.827 1.00 0.00 ATOM 971 CB PHE A 124 15.738 2.964 44.285 1.00 0.00 ATOM 972 CG PHE A 124 15.987 3.308 42.840 1.00 0.00 ATOM 973 CD1 PHE A 124 15.484 2.507 41.821 1.00 0.00 ATOM 974 CD2 PHE A 124 16.699 4.455 42.497 1.00 0.00 ATOM 975 CE1 PHE A 124 15.682 2.839 40.478 1.00 0.00 ATOM 976 CE2 PHE A 124 16.897 4.797 41.159 1.00 0.00 ATOM 977 CZ PHE A 124 16.387 3.984 40.145 1.00 0.00 ATOM 978 O PHE A 124 14.298 1.789 46.534 1.00 0.00 ATOM 979 C PHE A 124 14.288 2.994 46.276 1.00 0.00 ATOM 980 N GLY A 125 14.414 3.928 47.216 1.00 0.00 ATOM 981 CA GLY A 125 14.355 3.625 48.658 1.00 0.00 ATOM 982 O GLY A 125 15.791 3.072 50.469 1.00 0.00 ATOM 983 C GLY A 125 15.704 3.548 49.324 1.00 0.00 ATOM 984 N ILE A 126 16.820 4.000 48.630 1.00 0.00 ATOM 985 CA ILE A 126 18.130 4.010 49.259 1.00 0.00 ATOM 986 CB ILE A 126 19.209 4.397 48.232 1.00 0.00 ATOM 987 CG1 ILE A 126 19.330 3.320 47.152 1.00 0.00 ATOM 988 CG2 ILE A 126 20.546 4.615 48.923 1.00 0.00 ATOM 989 CD1 ILE A 126 20.358 3.631 46.090 1.00 0.00 ATOM 990 O ILE A 126 17.758 6.199 50.223 1.00 0.00 ATOM 991 C ILE A 126 18.108 5.033 50.410 1.00 0.00 ATOM 992 N ARG A 127 18.616 4.583 51.542 1.00 0.00 ATOM 993 CA ARG A 127 18.725 5.444 52.744 1.00 0.00 ATOM 994 CB ARG A 127 18.301 4.712 54.010 1.00 0.00 ATOM 995 CG ARG A 127 18.374 5.537 55.283 1.00 0.00 ATOM 996 CD ARG A 127 17.833 4.857 56.488 1.00 0.00 ATOM 997 NE ARG A 127 18.010 5.595 57.728 1.00 0.00 ATOM 998 CZ ARG A 127 17.670 5.135 58.946 1.00 0.00 ATOM 999 NH1 ARG A 127 17.100 3.959 59.092 1.00 0.00 ATOM 1000 NH2 ARG A 127 17.901 5.908 59.994 1.00 0.00 ATOM 1001 O ARG A 127 20.241 7.089 53.607 1.00 0.00 ATOM 1002 C ARG A 127 20.108 6.057 52.940 1.00 0.00 ATOM 1003 N HIS A 128 21.111 5.291 52.558 1.00 0.00 ATOM 1004 CA HIS A 128 22.512 5.647 52.816 1.00 0.00 ATOM 1005 CB HIS A 128 23.196 4.594 53.690 1.00 0.00 ATOM 1006 CG HIS A 128 22.450 4.282 54.950 1.00 0.00 ATOM 1007 CD2 HIS A 128 21.579 3.289 55.252 1.00 0.00 ATOM 1008 ND1 HIS A 128 22.566 5.046 56.094 1.00 0.00 ATOM 1009 CE1 HIS A 128 21.800 4.537 57.041 1.00 0.00 ATOM 1010 NE2 HIS A 128 21.189 3.471 56.556 1.00 0.00 ATOM 1011 O HIS A 128 23.505 4.876 50.761 1.00 0.00 ATOM 1012 C HIS A 128 23.303 5.830 51.515 1.00 0.00 ATOM 1013 N VAL A 129 23.819 7.045 51.364 1.00 0.00 ATOM 1014 CA VAL A 129 24.678 7.403 50.216 1.00 0.00 ATOM 1015 CB VAL A 129 23.985 8.463 49.326 1.00 0.00 ATOM 1016 CG1 VAL A 129 24.885 8.818 48.149 1.00 0.00 ATOM 1017 CG2 VAL A 129 22.648 7.937 48.830 1.00 0.00 ATOM 1018 O VAL A 129 26.014 8.906 51.534 1.00 0.00 ATOM 1019 C VAL A 129 25.991 7.948 50.775 1.00 0.00 ATOM 1020 N TRP A 130 27.052 7.228 50.442 1.00 0.00 ATOM 1021 CA TRP A 130 28.409 7.650 50.786 1.00 0.00 ATOM 1022 CB TRP A 130 29.199 6.487 51.385 1.00 0.00 ATOM 1023 CG TRP A 130 28.984 6.315 52.860 1.00 0.00 ATOM 1024 CD1 TRP A 130 29.663 6.945 53.860 1.00 0.00 ATOM 1025 CD2 TRP A 130 28.029 5.461 53.500 1.00 0.00 ATOM 1026 CE2 TRP A 130 28.188 5.623 54.888 1.00 0.00 ATOM 1027 CE3 TRP A 130 27.058 4.569 53.031 1.00 0.00 ATOM 1028 NE1 TRP A 130 29.190 6.536 55.084 1.00 0.00 ATOM 1029 CZ2 TRP A 130 27.413 4.935 55.807 1.00 0.00 ATOM 1030 CZ3 TRP A 130 26.280 3.881 53.954 1.00 0.00 ATOM 1031 CH2 TRP A 130 26.453 4.059 55.303 1.00 0.00 ATOM 1032 O TRP A 130 28.679 7.866 48.416 1.00 0.00 ATOM 1033 C TRP A 130 29.086 8.193 49.532 1.00 0.00 ATOM 1034 N LEU A 131 30.030 9.090 49.740 1.00 0.00 ATOM 1035 CA LEU A 131 30.790 9.652 48.615 1.00 0.00 ATOM 1036 CB LEU A 131 30.123 10.937 48.107 1.00 0.00 ATOM 1037 CG LEU A 131 29.523 11.834 49.195 1.00 0.00 ATOM 1038 CD1 LEU A 131 30.440 13.023 49.454 1.00 0.00 ATOM 1039 CD2 LEU A 131 28.140 12.306 48.765 1.00 0.00 ATOM 1040 O LEU A 131 32.549 10.409 50.090 1.00 0.00 ATOM 1041 C LEU A 131 32.252 9.942 48.986 1.00 0.00 ATOM 1042 N GLY A 132 33.131 9.720 47.999 1.00 0.00 ATOM 1043 CA GLY A 132 34.531 10.084 48.135 1.00 0.00 ATOM 1044 O GLY A 132 34.161 10.868 45.937 1.00 0.00 ATOM 1045 C GLY A 132 34.809 11.027 46.972 1.00 0.00 ATOM 1046 N THR A 133 35.415 12.153 47.277 1.00 0.00 ATOM 1047 CA THR A 133 35.542 13.237 46.273 1.00 0.00 ATOM 1048 CB THR A 133 34.648 14.440 46.629 1.00 0.00 ATOM 1049 CG2 THR A 133 35.136 15.180 47.830 1.00 0.00 ATOM 1050 OG1 THR A 133 34.706 15.446 45.621 1.00 0.00 ATOM 1051 O THR A 133 37.748 13.608 47.170 1.00 0.00 ATOM 1052 C THR A 133 36.963 13.799 46.231 1.00 0.00 ATOM 1053 N GLY A 134 37.226 14.598 45.196 1.00 0.00 ATOM 1054 CA GLY A 134 38.501 15.320 45.083 1.00 0.00 ATOM 1055 O GLY A 134 37.598 16.964 46.608 1.00 0.00 ATOM 1056 C GLY A 134 38.599 16.400 46.169 1.00 0.00 ATOM 1057 N SER A 135 39.830 16.661 46.590 1.00 0.00 ATOM 1058 CA SER A 135 40.112 17.749 47.556 1.00 0.00 ATOM 1059 CB SER A 135 41.573 17.976 47.829 1.00 0.00 ATOM 1060 OG SER A 135 42.311 18.235 46.670 1.00 0.00 ATOM 1061 O SER A 135 38.968 19.852 47.746 1.00 0.00 ATOM 1062 C SER A 135 39.650 19.116 47.026 1.00 0.00 ATOM 1063 N ALA A 136 39.880 19.354 45.738 1.00 0.00 ATOM 1064 CA ALA A 136 39.431 20.602 45.098 1.00 0.00 ATOM 1065 CB ALA A 136 40.010 20.772 43.694 1.00 0.00 ATOM 1066 O ALA A 136 37.344 21.798 45.253 1.00 0.00 ATOM 1067 C ALA A 136 37.899 20.715 45.045 1.00 0.00 ATOM 1068 N ASP A 137 37.239 19.581 44.831 1.00 0.00 ATOM 1069 CA ASP A 137 35.776 19.522 44.865 1.00 0.00 ATOM 1070 CB ASP A 137 35.367 18.182 44.135 1.00 0.00 ATOM 1071 CG ASP A 137 33.900 18.043 43.867 1.00 0.00 ATOM 1072 OD1 ASP A 137 33.258 19.082 43.596 1.00 0.00 ATOM 1073 OD2 ASP A 137 33.414 16.887 43.931 1.00 0.00 ATOM 1074 O ASP A 137 33.915 19.152 46.332 1.00 0.00 ATOM 1075 C ASP A 137 35.128 19.305 46.258 1.00 0.00 ATOM 1076 N VAL A 138 35.950 19.285 47.383 1.00 0.00 ATOM 1077 CA VAL A 138 35.394 19.056 48.724 1.00 0.00 ATOM 1078 CB VAL A 138 36.688 19.100 49.677 1.00 0.00 ATOM 1079 CG1 VAL A 138 36.498 19.035 51.112 1.00 0.00 ATOM 1080 CG2 VAL A 138 37.763 18.083 49.417 1.00 0.00 ATOM 1081 O VAL A 138 34.256 21.109 49.295 1.00 0.00 ATOM 1082 C VAL A 138 34.438 19.912 49.564 1.00 0.00 ATOM 1083 N PHE A 139 33.848 19.286 50.583 1.00 0.00 ATOM 1084 CA PHE A 139 32.733 19.865 51.352 1.00 0.00 ATOM 1085 CB PHE A 139 33.246 21.054 52.225 1.00 0.00 ATOM 1086 CG PHE A 139 34.275 20.860 53.290 1.00 0.00 ATOM 1087 CD1 PHE A 139 34.763 19.621 53.670 1.00 0.00 ATOM 1088 CD2 PHE A 139 34.720 21.983 53.988 1.00 0.00 ATOM 1089 CE1 PHE A 139 35.698 19.487 54.677 1.00 0.00 ATOM 1090 CE2 PHE A 139 35.677 21.886 55.003 1.00 0.00 ATOM 1091 CZ PHE A 139 36.162 20.604 55.345 1.00 0.00 ATOM 1092 O PHE A 139 31.426 20.965 49.684 1.00 0.00 ATOM 1093 C PHE A 139 31.610 19.929 50.340 1.00 0.00 ATOM 1094 N SER A 140 30.956 18.829 50.150 1.00 0.00 ATOM 1095 CA SER A 140 29.956 18.724 49.084 1.00 0.00 ATOM 1096 CB SER A 140 29.702 17.226 48.775 1.00 0.00 ATOM 1097 OG SER A 140 28.685 17.051 47.804 1.00 0.00 ATOM 1098 O SER A 140 27.782 19.152 50.024 1.00 0.00 ATOM 1099 C SER A 140 28.663 19.531 49.251 1.00 0.00 ATOM 1100 N PRO A 141 28.470 20.528 48.380 1.00 0.00 ATOM 1101 CA PRO A 141 27.221 21.322 48.347 1.00 0.00 ATOM 1102 CB PRO A 141 27.672 22.613 47.686 1.00 0.00 ATOM 1103 CG PRO A 141 28.657 22.108 46.636 1.00 0.00 ATOM 1104 CD PRO A 141 29.454 21.061 47.417 1.00 0.00 ATOM 1105 O PRO A 141 26.099 20.928 46.288 1.00 0.00 ATOM 1106 C PRO A 141 26.115 20.748 47.492 1.00 0.00 ATOM 1107 N LYS A 142 25.090 20.083 48.135 1.00 0.00 ATOM 1108 CA LYS A 142 24.008 19.504 47.372 1.00 0.00 ATOM 1109 CB LYS A 142 23.259 18.476 48.222 1.00 0.00 ATOM 1110 CG LYS A 142 24.061 17.218 48.535 1.00 0.00 ATOM 1111 CD LYS A 142 23.274 16.267 49.421 1.00 0.00 ATOM 1112 CE LYS A 142 23.041 16.861 50.804 1.00 0.00 ATOM 1113 NZ LYS A 142 24.318 17.080 51.535 1.00 0.00 ATOM 1114 O LYS A 142 22.771 21.530 47.655 1.00 0.00 ATOM 1115 C LYS A 142 23.028 20.599 46.906 1.00 0.00 ATOM 1116 N VAL A 143 22.497 20.489 45.692 1.00 0.00 ATOM 1117 CA VAL A 143 21.569 21.504 45.136 1.00 0.00 ATOM 1118 CB VAL A 143 21.751 21.654 43.615 1.00 0.00 ATOM 1119 CG1 VAL A 143 20.864 22.769 43.081 1.00 0.00 ATOM 1120 CG2 VAL A 143 23.210 21.929 43.276 1.00 0.00 ATOM 1121 O VAL A 143 19.712 20.028 45.041 1.00 0.00 ATOM 1122 C VAL A 143 20.142 21.076 45.494 1.00 0.00 ATOM 1123 N VAL A 144 19.458 21.879 46.286 1.00 0.00 ATOM 1124 CA VAL A 144 18.045 21.612 46.671 1.00 0.00 ATOM 1125 CB VAL A 144 17.598 22.530 47.809 1.00 0.00 ATOM 1126 CG1 VAL A 144 16.101 22.345 48.073 1.00 0.00 ATOM 1127 CG2 VAL A 144 18.398 22.187 49.044 1.00 0.00 ATOM 1128 O VAL A 144 16.280 20.880 45.232 1.00 0.00 ATOM 1129 C VAL A 144 17.144 21.730 45.439 1.00 0.00 ATOM 1130 N GLN A 145 17.364 22.758 44.631 1.00 0.00 ATOM 1131 CA GLN A 145 16.583 22.897 43.382 1.00 0.00 ATOM 1132 CB GLN A 145 16.970 24.200 42.663 1.00 0.00 ATOM 1133 CG GLN A 145 16.181 24.418 41.378 1.00 0.00 ATOM 1134 CD GLN A 145 14.687 24.594 41.632 1.00 0.00 ATOM 1135 OE1 GLN A 145 14.278 25.373 42.502 1.00 0.00 ATOM 1136 NE2 GLN A 145 13.870 23.880 40.868 1.00 0.00 ATOM 1137 O GLN A 145 15.950 21.330 41.687 1.00 0.00 ATOM 1138 C GLN A 145 16.838 21.687 42.490 1.00 0.00 ATOM 1139 N ALA A 146 18.024 21.153 42.545 1.00 0.00 ATOM 1140 CA ALA A 146 18.383 19.997 41.716 1.00 0.00 ATOM 1141 CB ALA A 146 19.919 19.915 41.611 1.00 0.00 ATOM 1142 O ALA A 146 17.254 17.895 41.619 1.00 0.00 ATOM 1143 C ALA A 146 17.821 18.726 42.329 1.00 0.00 ATOM 1144 N SER A 147 17.955 18.520 43.636 1.00 0.00 ATOM 1145 CA SER A 147 17.484 17.326 44.281 1.00 0.00 ATOM 1146 CB SER A 147 18.189 17.053 45.597 1.00 0.00 ATOM 1147 OG SER A 147 17.835 17.981 46.586 1.00 0.00 ATOM 1148 O SER A 147 15.444 16.230 44.901 1.00 0.00 ATOM 1149 C SER A 147 15.980 17.263 44.489 1.00 0.00 ATOM 1150 N MET A 148 15.337 18.416 44.298 1.00 0.00 ATOM 1151 CA MET A 148 13.926 18.650 44.636 1.00 0.00 ATOM 1152 CB MET A 148 13.020 17.721 43.831 1.00 0.00 ATOM 1153 CG MET A 148 13.013 17.989 42.335 1.00 0.00 ATOM 1154 SD MET A 148 12.046 19.444 41.892 1.00 0.00 ATOM 1155 CE MET A 148 13.341 20.662 41.679 1.00 0.00 ATOM 1156 O MET A 148 12.644 17.924 46.512 1.00 0.00 ATOM 1157 C MET A 148 13.681 18.459 46.137 1.00 0.00 ATOM 1158 N GLY A 149 14.928 18.934 46.829 1.00 0.00 ATOM 1159 CA GLY A 149 15.024 18.725 48.280 1.00 0.00 ATOM 1160 O GLY A 149 14.917 16.966 49.905 1.00 0.00 ATOM 1161 C GLY A 149 14.948 17.251 48.712 1.00 0.00 ATOM 1162 N ALA A 150 15.175 16.351 47.753 1.00 0.00 ATOM 1163 CA ALA A 150 15.359 14.919 48.043 1.00 0.00 ATOM 1164 CB ALA A 150 15.605 14.181 46.777 1.00 0.00 ATOM 1165 O ALA A 150 16.772 13.673 49.501 1.00 0.00 ATOM 1166 C ALA A 150 16.621 14.705 48.865 1.00 0.00 ATOM 1167 N LEU A 151 17.592 15.698 48.911 1.00 0.00 ATOM 1168 CA LEU A 151 18.776 15.533 49.737 1.00 0.00 ATOM 1169 CB LEU A 151 19.632 16.788 49.517 1.00 0.00 ATOM 1170 CG LEU A 151 19.166 18.038 50.275 1.00 0.00 ATOM 1171 CD1 LEU A 151 19.680 18.001 51.707 1.00 0.00 ATOM 1172 CD2 LEU A 151 19.661 19.284 49.555 1.00 0.00 ATOM 1173 O LEU A 151 19.262 14.786 51.965 1.00 0.00 ATOM 1174 C LEU A 151 18.476 15.383 51.225 1.00 0.00 ATOM 1175 N ALA A 152 17.323 15.875 51.618 1.00 0.00 ATOM 1176 CA ALA A 152 16.933 15.809 53.021 1.00 0.00 ATOM 1177 CB ALA A 152 15.598 16.509 53.239 1.00 0.00 ATOM 1178 O ALA A 152 16.975 14.146 54.752 1.00 0.00 ATOM 1179 C ALA A 152 16.666 14.412 53.599 1.00 0.00 ATOM 1180 N ARG A 153 16.119 13.517 52.820 1.00 0.00 ATOM 1181 CA ARG A 153 15.663 12.190 53.249 1.00 0.00 ATOM 1182 CB ARG A 153 14.261 11.867 52.754 1.00 0.00 ATOM 1183 CG ARG A 153 13.173 12.803 53.256 1.00 0.00 ATOM 1184 CD ARG A 153 12.761 12.565 54.663 1.00 0.00 ATOM 1185 NE ARG A 153 13.674 13.107 55.657 1.00 0.00 ATOM 1186 CZ ARG A 153 13.723 14.402 56.023 1.00 0.00 ATOM 1187 NH1 ARG A 153 12.944 15.297 55.458 1.00 0.00 ATOM 1188 NH2 ARG A 153 14.594 14.755 56.953 1.00 0.00 ATOM 1189 O ARG A 153 16.191 9.829 53.173 1.00 0.00 ATOM 1190 C ARG A 153 16.597 10.996 53.026 1.00 0.00 ATOM 1191 N VAL A 154 17.786 11.280 52.655 1.00 0.00 ATOM 1192 CA VAL A 154 18.832 10.311 52.388 1.00 0.00 ATOM 1193 CB VAL A 154 19.286 10.381 50.926 1.00 0.00 ATOM 1194 CG1 VAL A 154 20.635 9.686 50.732 1.00 0.00 ATOM 1195 CG2 VAL A 154 18.229 9.730 50.029 1.00 0.00 ATOM 1196 O VAL A 154 20.171 11.978 53.395 1.00 0.00 ATOM 1197 C VAL A 154 19.986 10.778 53.264 1.00 0.00 ATOM 1198 N GLN A 155 20.682 9.828 53.890 1.00 0.00 ATOM 1199 CA GLN A 155 21.845 10.132 54.748 1.00 0.00 ATOM 1200 CB GLN A 155 22.015 9.081 55.849 1.00 0.00 ATOM 1201 CG GLN A 155 23.185 9.339 56.780 1.00 0.00 ATOM 1202 CD GLN A 155 22.984 10.577 57.633 1.00 0.00 ATOM 1203 OE1 GLN A 155 21.923 10.765 58.237 1.00 0.00 ATOM 1204 NE2 GLN A 155 24.000 11.432 57.688 1.00 0.00 ATOM 1205 O GLN A 155 23.624 9.159 53.436 1.00 0.00 ATOM 1206 C GLN A 155 23.133 10.188 53.903 1.00 0.00 ATOM 1207 N PRO A 156 23.598 11.388 53.558 1.00 0.00 ATOM 1208 CA PRO A 156 24.799 11.534 52.748 1.00 0.00 ATOM 1209 CB PRO A 156 24.437 12.755 51.904 1.00 0.00 ATOM 1210 CG PRO A 156 23.676 13.668 52.859 1.00 0.00 ATOM 1211 CD PRO A 156 22.955 12.699 53.786 1.00 0.00 ATOM 1212 O PRO A 156 26.207 12.681 54.339 1.00 0.00 ATOM 1213 C PRO A 156 26.052 11.686 53.631 1.00 0.00 ATOM 1214 N THR A 157 26.970 10.731 53.490 1.00 0.00 ATOM 1215 CA THR A 157 28.215 10.737 54.275 1.00 0.00 ATOM 1216 CB THR A 157 28.281 9.534 55.227 1.00 0.00 ATOM 1217 CG2 THR A 157 29.562 9.534 56.071 1.00 0.00 ATOM 1218 OG1 THR A 157 27.172 9.577 56.128 1.00 0.00 ATOM 1219 O THR A 157 29.626 9.949 52.498 1.00 0.00 ATOM 1220 C THR A 157 29.463 10.787 53.380 1.00 0.00 ATOM 1221 N PRO A 158 30.340 11.747 53.668 1.00 0.00 ATOM 1222 CA PRO A 158 31.643 11.826 52.995 1.00 0.00 ATOM 1223 CB PRO A 158 32.069 13.281 53.164 1.00 0.00 ATOM 1224 CG PRO A 158 31.410 13.698 54.475 1.00 0.00 ATOM 1225 CD PRO A 158 30.075 12.958 54.482 1.00 0.00 ATOM 1226 O PRO A 158 32.727 10.742 54.866 1.00 0.00 ATOM 1227 C PRO A 158 32.647 10.870 53.642 1.00 0.00 ATOM 1228 N LEU A 159 33.338 10.143 52.779 1.00 0.00 ATOM 1229 CA LEU A 159 34.375 9.186 53.193 1.00 0.00 ATOM 1230 CB LEU A 159 34.049 7.809 52.655 1.00 0.00 ATOM 1231 CG LEU A 159 32.814 7.142 53.204 1.00 0.00 ATOM 1232 CD1 LEU A 159 32.566 5.843 52.449 1.00 0.00 ATOM 1233 CD2 LEU A 159 32.925 6.880 54.685 1.00 0.00 ATOM 1234 O LEU A 159 35.852 10.176 51.598 1.00 0.00 ATOM 1235 C LEU A 159 35.729 9.656 52.696 1.00 0.00 ATOM 1236 N LYS A 160 36.751 9.400 53.509 1.00 0.00 ATOM 1237 CA LYS A 160 38.127 9.785 53.140 1.00 0.00 ATOM 1238 CB LYS A 160 38.876 10.320 54.363 1.00 0.00 ATOM 1239 CG LYS A 160 38.297 11.608 54.940 1.00 0.00 ATOM 1240 CD LYS A 160 39.123 12.103 56.119 1.00 0.00 ATOM 1241 CE LYS A 160 38.552 13.393 56.688 1.00 0.00 ATOM 1242 NZ LYS A 160 39.319 13.864 57.876 1.00 0.00 ATOM 1243 O LYS A 160 39.888 8.834 51.804 1.00 0.00 ATOM 1244 C LYS A 160 38.934 8.624 52.546 1.00 0.00 ATOM 1245 N ASN A 161 38.479 7.379 52.849 1.00 0.00 ATOM 1246 CA ASN A 161 39.127 6.196 52.304 1.00 0.00 ATOM 1247 CB ASN A 161 40.050 5.551 53.324 1.00 0.00 ATOM 1248 CG ASN A 161 41.239 6.399 53.682 1.00 0.00 ATOM 1249 ND2 ASN A 161 41.232 6.901 54.889 1.00 0.00 ATOM 1250 OD1 ASN A 161 42.187 6.535 52.900 1.00 0.00 ATOM 1251 O ASN A 161 37.427 4.505 52.616 1.00 0.00 ATOM 1252 C ASN A 161 38.064 5.193 51.837 1.00 0.00 ATOM 1253 N THR A 162 37.833 5.118 50.468 1.00 0.00 ATOM 1254 CA THR A 162 36.832 4.241 49.940 1.00 0.00 ATOM 1255 CB THR A 162 36.818 4.362 48.392 1.00 0.00 ATOM 1256 CG2 THR A 162 35.670 3.603 47.762 1.00 0.00 ATOM 1257 OG1 THR A 162 36.671 5.752 48.066 1.00 0.00 ATOM 1258 O THR A 162 36.044 2.169 50.843 1.00 0.00 ATOM 1259 C THR A 162 37.000 2.770 50.358 1.00 0.00 ATOM 1260 N VAL A 163 38.174 2.217 50.062 1.00 0.00 ATOM 1261 CA VAL A 163 38.453 0.787 50.327 1.00 0.00 ATOM 1262 CB VAL A 163 39.914 0.424 49.997 1.00 0.00 ATOM 1263 CG1 VAL A 163 40.234 -0.986 50.469 1.00 0.00 ATOM 1264 CG2 VAL A 163 40.170 0.555 48.503 1.00 0.00 ATOM 1265 O VAL A 163 37.544 -0.585 52.075 1.00 0.00 ATOM 1266 C VAL A 163 38.170 0.440 51.800 1.00 0.00 ATOM 1267 N ASP A 164 38.604 1.312 52.698 1.00 0.00 ATOM 1268 CA ASP A 164 38.448 1.061 54.136 1.00 0.00 ATOM 1269 CB ASP A 164 39.174 2.132 54.954 1.00 0.00 ATOM 1270 CG ASP A 164 40.692 2.013 54.939 1.00 0.00 ATOM 1271 OD1 ASP A 164 41.185 0.997 54.508 1.00 0.00 ATOM 1272 OD2 ASP A 164 41.348 2.991 55.206 1.00 0.00 ATOM 1273 O ASP A 164 36.545 0.045 55.184 1.00 0.00 ATOM 1274 C ASP A 164 36.987 1.006 54.556 1.00 0.00 ATOM 1275 N THR A 165 36.222 1.930 53.983 1.00 0.00 ATOM 1276 CA THR A 165 34.771 1.987 54.242 1.00 0.00 ATOM 1277 CB THR A 165 34.144 3.295 53.754 1.00 0.00 ATOM 1278 CG2 THR A 165 32.676 3.334 54.182 1.00 0.00 ATOM 1279 OG1 THR A 165 34.851 4.418 54.300 1.00 0.00 ATOM 1280 O THR A 165 33.156 0.220 54.236 1.00 0.00 ATOM 1281 C THR A 165 34.028 0.811 53.600 1.00 0.00 ATOM 1282 N LEU A 166 34.397 0.477 52.367 1.00 0.00 ATOM 1283 CA LEU A 166 33.789 -0.647 51.642 1.00 0.00 ATOM 1284 CB LEU A 166 34.320 -0.623 50.163 1.00 0.00 ATOM 1285 CG LEU A 166 33.817 0.485 49.298 1.00 0.00 ATOM 1286 CD1 LEU A 166 34.611 0.509 47.978 1.00 0.00 ATOM 1287 CD2 LEU A 166 32.356 0.291 48.997 1.00 0.00 ATOM 1288 O LEU A 166 33.230 -2.838 52.430 1.00 0.00 ATOM 1289 C LEU A 166 34.083 -1.954 52.373 1.00 0.00 ATOM 1290 N ALA A 167 35.292 -2.069 52.895 1.00 0.00 ATOM 1291 CA ALA A 167 35.712 -3.259 53.635 1.00 0.00 ATOM 1292 CB ALA A 167 37.210 -3.163 53.936 1.00 0.00 ATOM 1293 O ALA A 167 34.481 -4.470 55.370 1.00 0.00 ATOM 1294 C ALA A 167 34.876 -3.405 54.920 1.00 0.00 ATOM 1295 N TYR A 168 34.493 -2.270 55.499 1.00 0.00 ATOM 1296 CA TYR A 168 33.590 -2.299 56.659 1.00 0.00 ATOM 1297 CB TYR A 168 33.356 -0.882 57.189 1.00 0.00 ATOM 1298 CG TYR A 168 32.432 -0.904 58.407 1.00 0.00 ATOM 1299 CD1 TYR A 168 32.935 -1.220 59.654 1.00 0.00 ATOM 1300 CD2 TYR A 168 31.099 -0.579 58.289 1.00 0.00 ATOM 1301 CE1 TYR A 168 32.134 -1.195 60.785 1.00 0.00 ATOM 1302 CE2 TYR A 168 30.289 -0.547 59.413 1.00 0.00 ATOM 1303 CZ TYR A 168 30.808 -0.859 60.669 1.00 0.00 ATOM 1304 OH TYR A 168 30.026 -0.845 61.767 1.00 0.00 ATOM 1305 O TYR A 168 31.872 -3.966 56.982 1.00 0.00 ATOM 1306 C TYR A 168 32.308 -3.051 56.283 1.00 0.00 ATOM 1307 N PHE A 169 31.722 -2.665 55.178 1.00 0.00 ATOM 1308 CA PHE A 169 30.488 -3.269 54.688 1.00 0.00 ATOM 1309 CB PHE A 169 29.942 -2.471 53.502 1.00 0.00 ATOM 1310 CG PHE A 169 29.651 -1.031 53.826 1.00 0.00 ATOM 1311 CD1 PHE A 169 29.880 -0.034 52.889 1.00 0.00 ATOM 1312 CD2 PHE A 169 29.147 -0.673 55.067 1.00 0.00 ATOM 1313 CE1 PHE A 169 29.612 1.289 53.184 1.00 0.00 ATOM 1314 CE2 PHE A 169 28.878 0.650 55.365 1.00 0.00 ATOM 1315 CZ PHE A 169 29.111 1.631 54.423 1.00 0.00 ATOM 1316 O PHE A 169 29.864 -5.593 54.613 1.00 0.00 ATOM 1317 C PHE A 169 30.700 -4.734 54.322 1.00 0.00 ATOM 1318 N ARG A 170 31.740 -4.980 53.547 1.00 0.00 ATOM 1319 CA ARG A 170 32.084 -6.321 53.107 1.00 0.00 ATOM 1320 CB ARG A 170 33.332 -6.328 52.232 1.00 0.00 ATOM 1321 CG ARG A 170 33.717 -7.691 51.682 1.00 0.00 ATOM 1322 CD ARG A 170 34.903 -7.678 50.788 1.00 0.00 ATOM 1323 NE ARG A 170 35.284 -8.982 50.275 1.00 0.00 ATOM 1324 CZ ARG A 170 36.337 -9.206 49.460 1.00 0.00 ATOM 1325 NH1 ARG A 170 37.086 -8.215 49.036 1.00 0.00 ATOM 1326 NH2 ARG A 170 36.578 -10.450 49.080 1.00 0.00 ATOM 1327 O ARG A 170 31.557 -8.307 54.280 1.00 0.00 ATOM 1328 C ARG A 170 32.218 -7.283 54.284 1.00 0.00 ATOM 1329 N ARG A 171 32.960 -6.889 55.316 1.00 0.00 ATOM 1330 CA ARG A 171 33.113 -7.731 56.521 1.00 0.00 ATOM 1331 CB ARG A 171 34.389 -7.204 57.271 1.00 0.00 ATOM 1332 CG ARG A 171 35.713 -7.470 56.586 1.00 0.00 ATOM 1333 CD ARG A 171 36.810 -6.690 57.274 1.00 0.00 ATOM 1334 NE ARG A 171 36.671 -5.258 57.024 1.00 0.00 ATOM 1335 CZ ARG A 171 37.128 -4.309 57.833 1.00 0.00 ATOM 1336 NH1 ARG A 171 37.753 -4.638 58.952 1.00 0.00 ATOM 1337 NH2 ARG A 171 36.965 -3.032 57.522 1.00 0.00 ATOM 1338 O ARG A 171 31.727 -8.786 58.153 1.00 0.00 ATOM 1339 C ARG A 171 31.802 -7.934 57.284 1.00 0.00 ATOM 1340 N GLN A 172 30.844 -7.049 57.029 1.00 0.00 ATOM 1341 CA GLN A 172 29.489 -7.121 57.634 1.00 0.00 ATOM 1342 CB GLN A 172 29.196 -5.775 58.308 1.00 0.00 ATOM 1343 CG GLN A 172 30.158 -5.436 59.370 1.00 0.00 ATOM 1344 CD GLN A 172 30.247 -6.492 60.464 1.00 0.00 ATOM 1345 OE1 GLN A 172 29.226 -6.762 61.156 1.00 0.00 ATOM 1346 NE2 GLN A 172 31.461 -7.084 60.660 1.00 0.00 ATOM 1347 O GLN A 172 27.411 -8.128 57.191 1.00 0.00 ATOM 1348 C GLN A 172 28.573 -8.011 56.785 1.00 0.00 ATOM 1349 N GLY A 173 29.047 -8.609 55.702 1.00 0.00 ATOM 1350 CA GLY A 173 28.229 -9.498 54.883 1.00 0.00 ATOM 1351 O GLY A 173 26.797 -9.439 52.977 1.00 0.00 ATOM 1352 C GLY A 173 27.581 -8.806 53.683 1.00 0.00 ATOM 1353 N ILE A 174 28.013 -7.593 53.368 1.00 0.00 ATOM 1354 CA ILE A 174 27.517 -6.868 52.194 1.00 0.00 ATOM 1355 CB ILE A 174 27.322 -5.360 52.513 1.00 0.00 ATOM 1356 CG1 ILE A 174 26.571 -5.175 53.831 1.00 0.00 ATOM 1357 CG2 ILE A 174 26.568 -4.664 51.379 1.00 0.00 ATOM 1358 CD1 ILE A 174 26.410 -3.717 54.237 1.00 0.00 ATOM 1359 O ILE A 174 29.471 -6.610 50.871 1.00 0.00 ATOM 1360 C ILE A 174 28.375 -7.164 50.941 1.00 0.00 ATOM 1361 N PRO A 175 27.750 -7.702 49.894 1.00 0.00 ATOM 1362 CA PRO A 175 28.387 -7.817 48.569 1.00 0.00 ATOM 1363 CB PRO A 175 27.424 -8.729 47.810 1.00 0.00 ATOM 1364 CG PRO A 175 26.873 -9.597 48.903 1.00 0.00 ATOM 1365 CD PRO A 175 26.599 -8.586 49.997 1.00 0.00 ATOM 1366 O PRO A 175 27.753 -5.566 47.896 1.00 0.00 ATOM 1367 C PRO A 175 28.635 -6.432 47.965 1.00 0.00 ATOM 1368 N VAL A 176 29.871 -6.260 47.536 1.00 0.00 ATOM 1369 CA VAL A 176 30.299 -5.012 46.882 1.00 0.00 ATOM 1370 CB VAL A 176 31.754 -4.657 47.248 1.00 0.00 ATOM 1371 CG1 VAL A 176 32.140 -3.316 46.644 1.00 0.00 ATOM 1372 CG2 VAL A 176 31.931 -4.630 48.757 1.00 0.00 ATOM 1373 O VAL A 176 30.903 -5.933 44.728 1.00 0.00 ATOM 1374 C VAL A 176 30.145 -5.197 45.363 1.00 0.00 ATOM 1375 N TYR A 177 29.217 -4.432 44.804 1.00 0.00 ATOM 1376 CA TYR A 177 28.970 -4.436 43.355 1.00 0.00 ATOM 1377 CB TYR A 177 27.480 -4.539 43.090 1.00 0.00 ATOM 1378 CG TYR A 177 26.798 -5.814 43.576 1.00 0.00 ATOM 1379 CD1 TYR A 177 26.609 -6.089 44.938 1.00 0.00 ATOM 1380 CD2 TYR A 177 26.282 -6.717 42.668 1.00 0.00 ATOM 1381 CE1 TYR A 177 25.962 -7.230 45.359 1.00 0.00 ATOM 1382 CE2 TYR A 177 25.635 -7.867 43.081 1.00 0.00 ATOM 1383 CZ TYR A 177 25.485 -8.120 44.423 1.00 0.00 ATOM 1384 OH TYR A 177 24.847 -9.255 44.847 1.00 0.00 ATOM 1385 O TYR A 177 28.862 -2.073 42.937 1.00 0.00 ATOM 1386 C TYR A 177 29.448 -3.126 42.715 1.00 0.00 ATOM 1387 N GLY A 178 30.494 -3.238 41.890 1.00 0.00 ATOM 1388 CA GLY A 178 31.112 -2.068 41.266 1.00 0.00 ATOM 1389 O GLY A 178 31.173 -3.030 39.050 1.00 0.00 ATOM 1390 C GLY A 178 30.960 -2.033 39.744 1.00 0.00 ATOM 1391 N ALA A 179 30.677 -0.832 39.249 1.00 0.00 ATOM 1392 CA ALA A 179 30.652 -0.548 37.810 1.00 0.00 ATOM 1393 CB ALA A 179 29.818 0.703 37.489 1.00 0.00 ATOM 1394 O ALA A 179 32.893 0.325 37.803 1.00 0.00 ATOM 1395 C ALA A 179 32.107 -0.509 37.342 1.00 0.00 ATOM 1396 N PHE A 180 32.455 -1.455 36.471 1.00 0.00 ATOM 1397 CA PHE A 180 33.824 -1.565 35.957 1.00 0.00 ATOM 1398 CB PHE A 180 34.600 -2.679 36.663 1.00 0.00 ATOM 1399 CG PHE A 180 36.082 -2.632 36.420 1.00 0.00 ATOM 1400 CD1 PHE A 180 36.821 -1.507 36.755 1.00 0.00 ATOM 1401 CD2 PHE A 180 36.741 -3.715 35.856 1.00 0.00 ATOM 1402 CE1 PHE A 180 38.184 -1.463 36.532 1.00 0.00 ATOM 1403 CE2 PHE A 180 38.103 -3.673 35.632 1.00 0.00 ATOM 1404 CZ PHE A 180 38.828 -2.546 35.971 1.00 0.00 ATOM 1405 O PHE A 180 33.172 -2.809 34.021 1.00 0.00 ATOM 1406 C PHE A 180 33.749 -1.805 34.448 1.00 0.00 ATOM 1407 N LEU A 181 34.232 -0.822 33.704 1.00 0.00 ATOM 1408 CA LEU A 181 34.238 -0.865 32.229 1.00 0.00 ATOM 1409 CB LEU A 181 34.441 0.543 31.656 1.00 0.00 ATOM 1410 CG LEU A 181 33.324 1.546 31.975 1.00 0.00 ATOM 1411 CD1 LEU A 181 33.670 2.911 31.402 1.00 0.00 ATOM 1412 CD2 LEU A 181 32.008 1.037 31.404 1.00 0.00 ATOM 1413 O LEU A 181 36.469 -1.410 31.519 1.00 0.00 ATOM 1414 C LEU A 181 35.322 -1.807 31.702 1.00 0.00 ATOM 1415 N ASP A 182 34.924 -3.061 31.569 1.00 0.00 ATOM 1416 CA ASP A 182 35.834 -4.105 31.074 1.00 0.00 ATOM 1417 CB ASP A 182 36.662 -4.617 32.242 1.00 0.00 ATOM 1418 CG ASP A 182 37.964 -5.276 31.805 1.00 0.00 ATOM 1419 OD1 ASP A 182 38.217 -5.200 30.586 1.00 0.00 ATOM 1420 OD2 ASP A 182 38.663 -5.792 32.700 1.00 0.00 ATOM 1421 O ASP A 182 33.951 -5.600 30.932 1.00 0.00 ATOM 1422 C ASP A 182 35.062 -5.283 30.492 1.00 0.00 ATOM 1423 N GLY A 183 35.711 -5.934 29.533 1.00 0.00 ATOM 1424 CA GLY A 183 35.241 -7.188 28.895 1.00 0.00 ATOM 1425 O GLY A 183 34.162 -9.125 29.837 1.00 0.00 ATOM 1426 C GLY A 183 35.049 -8.263 29.953 1.00 0.00 ATOM 1427 N GLN A 184 35.923 -8.236 31.041 1.00 0.00 ATOM 1428 CA GLN A 184 35.821 -9.216 32.092 1.00 0.00 ATOM 1429 CB GLN A 184 36.715 -8.837 33.285 1.00 0.00 ATOM 1430 CG GLN A 184 38.198 -8.718 32.943 1.00 0.00 ATOM 1431 CD GLN A 184 38.793 -10.017 32.408 1.00 0.00 ATOM 1432 OE1 GLN A 184 38.845 -11.032 33.111 1.00 0.00 ATOM 1433 NE2 GLN A 184 39.246 -9.989 31.155 1.00 0.00 ATOM 1434 O GLN A 184 34.115 -10.419 33.279 1.00 0.00 ATOM 1435 C GLN A 184 34.509 -9.324 32.875 1.00 0.00 ATOM 1436 N SER A 185 33.941 -8.184 33.143 1.00 0.00 ATOM 1437 CA SER A 185 32.688 -8.163 33.897 1.00 0.00 ATOM 1438 CB SER A 185 32.825 -7.240 35.088 1.00 0.00 ATOM 1439 OG SER A 185 33.354 -5.973 34.731 1.00 0.00 ATOM 1440 O SER A 185 31.125 -6.489 33.178 1.00 0.00 ATOM 1441 C SER A 185 31.675 -7.562 32.932 1.00 0.00 ATOM 1442 N LEU A 186 31.578 -8.279 31.806 1.00 0.00 ATOM 1443 CA LEU A 186 30.623 -7.857 30.791 1.00 0.00 ATOM 1444 CB LEU A 186 30.866 -8.382 29.472 1.00 0.00 ATOM 1445 CG LEU A 186 32.082 -7.749 28.815 1.00 0.00 ATOM 1446 CD1 LEU A 186 32.375 -8.503 27.459 1.00 0.00 ATOM 1447 CD2 LEU A 186 31.856 -6.264 28.591 1.00 0.00 ATOM 1448 O LEU A 186 28.251 -8.052 31.022 1.00 0.00 ATOM 1449 C LEU A 186 29.352 -8.241 31.544 1.00 0.00 ATOM 1450 N TYR A 187 29.577 -8.848 32.777 1.00 0.00 ATOM 1451 CA TYR A 187 28.420 -9.298 33.552 1.00 0.00 ATOM 1452 CB TYR A 187 28.882 -9.723 34.947 1.00 0.00 ATOM 1453 CG TYR A 187 29.708 -10.972 35.030 1.00 0.00 ATOM 1454 CD1 TYR A 187 31.078 -10.898 34.775 1.00 0.00 ATOM 1455 CD2 TYR A 187 29.159 -12.208 35.374 1.00 0.00 ATOM 1456 CE1 TYR A 187 31.871 -12.032 34.851 1.00 0.00 ATOM 1457 CE2 TYR A 187 29.942 -13.355 35.441 1.00 0.00 ATOM 1458 CZ TYR A 187 31.286 -13.249 35.164 1.00 0.00 ATOM 1459 OH TYR A 187 32.109 -14.338 35.209 1.00 0.00 ATOM 1460 O TYR A 187 27.607 -7.063 33.816 1.00 0.00 ATOM 1461 C TYR A 187 27.365 -8.190 33.421 1.00 0.00 ATOM 1462 N GLU A 188 26.300 -8.517 32.841 1.00 0.00 ATOM 1463 CA GLU A 188 25.246 -7.557 32.612 1.00 0.00 ATOM 1464 CB GLU A 188 24.166 -8.086 31.680 1.00 0.00 ATOM 1465 CG GLU A 188 23.437 -9.297 32.158 1.00 0.00 ATOM 1466 CD GLU A 188 22.516 -9.940 31.116 1.00 0.00 ATOM 1467 OE1 GLU A 188 21.830 -10.945 31.430 1.00 0.00 ATOM 1468 OE2 GLU A 188 22.428 -9.489 29.949 1.00 0.00 ATOM 1469 O GLU A 188 24.644 -8.234 34.861 1.00 0.00 ATOM 1470 C GLU A 188 24.705 -7.318 34.022 1.00 0.00 ATOM 1471 N ALA A 189 24.561 -6.045 34.324 1.00 0.00 ATOM 1472 CA ALA A 189 23.985 -5.581 35.595 1.00 0.00 ATOM 1473 CB ALA A 189 23.622 -4.085 35.429 1.00 0.00 ATOM 1474 O ALA A 189 22.379 -6.184 37.248 1.00 0.00 ATOM 1475 C ALA A 189 22.684 -6.275 36.059 1.00 0.00 ATOM 1476 N PRO A 190 21.884 -6.930 35.202 1.00 0.00 ATOM 1477 CA PRO A 190 20.739 -7.717 35.680 1.00 0.00 ATOM 1478 CB PRO A 190 19.792 -7.732 34.503 1.00 0.00 ATOM 1479 CG PRO A 190 20.703 -7.672 33.347 1.00 0.00 ATOM 1480 CD PRO A 190 21.735 -6.656 33.761 1.00 0.00 ATOM 1481 O PRO A 190 20.304 -9.687 36.991 1.00 0.00 ATOM 1482 C PRO A 190 21.108 -9.072 36.290 1.00 0.00 ATOM 1483 N LEU A 191 22.318 -9.584 36.064 1.00 0.00 ATOM 1484 CA LEU A 191 22.734 -10.862 36.620 1.00 0.00 ATOM 1485 CB LEU A 191 24.075 -11.288 36.004 1.00 0.00 ATOM 1486 CG LEU A 191 24.006 -11.730 34.539 1.00 0.00 ATOM 1487 CD1 LEU A 191 25.411 -11.966 33.998 1.00 0.00 ATOM 1488 CD2 LEU A 191 23.167 -12.994 34.424 1.00 0.00 ATOM 1489 O LEU A 191 22.965 -11.961 38.740 1.00 0.00 ATOM 1490 C LEU A 191 22.947 -10.890 38.129 1.00 0.00 ATOM 1491 N PRO A 192 23.140 -9.651 38.781 1.00 0.00 ATOM 1492 CA PRO A 192 23.380 -9.627 40.227 1.00 0.00 ATOM 1493 CB PRO A 192 23.968 -8.253 40.452 1.00 0.00 ATOM 1494 CG PRO A 192 24.686 -7.959 39.199 1.00 0.00 ATOM 1495 CD PRO A 192 23.837 -8.538 38.098 1.00 0.00 ATOM 1496 O PRO A 192 21.043 -9.112 40.581 1.00 0.00 ATOM 1497 C PRO A 192 22.060 -9.683 40.972 1.00 0.00 ATOM 1498 N ASN A 193 22.166 -10.265 42.147 1.00 0.00 ATOM 1499 CA ASN A 193 21.048 -10.383 43.074 1.00 0.00 ATOM 1500 CB ASN A 193 21.034 -11.745 43.745 1.00 0.00 ATOM 1501 CG ASN A 193 19.835 -11.974 44.625 1.00 0.00 ATOM 1502 ND2 ASN A 193 19.611 -13.218 44.962 1.00 0.00 ATOM 1503 OD1 ASN A 193 19.168 -11.027 45.055 1.00 0.00 ATOM 1504 O ASN A 193 21.776 -9.271 45.069 1.00 0.00 ATOM 1505 C ASN A 193 21.056 -9.237 44.071 1.00 0.00 ATOM 1506 N PHE A 194 20.297 -8.237 43.777 1.00 0.00 ATOM 1507 CA PHE A 194 20.285 -7.032 44.592 1.00 0.00 ATOM 1508 CB PHE A 194 19.874 -5.797 43.837 1.00 0.00 ATOM 1509 CG PHE A 194 20.839 -5.466 42.755 1.00 0.00 ATOM 1510 CD1 PHE A 194 22.006 -4.775 43.040 1.00 0.00 ATOM 1511 CD2 PHE A 194 20.626 -5.916 41.459 1.00 0.00 ATOM 1512 CE1 PHE A 194 22.962 -4.527 42.045 1.00 0.00 ATOM 1513 CE2 PHE A 194 21.562 -5.675 40.459 1.00 0.00 ATOM 1514 CZ PHE A 194 22.747 -4.980 40.756 1.00 0.00 ATOM 1515 O PHE A 194 19.560 -6.228 46.747 1.00 0.00 ATOM 1516 C PHE A 194 19.468 -7.096 45.886 1.00 0.00 ATOM 1517 N THR A 195 18.775 -8.208 46.084 1.00 0.00 ATOM 1518 CA THR A 195 17.896 -8.388 47.270 1.00 0.00 ATOM 1519 CB THR A 195 16.908 -9.551 47.071 1.00 0.00 ATOM 1520 CG2 THR A 195 16.036 -9.726 48.306 1.00 0.00 ATOM 1521 OG1 THR A 195 16.073 -9.286 45.937 1.00 0.00 ATOM 1522 O THR A 195 18.292 -8.188 49.647 1.00 0.00 ATOM 1523 C THR A 195 18.716 -8.572 48.563 1.00 0.00 ATOM 1524 N GLU A 196 19.870 -9.203 48.435 1.00 0.00 ATOM 1525 CA GLU A 196 20.768 -9.408 49.594 1.00 0.00 ATOM 1526 CB GLU A 196 22.004 -10.208 49.199 1.00 0.00 ATOM 1527 CG GLU A 196 21.550 -11.606 48.822 1.00 0.00 ATOM 1528 CD GLU A 196 20.865 -12.386 49.927 1.00 0.00 ATOM 1529 OE1 GLU A 196 20.811 -12.078 51.135 1.00 0.00 ATOM 1530 OE2 GLU A 196 20.278 -13.444 49.628 1.00 0.00 ATOM 1531 O GLU A 196 21.587 -7.218 49.068 1.00 0.00 ATOM 1532 C GLU A 196 21.492 -8.099 49.916 1.00 0.00 ATOM 1533 N PRO A 197 21.992 -8.002 51.211 1.00 0.00 ATOM 1534 CA PRO A 197 22.709 -6.782 51.608 1.00 0.00 ATOM 1535 CB PRO A 197 23.439 -7.255 52.850 1.00 0.00 ATOM 1536 CG PRO A 197 23.599 -8.717 52.722 1.00 0.00 ATOM 1537 CD PRO A 197 22.302 -9.172 52.073 1.00 0.00 ATOM 1538 O PRO A 197 24.118 -7.308 49.757 1.00 0.00 ATOM 1539 C PRO A 197 23.687 -6.421 50.479 1.00 0.00 ATOM 1540 N ALA A 198 23.655 -5.172 50.056 1.00 0.00 ATOM 1541 CA ALA A 198 24.436 -4.766 48.864 1.00 0.00 ATOM 1542 CB ALA A 198 23.652 -4.952 47.565 1.00 0.00 ATOM 1543 O ALA A 198 24.149 -2.432 49.363 1.00 0.00 ATOM 1544 C ALA A 198 24.898 -3.309 48.947 1.00 0.00 ATOM 1545 N ILE A 199 26.141 -3.114 48.522 1.00 0.00 ATOM 1546 CA ILE A 199 26.701 -1.756 48.392 1.00 0.00 ATOM 1547 CB ILE A 199 28.006 -1.537 49.195 1.00 0.00 ATOM 1548 CG1 ILE A 199 27.905 -1.952 50.647 1.00 0.00 ATOM 1549 CG2 ILE A 199 28.481 -0.082 49.138 1.00 0.00 ATOM 1550 CD1 ILE A 199 26.756 -1.431 51.492 1.00 0.00 ATOM 1551 O ILE A 199 27.854 -2.257 46.350 1.00 0.00 ATOM 1552 C ILE A 199 26.970 -1.593 46.913 1.00 0.00 ATOM 1553 N LEU A 200 26.236 -0.683 46.275 1.00 0.00 ATOM 1554 CA LEU A 200 26.386 -0.409 44.856 1.00 0.00 ATOM 1555 CB LEU A 200 25.039 -0.070 44.208 1.00 0.00 ATOM 1556 CG LEU A 200 25.106 0.314 42.724 1.00 0.00 ATOM 1557 CD1 LEU A 200 25.590 -0.870 41.899 1.00 0.00 ATOM 1558 CD2 LEU A 200 23.734 0.775 42.255 1.00 0.00 ATOM 1559 O LEU A 200 27.107 1.854 45.249 1.00 0.00 ATOM 1560 C LEU A 200 27.369 0.760 44.741 1.00 0.00 ATOM 1561 N VAL A 201 28.488 0.498 44.086 1.00 0.00 ATOM 1562 CA VAL A 201 29.528 1.533 43.888 1.00 0.00 ATOM 1563 CB VAL A 201 30.922 1.007 44.169 1.00 0.00 ATOM 1564 CG1 VAL A 201 31.912 2.103 44.015 1.00 0.00 ATOM 1565 CG2 VAL A 201 31.022 0.386 45.570 1.00 0.00 ATOM 1566 O VAL A 201 29.534 1.251 41.520 1.00 0.00 ATOM 1567 C VAL A 201 29.484 2.048 42.452 1.00 0.00 ATOM 1568 N LEU A 202 29.327 3.342 42.316 1.00 0.00 ATOM 1569 CA LEU A 202 29.288 3.965 40.993 1.00 0.00 ATOM 1570 CB LEU A 202 27.910 4.552 40.687 1.00 0.00 ATOM 1571 CG LEU A 202 26.894 3.427 40.699 1.00 0.00 ATOM 1572 CD1 LEU A 202 25.505 4.006 40.748 1.00 0.00 ATOM 1573 CD2 LEU A 202 27.035 2.535 39.477 1.00 0.00 ATOM 1574 O LEU A 202 30.616 5.573 42.124 1.00 0.00 ATOM 1575 C LEU A 202 30.315 5.089 41.035 1.00 0.00 ATOM 1576 N GLY A 203 30.710 5.560 39.876 1.00 0.00 ATOM 1577 CA GLY A 203 31.672 6.673 39.919 1.00 0.00 ATOM 1578 O GLY A 203 31.501 6.852 37.535 1.00 0.00 ATOM 1579 C GLY A 203 32.036 7.237 38.567 1.00 0.00 ATOM 1580 N SER A 204 32.996 8.125 38.664 1.00 0.00 ATOM 1581 CA SER A 204 33.514 8.835 37.485 1.00 0.00 ATOM 1582 CB SER A 204 33.234 10.318 37.620 1.00 0.00 ATOM 1583 OG SER A 204 31.863 10.588 37.735 1.00 0.00 ATOM 1584 O SER A 204 35.725 9.391 36.710 1.00 0.00 ATOM 1585 C SER A 204 35.017 8.608 37.315 1.00 0.00 ATOM 1586 N GLU A 205 35.529 7.472 37.761 1.00 0.00 ATOM 1587 CA GLU A 205 36.929 7.147 37.444 1.00 0.00 ATOM 1588 CB GLU A 205 37.461 6.145 38.465 1.00 0.00 ATOM 1589 CG GLU A 205 37.555 6.747 39.878 1.00 0.00 ATOM 1590 CD GLU A 205 38.531 7.922 40.011 1.00 0.00 ATOM 1591 OE1 GLU A 205 39.261 8.204 39.029 1.00 0.00 ATOM 1592 OE2 GLU A 205 38.463 8.628 41.032 1.00 0.00 ATOM 1593 O GLU A 205 35.888 6.347 35.428 1.00 0.00 ATOM 1594 C GLU A 205 36.946 6.634 36.005 1.00 0.00 ATOM 1595 N GLY A 206 38.138 6.446 35.454 1.00 0.00 ATOM 1596 CA GLY A 206 38.340 5.988 34.058 1.00 0.00 ATOM 1597 O GLY A 206 36.714 4.901 32.621 1.00 0.00 ATOM 1598 C GLY A 206 37.388 4.838 33.648 1.00 0.00 ATOM 1599 N ARG A 207 37.399 3.777 34.570 1.00 0.00 ATOM 1600 CA ARG A 207 36.551 2.600 34.327 1.00 0.00 ATOM 1601 CB ARG A 207 37.328 1.296 34.446 1.00 0.00 ATOM 1602 CG ARG A 207 38.391 1.087 33.380 1.00 0.00 ATOM 1603 CD ARG A 207 39.090 -0.220 33.459 1.00 0.00 ATOM 1604 NE ARG A 207 40.256 -0.334 32.597 1.00 0.00 ATOM 1605 CZ ARG A 207 40.210 -0.617 31.280 1.00 0.00 ATOM 1606 NH1 ARG A 207 39.065 -0.856 30.679 1.00 0.00 ATOM 1607 NH2 ARG A 207 41.349 -0.676 30.614 1.00 0.00 ATOM 1608 O ARG A 207 34.757 1.398 35.364 1.00 0.00 ATOM 1609 C ARG A 207 35.290 2.493 35.206 1.00 0.00 ATOM 1610 N GLY A 208 34.765 3.629 35.689 1.00 0.00 ATOM 1611 CA GLY A 208 33.541 3.650 36.520 1.00 0.00 ATOM 1612 O GLY A 208 34.028 5.138 38.349 1.00 0.00 ATOM 1613 C GLY A 208 33.942 3.973 37.955 1.00 0.00 ATOM 1614 N ILE A 209 34.287 2.916 38.673 1.00 0.00 ATOM 1615 CA ILE A 209 34.865 3.046 40.025 1.00 0.00 ATOM 1616 CB ILE A 209 34.402 1.905 40.950 1.00 0.00 ATOM 1617 CG1 ILE A 209 34.889 0.555 40.419 1.00 0.00 ATOM 1618 CG2 ILE A 209 32.887 1.910 41.082 1.00 0.00 ATOM 1619 CD1 ILE A 209 34.543 -0.615 41.314 1.00 0.00 ATOM 1620 O ILE A 209 36.915 2.691 38.804 1.00 0.00 ATOM 1621 C ILE A 209 36.404 3.048 39.872 1.00 0.00 ATOM 1622 N SER A 210 37.078 3.414 40.950 1.00 0.00 ATOM 1623 CA SER A 210 38.551 3.398 40.959 1.00 0.00 ATOM 1624 CB SER A 210 39.074 4.168 42.155 1.00 0.00 ATOM 1625 OG SER A 210 38.952 3.437 43.345 1.00 0.00 ATOM 1626 O SER A 210 38.359 1.065 41.484 1.00 0.00 ATOM 1627 C SER A 210 39.074 1.968 41.046 1.00 0.00 ATOM 1628 N PRO A 211 40.358 1.714 40.610 1.00 0.00 ATOM 1629 CA PRO A 211 40.947 0.373 40.665 1.00 0.00 ATOM 1630 CB PRO A 211 42.259 0.510 39.923 1.00 0.00 ATOM 1631 CG PRO A 211 42.042 1.708 38.966 1.00 0.00 ATOM 1632 CD PRO A 211 41.088 2.604 39.642 1.00 0.00 ATOM 1633 O PRO A 211 40.791 -1.280 42.382 1.00 0.00 ATOM 1634 C PRO A 211 41.020 -0.098 42.123 1.00 0.00 ATOM 1635 N GLU A 212 41.236 0.853 43.037 1.00 0.00 ATOM 1636 CA GLU A 212 41.273 0.558 44.478 1.00 0.00 ATOM 1637 CB GLU A 212 41.601 1.820 45.278 1.00 0.00 ATOM 1638 CG GLU A 212 43.030 2.319 45.106 1.00 0.00 ATOM 1639 CD GLU A 212 43.240 3.626 45.819 1.00 0.00 ATOM 1640 OE1 GLU A 212 42.294 4.149 46.355 1.00 0.00 ATOM 1641 OE2 GLU A 212 44.368 4.046 45.923 1.00 0.00 ATOM 1642 O GLU A 212 39.976 -1.069 45.651 1.00 0.00 ATOM 1643 C GLU A 212 39.954 -0.053 44.975 1.00 0.00 ATOM 1644 N VAL A 213 38.849 0.498 44.486 1.00 0.00 ATOM 1645 CA VAL A 213 37.501 -0.016 44.824 1.00 0.00 ATOM 1646 CB VAL A 213 36.394 0.956 44.365 1.00 0.00 ATOM 1647 CG1 VAL A 213 35.022 0.331 44.561 1.00 0.00 ATOM 1648 CG2 VAL A 213 36.492 2.268 45.123 1.00 0.00 ATOM 1649 O VAL A 213 36.597 -2.237 44.760 1.00 0.00 ATOM 1650 C VAL A 213 37.190 -1.348 44.144 1.00 0.00 ATOM 1651 N ALA A 214 37.522 -1.480 42.868 1.00 0.00 ATOM 1652 CA ALA A 214 37.268 -2.728 42.151 1.00 0.00 ATOM 1653 CB ALA A 214 37.612 -2.574 40.664 1.00 0.00 ATOM 1654 O ALA A 214 37.533 -5.053 42.699 1.00 0.00 ATOM 1655 C ALA A 214 38.008 -3.919 42.761 1.00 0.00 ATOM 1656 N ALA A 215 39.181 -3.649 43.365 1.00 0.00 ATOM 1657 CA ALA A 215 39.985 -4.705 43.976 1.00 0.00 ATOM 1658 CB ALA A 215 41.283 -4.098 44.502 1.00 0.00 ATOM 1659 O ALA A 215 39.598 -6.594 45.400 1.00 0.00 ATOM 1660 C ALA A 215 39.284 -5.439 45.116 1.00 0.00 ATOM 1661 N GLU A 216 38.302 -4.816 45.759 1.00 0.00 ATOM 1662 CA GLU A 216 37.565 -5.418 46.871 1.00 0.00 ATOM 1663 CB GLU A 216 37.518 -4.449 48.056 1.00 0.00 ATOM 1664 CG GLU A 216 38.885 -4.031 48.583 1.00 0.00 ATOM 1665 CD GLU A 216 39.673 -5.219 49.056 1.00 0.00 ATOM 1666 OE1 GLU A 216 39.134 -6.014 49.788 1.00 0.00 ATOM 1667 OE2 GLU A 216 40.778 -5.394 48.600 1.00 0.00 ATOM 1668 O GLU A 216 35.347 -6.218 47.424 1.00 0.00 ATOM 1669 C GLU A 216 36.116 -5.807 46.560 1.00 0.00 ATOM 1670 N ILE A 217 35.732 -5.605 45.305 1.00 0.00 ATOM 1671 CA ILE A 217 34.347 -5.878 44.883 1.00 0.00 ATOM 1672 CB ILE A 217 34.021 -5.182 43.561 1.00 0.00 ATOM 1673 CG1 ILE A 217 34.838 -5.807 42.426 1.00 0.00 ATOM 1674 CG2 ILE A 217 34.123 -3.656 43.737 1.00 0.00 ATOM 1675 CD1 ILE A 217 34.610 -4.984 41.174 1.00 0.00 ATOM 1676 O ILE A 217 34.971 -8.174 44.425 1.00 0.00 ATOM 1677 C ILE A 217 34.104 -7.391 44.808 1.00 0.00 ATOM 1678 N THR A 218 32.857 -7.727 45.035 1.00 0.00 ATOM 1679 CA THR A 218 32.354 -9.108 44.897 1.00 0.00 ATOM 1680 CB THR A 218 31.422 -9.336 46.150 1.00 0.00 ATOM 1681 CG2 THR A 218 30.907 -10.768 46.237 1.00 0.00 ATOM 1682 OG1 THR A 218 32.145 -9.136 47.382 1.00 0.00 ATOM 1683 O THR A 218 31.892 -10.496 43.040 1.00 0.00 ATOM 1684 C THR A 218 31.816 -9.362 43.503 1.00 0.00 ATOM 1685 N ASP A 219 31.321 -8.284 42.913 1.00 0.00 ATOM 1686 CA ASP A 219 30.971 -8.263 41.496 1.00 0.00 ATOM 1687 CB ASP A 219 29.473 -8.504 41.281 1.00 0.00 ATOM 1688 CG ASP A 219 29.004 -9.906 41.646 1.00 0.00 ATOM 1689 OD1 ASP A 219 29.405 -10.835 40.985 1.00 0.00 ATOM 1690 OD2 ASP A 219 28.377 -10.055 42.668 1.00 0.00 ATOM 1691 O ASP A 219 31.377 -5.911 41.305 1.00 0.00 ATOM 1692 C ASP A 219 31.337 -7.018 40.752 1.00 0.00 ATOM 1693 N ARG A 220 31.720 -7.292 39.512 1.00 0.00 ATOM 1694 CA ARG A 220 32.126 -6.246 38.549 1.00 0.00 ATOM 1695 CB ARG A 220 33.549 -6.442 38.045 1.00 0.00 ATOM 1696 CG ARG A 220 33.839 -7.817 37.466 1.00 0.00 ATOM 1697 CD ARG A 220 35.269 -8.055 37.134 1.00 0.00 ATOM 1698 NE ARG A 220 36.140 -8.188 38.291 1.00 0.00 ATOM 1699 CZ ARG A 220 37.486 -8.210 38.236 1.00 0.00 ATOM 1700 NH1 ARG A 220 38.118 -8.146 37.086 1.00 0.00 ATOM 1701 NH2 ARG A 220 38.155 -8.322 39.369 1.00 0.00 ATOM 1702 O ARG A 220 30.713 -7.386 36.992 1.00 0.00 ATOM 1703 C ARG A 220 31.020 -6.318 37.517 1.00 0.00 ATOM 1704 N LEU A 221 30.353 -5.152 37.283 1.00 0.00 ATOM 1705 CA LEU A 221 29.244 -5.091 36.354 1.00 0.00 ATOM 1706 CB LEU A 221 27.905 -4.854 37.061 1.00 0.00 ATOM 1707 CG LEU A 221 27.601 -5.810 38.221 1.00 0.00 ATOM 1708 CD1 LEU A 221 26.416 -5.295 39.027 1.00 0.00 ATOM 1709 CD2 LEU A 221 27.316 -7.200 37.675 1.00 0.00 ATOM 1710 O LEU A 221 30.095 -3.013 35.430 1.00 0.00 ATOM 1711 C LEU A 221 29.402 -4.027 35.268 1.00 0.00 ATOM 1712 N THR A 222 28.742 -4.334 34.170 1.00 0.00 ATOM 1713 CA THR A 222 28.597 -3.424 33.023 1.00 0.00 ATOM 1714 CB THR A 222 29.545 -3.812 31.872 1.00 0.00 ATOM 1715 CG2 THR A 222 30.989 -3.812 32.349 1.00 0.00 ATOM 1716 OG1 THR A 222 29.204 -5.117 31.388 1.00 0.00 ATOM 1717 O THR A 222 26.420 -4.437 32.767 1.00 0.00 ATOM 1718 C THR A 222 27.143 -3.466 32.550 1.00 0.00 ATOM 1719 N ILE A 223 26.747 -2.432 31.839 1.00 0.00 ATOM 1720 CA ILE A 223 25.442 -2.344 31.183 1.00 0.00 ATOM 1721 CB ILE A 223 24.733 -0.994 31.485 1.00 0.00 ATOM 1722 CG1 ILE A 223 24.542 -0.794 32.997 1.00 0.00 ATOM 1723 CG2 ILE A 223 23.392 -0.879 30.743 1.00 0.00 ATOM 1724 CD1 ILE A 223 24.193 0.652 33.377 1.00 0.00 ATOM 1725 O ILE A 223 26.640 -1.876 29.153 1.00 0.00 ATOM 1726 C ILE A 223 25.733 -2.523 29.692 1.00 0.00 ATOM 1727 N PRO A 224 24.998 -3.414 29.021 1.00 0.00 ATOM 1728 CA PRO A 224 25.221 -3.706 27.595 1.00 0.00 ATOM 1729 CB PRO A 224 24.116 -4.690 27.205 1.00 0.00 ATOM 1730 CG PRO A 224 23.851 -5.435 28.522 1.00 0.00 ATOM 1731 CD PRO A 224 23.999 -4.349 29.582 1.00 0.00 ATOM 1732 O PRO A 224 24.319 -1.522 27.036 1.00 0.00 ATOM 1733 C PRO A 224 25.150 -2.393 26.791 1.00 0.00 ATOM 1734 N ALA A 225 25.977 -2.331 25.755 1.00 0.00 ATOM 1735 CA ALA A 225 26.092 -1.134 24.899 1.00 0.00 ATOM 1736 CB ALA A 225 27.059 -1.444 23.791 1.00 0.00 ATOM 1737 O ALA A 225 24.469 0.436 24.058 1.00 0.00 ATOM 1738 C ALA A 225 24.781 -0.744 24.198 1.00 0.00 ATOM 1739 N SER A 226 24.017 -1.763 23.823 1.00 0.00 ATOM 1740 CA SER A 226 22.793 -1.593 23.019 1.00 0.00 ATOM 1741 CB SER A 226 22.211 -2.947 22.660 1.00 0.00 ATOM 1742 OG SER A 226 21.770 -3.648 23.791 1.00 0.00 ATOM 1743 O SER A 226 20.973 -0.062 23.101 1.00 0.00 ATOM 1744 C SER A 226 21.734 -0.757 23.749 1.00 0.00 ATOM 1745 N GLY A 227 21.733 -0.909 25.069 1.00 0.00 ATOM 1746 CA GLY A 227 20.746 -0.298 25.966 1.00 0.00 ATOM 1747 O GLY A 227 20.618 1.031 27.966 1.00 0.00 ATOM 1748 C GLY A 227 21.345 0.644 27.029 1.00 0.00 ATOM 1749 N LEU A 228 22.583 1.013 26.912 1.00 0.00 ATOM 1750 CA LEU A 228 23.240 1.925 27.817 1.00 0.00 ATOM 1751 CB LEU A 228 24.704 2.069 27.417 1.00 0.00 ATOM 1752 CG LEU A 228 25.600 3.011 28.229 1.00 0.00 ATOM 1753 CD1 LEU A 228 25.687 2.530 29.667 1.00 0.00 ATOM 1754 CD2 LEU A 228 26.990 3.064 27.595 1.00 0.00 ATOM 1755 O LEU A 228 22.384 3.773 26.581 1.00 0.00 ATOM 1756 C LEU A 228 22.537 3.267 27.688 1.00 0.00 ATOM 1757 N SER A 229 22.009 3.688 28.839 1.00 0.00 ATOM 1758 CA SER A 229 21.348 4.988 29.027 1.00 0.00 ATOM 1759 CB SER A 229 22.250 6.123 28.450 1.00 0.00 ATOM 1760 OG SER A 229 23.543 6.078 29.003 1.00 0.00 ATOM 1761 O SER A 229 19.520 6.383 28.231 1.00 0.00 ATOM 1762 C SER A 229 20.042 5.267 28.309 1.00 0.00 ATOM 1763 N VAL A 230 19.490 4.166 27.856 1.00 0.00 ATOM 1764 CA VAL A 230 18.241 4.211 27.090 1.00 0.00 ATOM 1765 CB VAL A 230 18.407 3.646 25.662 1.00 0.00 ATOM 1766 CG1 VAL A 230 19.460 4.447 24.914 1.00 0.00 ATOM 1767 CG2 VAL A 230 18.785 2.170 25.705 1.00 0.00 ATOM 1768 O VAL A 230 15.957 3.503 27.319 1.00 0.00 ATOM 1769 C VAL A 230 17.062 3.607 27.852 1.00 0.00 ATOM 1770 N LYS A 231 17.379 2.996 28.994 1.00 0.00 ATOM 1771 CA LYS A 231 16.419 2.187 29.763 1.00 0.00 ATOM 1772 CB LYS A 231 16.792 0.691 29.583 1.00 0.00 ATOM 1773 CG LYS A 231 16.648 0.162 28.168 1.00 0.00 ATOM 1774 CD LYS A 231 16.421 -1.341 28.166 1.00 0.00 ATOM 1775 CE LYS A 231 17.027 -2.005 26.934 1.00 0.00 ATOM 1776 NZ LYS A 231 17.420 -3.422 27.210 1.00 0.00 ATOM 1777 O LYS A 231 15.454 2.036 31.958 1.00 0.00 ATOM 1778 C LYS A 231 16.142 2.697 31.187 1.00 0.00 ATOM 1779 N GLY A 232 16.700 3.849 31.528 1.00 0.00 ATOM 1780 CA GLY A 232 16.532 4.400 32.882 1.00 0.00 ATOM 1781 O GLY A 232 15.309 6.196 31.813 1.00 0.00 ATOM 1782 C GLY A 232 15.842 5.752 32.824 1.00 0.00 ATOM 1783 N HIS A 233 15.919 6.398 33.973 1.00 0.00 ATOM 1784 CA HIS A 233 15.330 7.721 34.203 1.00 0.00 ATOM 1785 CB HIS A 233 15.537 7.906 35.697 1.00 0.00 ATOM 1786 CG HIS A 233 14.545 7.073 36.531 1.00 0.00 ATOM 1787 CD2 HIS A 233 14.842 6.390 37.626 1.00 0.00 ATOM 1788 ND1 HIS A 233 13.207 7.045 36.401 1.00 0.00 ATOM 1789 CE1 HIS A 233 12.708 6.416 37.461 1.00 0.00 ATOM 1790 NE2 HIS A 233 13.718 5.975 38.193 1.00 0.00 ATOM 1791 O HIS A 233 15.155 9.675 32.791 1.00 0.00 ATOM 1792 C HIS A 233 15.899 8.878 33.352 1.00 0.00 ATOM 1793 N THR A 234 17.289 8.934 33.368 1.00 0.00 ATOM 1794 CA THR A 234 18.023 10.000 32.661 1.00 0.00 ATOM 1795 CB THR A 234 19.543 9.871 32.862 1.00 0.00 ATOM 1796 CG2 THR A 234 20.261 11.077 32.282 1.00 0.00 ATOM 1797 OG1 THR A 234 19.835 9.771 34.262 1.00 0.00 ATOM 1798 O THR A 234 17.833 8.830 30.537 1.00 0.00 ATOM 1799 C THR A 234 17.707 9.877 31.176 1.00 0.00 ATOM 1800 N GLU A 235 17.402 11.045 30.662 1.00 0.00 ATOM 1801 CA GLU A 235 17.089 11.217 29.235 1.00 0.00 ATOM 1802 CB GLU A 235 16.351 12.539 29.020 1.00 0.00 ATOM 1803 CG GLU A 235 14.985 12.613 29.689 1.00 0.00 ATOM 1804 CD GLU A 235 14.344 13.955 29.474 1.00 0.00 ATOM 1805 OE1 GLU A 235 14.942 14.782 28.825 1.00 0.00 ATOM 1806 OE2 GLU A 235 13.211 14.121 29.861 1.00 0.00 ATOM 1807 O GLU A 235 18.149 10.801 27.125 1.00 0.00 ATOM 1808 C GLU A 235 18.307 11.107 28.309 1.00 0.00 ATOM 1809 N SER A 236 19.496 11.394 28.891 1.00 0.00 ATOM 1810 CA SER A 236 20.749 11.429 28.140 1.00 0.00 ATOM 1811 CB SER A 236 21.393 12.818 28.237 1.00 0.00 ATOM 1812 OG SER A 236 21.859 13.131 29.511 1.00 0.00 ATOM 1813 O SER A 236 21.576 10.110 29.963 1.00 0.00 ATOM 1814 C SER A 236 21.680 10.427 28.771 1.00 0.00 ATOM 1815 N LEU A 237 22.679 9.890 28.023 1.00 0.00 ATOM 1816 CA LEU A 237 23.661 8.964 28.530 1.00 0.00 ATOM 1817 CB LEU A 237 24.807 8.833 27.520 1.00 0.00 ATOM 1818 CG LEU A 237 24.542 7.877 26.350 1.00 0.00 ATOM 1819 CD1 LEU A 237 23.154 8.130 25.773 1.00 0.00 ATOM 1820 CD2 LEU A 237 25.611 8.067 25.282 1.00 0.00 ATOM 1821 O LEU A 237 25.099 10.777 29.129 1.00 0.00 ATOM 1822 C LEU A 237 24.526 9.755 29.497 1.00 0.00 ATOM 1823 N ASN A 238 24.660 9.256 30.805 1.00 0.00 ATOM 1824 CA ASN A 238 25.563 9.797 31.827 1.00 0.00 ATOM 1825 CB ASN A 238 25.174 11.200 32.300 1.00 0.00 ATOM 1826 CG ASN A 238 23.817 11.281 32.982 1.00 0.00 ATOM 1827 ND2 ASN A 238 23.238 12.480 32.976 1.00 0.00 ATOM 1828 OD1 ASN A 238 23.307 10.302 33.525 1.00 0.00 ATOM 1829 O ASN A 238 24.844 7.816 32.972 1.00 0.00 ATOM 1830 C ASN A 238 25.593 8.794 32.976 1.00 0.00 ATOM 1831 N VAL A 239 26.502 9.063 33.918 1.00 0.00 ATOM 1832 CA VAL A 239 26.649 8.170 35.060 1.00 0.00 ATOM 1833 CB VAL A 239 27.803 8.530 36.053 1.00 0.00 ATOM 1834 CG1 VAL A 239 29.110 8.382 35.310 1.00 0.00 ATOM 1835 CG2 VAL A 239 27.700 9.925 36.586 1.00 0.00 ATOM 1836 O VAL A 239 25.015 7.023 36.397 1.00 0.00 ATOM 1837 C VAL A 239 25.370 8.097 35.877 1.00 0.00 ATOM 1838 N ALA A 240 24.637 9.205 35.969 1.00 0.00 ATOM 1839 CA ALA A 240 23.395 9.173 36.698 1.00 0.00 ATOM 1840 CB ALA A 240 22.831 10.587 36.874 1.00 0.00 ATOM 1841 O ALA A 240 21.733 7.467 36.632 1.00 0.00 ATOM 1842 C ALA A 240 22.412 8.261 35.992 1.00 0.00 ATOM 1843 N ILE A 241 22.426 8.273 34.653 1.00 0.00 ATOM 1844 CA ILE A 241 21.587 7.331 33.884 1.00 0.00 ATOM 1845 CB ILE A 241 21.630 7.559 32.369 1.00 0.00 ATOM 1846 CG1 ILE A 241 20.638 6.685 31.588 1.00 0.00 ATOM 1847 CG2 ILE A 241 22.957 7.107 31.819 1.00 0.00 ATOM 1848 CD1 ILE A 241 19.179 6.587 32.011 1.00 0.00 ATOM 1849 O ILE A 241 20.976 5.047 34.370 1.00 0.00 ATOM 1850 C ILE A 241 21.892 5.857 34.175 1.00 0.00 ATOM 1851 N ALA A 242 23.179 5.534 34.194 1.00 0.00 ATOM 1852 CA ALA A 242 23.607 4.165 34.464 1.00 0.00 ATOM 1853 CB ALA A 242 25.122 4.044 34.369 1.00 0.00 ATOM 1854 O ALA A 242 22.745 2.642 36.134 1.00 0.00 ATOM 1855 C ALA A 242 23.167 3.788 35.894 1.00 0.00 ATOM 1856 N THR A 243 23.281 4.735 36.844 1.00 0.00 ATOM 1857 CA THR A 243 22.830 4.469 38.183 1.00 0.00 ATOM 1858 CB THR A 243 22.983 5.721 39.069 1.00 0.00 ATOM 1859 CG2 THR A 243 22.781 5.369 40.497 1.00 0.00 ATOM 1860 OG1 THR A 243 24.335 6.193 38.888 1.00 0.00 ATOM 1861 O THR A 243 20.949 3.152 38.848 1.00 0.00 ATOM 1862 C THR A 243 21.346 4.126 38.208 1.00 0.00 ATOM 1863 N ALA A 244 20.560 4.901 37.488 1.00 0.00 ATOM 1864 CA ALA A 244 19.116 4.634 37.478 1.00 0.00 ATOM 1865 CB ALA A 244 18.402 5.728 36.734 1.00 0.00 ATOM 1866 O ALA A 244 17.881 2.628 37.316 1.00 0.00 ATOM 1867 C ALA A 244 18.740 3.326 36.803 1.00 0.00 ATOM 1868 N ILE A 245 19.421 3.006 35.694 1.00 0.00 ATOM 1869 CA ILE A 245 19.197 1.737 34.988 1.00 0.00 ATOM 1870 CB ILE A 245 20.094 1.616 33.743 1.00 0.00 ATOM 1871 CG1 ILE A 245 19.683 2.647 32.687 1.00 0.00 ATOM 1872 CG2 ILE A 245 20.029 0.209 33.173 1.00 0.00 ATOM 1873 CD1 ILE A 245 20.669 2.784 31.552 1.00 0.00 ATOM 1874 O ILE A 245 18.613 -0.338 36.039 1.00 0.00 ATOM 1875 C ILE A 245 19.456 0.550 35.935 1.00 0.00 ATOM 1876 N LEU A 246 20.592 0.602 36.608 1.00 0.00 ATOM 1877 CA LEU A 246 20.984 -0.484 37.529 1.00 0.00 ATOM 1878 CB LEU A 246 22.320 -0.194 38.145 1.00 0.00 ATOM 1879 CG LEU A 246 23.055 -1.324 38.857 1.00 0.00 ATOM 1880 CD1 LEU A 246 22.883 -2.650 38.119 1.00 0.00 ATOM 1881 CD2 LEU A 246 24.511 -0.938 38.951 1.00 0.00 ATOM 1882 O LEU A 246 19.623 -1.616 39.143 1.00 0.00 ATOM 1883 C LEU A 246 20.057 -0.538 38.741 1.00 0.00 ATOM 1884 N CYS A 247 19.750 0.603 39.338 1.00 0.00 ATOM 1885 CA CYS A 247 18.876 0.645 40.504 1.00 0.00 ATOM 1886 CB CYS A 247 18.864 2.046 41.088 1.00 0.00 ATOM 1887 SG CYS A 247 20.470 2.493 41.849 1.00 0.00 ATOM 1888 O CYS A 247 16.804 -0.465 40.996 1.00 0.00 ATOM 1889 C CYS A 247 17.463 0.170 40.169 1.00 0.00 ATOM 1890 N SER A 248 16.992 0.437 38.934 1.00 0.00 ATOM 1891 CA SER A 248 15.661 0.003 38.525 1.00 0.00 ATOM 1892 CB SER A 248 15.129 0.798 37.256 1.00 0.00 ATOM 1893 OG SER A 248 15.959 0.659 36.094 1.00 0.00 ATOM 1894 O SER A 248 14.611 -2.143 38.585 1.00 0.00 ATOM 1895 C SER A 248 15.629 -1.502 38.321 1.00 0.00 ATOM 1896 N GLU A 249 16.774 -2.042 37.922 1.00 0.00 ATOM 1897 CA GLU A 249 16.960 -3.499 37.833 1.00 0.00 ATOM 1898 CB GLU A 249 18.311 -3.911 37.360 1.00 0.00 ATOM 1899 CG GLU A 249 18.386 -3.946 35.830 1.00 0.00 ATOM 1900 CD GLU A 249 19.793 -3.789 35.286 1.00 0.00 ATOM 1901 OE1 GLU A 249 20.783 -3.660 36.063 1.00 0.00 ATOM 1902 OE2 GLU A 249 19.931 -3.790 34.039 1.00 0.00 ATOM 1903 O GLU A 249 16.090 -5.103 39.411 1.00 0.00 ATOM 1904 C GLU A 249 16.805 -4.111 39.234 1.00 0.00 ATOM 1905 N TRP A 250 17.337 -3.416 40.239 1.00 0.00 ATOM 1906 CA TRP A 250 17.173 -3.770 41.662 1.00 0.00 ATOM 1907 CB TRP A 250 17.975 -2.816 42.546 1.00 0.00 ATOM 1908 CG TRP A 250 17.723 -3.003 44.013 1.00 0.00 ATOM 1909 CD1 TRP A 250 18.451 -3.772 44.872 1.00 0.00 ATOM 1910 CD2 TRP A 250 16.676 -2.412 44.790 1.00 0.00 ATOM 1911 CE2 TRP A 250 16.830 -2.865 46.113 1.00 0.00 ATOM 1912 CE3 TRP A 250 15.621 -1.538 44.495 1.00 0.00 ATOM 1913 NE1 TRP A 250 17.922 -3.698 46.135 1.00 0.00 ATOM 1914 CZ2 TRP A 250 15.975 -2.487 47.132 1.00 0.00 ATOM 1915 CZ3 TRP A 250 14.764 -1.158 45.520 1.00 0.00 ATOM 1916 CH2 TRP A 250 14.937 -1.616 46.800 1.00 0.00 ATOM 1917 O TRP A 250 15.243 -4.696 42.726 1.00 0.00 ATOM 1918 C TRP A 250 15.709 -3.756 42.099 1.00 0.00 ATOM 1919 N ARG A 251 15.029 -2.716 41.642 1.00 0.00 ATOM 1920 CA ARG A 251 13.602 -2.535 41.916 1.00 0.00 ATOM 1921 CB ARG A 251 13.108 -1.159 41.493 1.00 0.00 ATOM 1922 CG ARG A 251 11.647 -0.880 41.814 1.00 0.00 ATOM 1923 CD ARG A 251 11.076 0.284 41.090 1.00 0.00 ATOM 1924 NE ARG A 251 10.990 0.117 39.648 1.00 0.00 ATOM 1925 CZ ARG A 251 10.045 -0.603 39.014 1.00 0.00 ATOM 1926 NH1 ARG A 251 9.122 -1.254 39.690 1.00 0.00 ATOM 1927 NH2 ARG A 251 10.081 -0.657 37.695 1.00 0.00 ATOM 1928 O ARG A 251 11.785 -4.082 41.863 1.00 0.00 ATOM 1929 C ARG A 251 12.759 -3.608 41.272 1.00 0.00 ATOM 1930 N ARG A 252 13.129 -3.998 40.035 1.00 0.00 ATOM 1931 CA ARG A 252 12.388 -5.071 39.339 1.00 0.00 ATOM 1932 CB ARG A 252 12.840 -5.223 37.920 1.00 0.00 ATOM 1933 CG ARG A 252 12.276 -6.451 37.207 1.00 0.00 ATOM 1934 CD ARG A 252 12.645 -6.427 35.726 1.00 0.00 ATOM 1935 NE ARG A 252 14.086 -6.310 35.530 1.00 0.00 ATOM 1936 CZ ARG A 252 14.947 -7.318 35.633 1.00 0.00 ATOM 1937 NH1 ARG A 252 16.241 -7.104 35.442 1.00 0.00 ATOM 1938 NH2 ARG A 252 14.514 -8.542 35.903 1.00 0.00 ATOM 1939 O ARG A 252 11.615 -7.068 40.358 1.00 0.00 ATOM 1940 C ARG A 252 12.571 -6.359 40.122 1.00 0.00 ATOM 1941 N ARG A 253 13.793 -6.647 40.604 1.00 0.00 ATOM 1942 CA ARG A 253 14.099 -7.915 41.245 1.00 0.00 ATOM 1943 CB ARG A 253 15.597 -8.104 41.413 1.00 0.00 ATOM 1944 CG ARG A 253 16.011 -9.430 42.034 1.00 0.00 ATOM 1945 CD ARG A 253 17.474 -9.585 42.235 1.00 0.00 ATOM 1946 NE ARG A 253 18.256 -9.552 41.010 1.00 0.00 ATOM 1947 CZ ARG A 253 18.427 -10.603 40.184 1.00 0.00 ATOM 1948 NH1 ARG A 253 17.902 -11.775 40.464 1.00 0.00 ATOM 1949 NH2 ARG A 253 19.154 -10.428 39.095 1.00 0.00 ATOM 1950 O ARG A 253 12.845 -9.066 42.880 1.00 0.00 ATOM 1951 C ARG A 253 13.405 -8.014 42.599 1.00 0.00 ATOM 1952 N SER A 254 13.543 -6.933 43.423 1.00 0.00 ATOM 1953 CA SER A 254 12.937 -6.913 44.759 1.00 0.00 ATOM 1954 CB SER A 254 13.983 -7.219 45.831 1.00 0.00 ATOM 1955 OG SER A 254 15.004 -6.235 45.835 1.00 0.00 ATOM 1956 O SER A 254 11.578 -5.490 46.146 1.00 0.00 ATOM 1957 C SER A 254 12.259 -5.590 45.123 1.00 0.00 ENDMDL EXPDTA 2i6dA MODEL 2 REMARK 44 REMARK 44 model 2 is called 2i6dA ATOM 1 N MET 1 -3.220 34.931 51.119 1.00 0.00 ATOM 2 CA MET 1 -1.936 35.574 50.810 1.00 0.00 ATOM 3 CB MET 1 -1.962 37.090 51.117 1.00 0.00 ATOM 4 CG MET 1 -2.966 37.942 50.306 1.00 0.00 ATOM 5 SD MET 1 -2.937 39.885 50.726 1.00 0.00 ATOM 6 CE MET 1 -4.728 40.426 50.112 1.00 0.00 ATOM 7 O MET 1 -1.019 34.679 52.821 1.00 0.00 ATOM 8 C MET 1 -0.843 34.898 51.632 1.00 0.00 ATOM 9 N LEU 2 0.272 34.551 50.997 1.00 0.00 ATOM 10 CA LEU 2 1.491 34.178 51.718 1.00 0.00 ATOM 11 CB LEU 2 2.519 33.569 50.760 1.00 0.00 ATOM 12 CG LEU 2 2.192 32.207 50.169 1.00 0.00 ATOM 13 CD1 LEU 2 3.212 31.866 49.094 1.00 0.00 ATOM 14 CD2 LEU 2 2.196 31.158 51.270 1.00 0.00 ATOM 15 O LEU 2 2.224 36.441 51.733 1.00 0.00 ATOM 16 C LEU 2 2.129 35.400 52.363 1.00 0.00 ATOM 17 N SER 3 2.601 35.264 53.594 1.00 0.00 ATOM 18 CA SER 3 3.293 36.372 54.253 1.00 0.00 ATOM 19 CB SER 3 3.407 36.117 55.756 1.00 0.00 ATOM 20 OG SER 3 4.378 35.119 56.015 1.00 0.00 ATOM 21 O SER 3 5.163 35.631 52.957 1.00 0.00 ATOM 22 C SER 3 4.678 36.527 53.644 1.00 0.00 ATOM 23 N ALA 4 5.315 37.661 53.905 1.00 0.00 ATOM 24 CA ALA 4 6.679 37.888 53.440 1.00 0.00 ATOM 25 CB ALA 4 7.152 39.273 53.819 1.00 0.00 ATOM 26 O ALA 4 8.506 36.354 53.303 1.00 0.00 ATOM 27 C ALA 4 7.622 36.829 54.003 1.00 0.00 ATOM 28 N ASN 5 7.423 36.461 55.270 1.00 0.00 ATOM 29 CA ASN 5 8.225 35.407 55.884 1.00 0.00 ATOM 30 CB ASN 5 7.930 35.301 57.383 1.00 0.00 ATOM 31 CG ASN 5 8.406 36.518 58.153 1.00 0.00 ATOM 32 ND2 ASN 5 7.935 36.653 59.390 1.00 0.00 ATOM 33 OD1 ASN 5 9.175 37.344 57.638 1.00 0.00 ATOM 34 O ASN 5 9.038 33.344 54.958 1.00 0.00 ATOM 35 C ASN 5 8.067 34.058 55.184 1.00 0.00 ATOM 36 N GLN 6 6.842 33.717 54.813 1.00 0.00 ATOM 37 CA GLN 6 6.593 32.440 54.160 1.00 0.00 ATOM 38 CB GLN 6 5.095 32.183 54.054 1.00 0.00 ATOM 39 CG GLN 6 4.467 31.842 55.401 1.00 0.00 ATOM 40 CD GLN 6 2.969 31.728 55.321 1.00 0.00 ATOM 41 OE1 GLN 6 2.314 32.471 54.586 1.00 0.00 ATOM 42 NE2 GLN 6 2.409 30.805 56.088 1.00 0.00 ATOM 43 O GLN 6 7.875 31.359 52.441 1.00 0.00 ATOM 44 C GLN 6 7.268 32.366 52.794 1.00 0.00 ATOM 45 N ILE 7 7.175 33.455 52.037 1.00 0.00 ATOM 46 CA ILE 7 7.819 33.556 50.735 1.00 0.00 ATOM 47 CB ILE 7 7.382 34.869 50.018 1.00 0.00 ATOM 48 CG1 ILE 7 5.904 34.751 49.594 1.00 0.00 ATOM 49 CG2 ILE 7 8.295 35.178 48.820 1.00 0.00 ATOM 50 CD1 ILE 7 5.301 36.035 49.061 1.00 0.00 ATOM 51 O ILE 7 9.989 32.694 50.155 1.00 0.00 ATOM 52 C ILE 7 9.348 33.442 50.876 1.00 0.00 ATOM 53 N LYS 8 9.918 34.156 51.836 1.00 0.00 ATOM 54 CA LYS 8 11.352 34.074 52.103 1.00 0.00 ATOM 55 CB LYS 8 11.724 35.043 53.228 1.00 0.00 ATOM 56 CG LYS 8 13.182 35.062 53.612 1.00 0.00 ATOM 57 CD LYS 8 13.394 36.147 54.672 1.00 0.00 ATOM 58 CE LYS 8 14.858 36.289 55.064 1.00 0.00 ATOM 59 NZ LYS 8 15.288 35.129 55.906 1.00 0.00 ATOM 60 O LYS 8 12.723 32.086 51.870 1.00 0.00 ATOM 61 C LYS 8 11.771 32.634 52.445 1.00 0.00 ATOM 62 N PHE 9 11.021 32.004 53.343 1.00 0.00 ATOM 63 CA PHE 9 11.262 30.611 53.704 1.00 0.00 ATOM 64 CB PHE 9 10.244 30.165 54.766 1.00 0.00 ATOM 65 CG PHE 9 10.281 28.705 55.057 1.00 0.00 ATOM 66 CD1 PHE 9 11.284 28.178 55.871 1.00 0.00 ATOM 67 CD2 PHE 9 9.312 27.846 54.519 1.00 0.00 ATOM 68 CE1 PHE 9 11.329 26.811 56.141 1.00 0.00 ATOM 69 CE2 PHE 9 9.347 26.484 54.790 1.00 0.00 ATOM 70 CZ PHE 9 10.361 25.969 55.606 1.00 0.00 ATOM 71 O PHE 9 12.167 28.913 52.273 1.00 0.00 ATOM 72 C PHE 9 11.220 29.668 52.497 1.00 0.00 ATOM 73 N LEU 10 10.119 29.708 51.739 1.00 0.00 ATOM 74 CA LEU 10 9.973 28.895 50.528 1.00 0.00 ATOM 75 CB LEU 10 8.622 29.191 49.849 1.00 0.00 ATOM 76 CG LEU 10 7.434 28.533 50.564 1.00 0.00 ATOM 77 CD1 LEU 10 6.156 29.232 50.164 1.00 0.00 ATOM 78 CD2 LEU 10 7.352 26.971 50.269 1.00 0.00 ATOM 79 O LEU 10 11.699 28.099 48.999 1.00 0.00 ATOM 80 C LEU 10 11.144 29.084 49.544 1.00 0.00 ATOM 81 N ARG 11 11.522 30.337 49.317 1.00 0.00 ATOM 82 CA ARG 11 12.605 30.639 48.348 1.00 0.00 ATOM 83 CB ARG 11 12.655 32.137 48.035 1.00 0.00 ATOM 84 CG ARG 11 11.419 32.644 47.270 1.00 0.00 ATOM 85 CD ARG 11 11.426 34.173 47.070 1.00 0.00 ATOM 86 NE ARG 11 12.613 34.646 46.367 1.00 0.00 ATOM 87 CZ ARG 11 12.810 34.519 45.059 1.00 0.00 ATOM 88 NH1 ARG 11 11.883 33.948 44.285 1.00 0.00 ATOM 89 NH2 ARG 11 13.934 34.977 44.520 1.00 0.00 ATOM 90 O ARG 11 14.810 29.763 48.040 1.00 0.00 ATOM 91 C ARG 11 13.974 30.150 48.834 1.00 0.00 ATOM 92 N SER 12 14.185 30.162 50.150 1.00 0.00 ATOM 93 CA SER 12 15.469 29.792 50.735 1.00 0.00 ATOM 94 CB SER 12 15.464 30.062 52.242 1.00 0.00 ATOM 95 OG SER 12 14.694 29.069 52.908 1.00 0.00 ATOM 96 O SER 12 16.970 27.938 50.443 1.00 0.00 ATOM 97 C SER 12 15.798 28.317 50.470 1.00 0.00 ATOM 98 N LEU 13 14.778 27.486 50.242 1.00 0.00 ATOM 99 CA LEU 13 15.016 26.037 50.163 1.00 0.00 ATOM 100 CB LEU 13 13.718 25.257 50.417 1.00 0.00 ATOM 101 CG LEU 13 13.088 25.517 51.785 1.00 0.00 ATOM 102 CD1 LEU 13 11.743 24.775 51.883 1.00 0.00 ATOM 103 CD2 LEU 13 14.024 25.187 52.984 1.00 0.00 ATOM 104 O LEU 13 16.086 24.414 48.716 1.00 0.00 ATOM 105 C LEU 13 15.671 25.581 48.853 1.00 0.00 ATOM 106 N ARG 14 15.790 26.497 47.903 1.00 0.00 ATOM 107 CA ARG 14 16.578 26.223 46.717 1.00 0.00 ATOM 108 CB ARG 14 16.285 27.240 45.634 1.00 0.00 ATOM 109 CG ARG 14 16.896 28.614 45.833 1.00 0.00 ATOM 110 CD ARG 14 16.107 29.629 44.996 1.00 0.00 ATOM 111 NE ARG 14 14.668 29.409 45.202 1.00 0.00 ATOM 112 CZ ARG 14 13.681 29.948 44.479 1.00 0.00 ATOM 113 NH1 ARG 14 13.952 30.766 43.467 1.00 0.00 ATOM 114 NH2 ARG 14 12.410 29.664 44.778 1.00 0.00 ATOM 115 O ARG 14 18.883 25.735 46.157 1.00 0.00 ATOM 116 C ARG 14 18.105 26.179 47.007 1.00 0.00 ATOM 117 N GLU 15 18.514 26.645 48.189 1.00 0.00 ATOM 118 CA GLU 15 19.925 26.626 48.593 1.00 0.00 ATOM 119 CB GLU 15 20.327 27.955 49.234 1.00 0.00 ATOM 120 CG GLU 15 20.082 29.182 48.377 1.00 0.00 ATOM 121 CD GLU 15 20.199 30.498 49.175 1.00 0.00 ATOM 122 OE1 GLU 15 21.270 30.752 49.759 1.00 0.00 ATOM 123 OE2 GLU 15 19.201 31.265 49.222 1.00 0.00 ATOM 124 O GLU 15 19.427 25.395 50.585 1.00 0.00 ATOM 125 C GLU 15 20.176 25.523 49.606 1.00 0.00 ATOM 126 N ARG 16 21.242 24.752 49.403 1.00 0.00 ATOM 127 CA ARG 16 21.585 23.669 50.326 1.00 0.00 ATOM 128 CB ARG 16 22.889 22.991 49.882 1.00 0.00 ATOM 129 CG ARG 16 23.443 22.068 50.929 1.00 0.00 ATOM 130 CD ARG 16 24.325 20.980 50.360 1.00 0.00 ATOM 131 NE ARG 16 24.690 20.022 51.406 1.00 0.00 ATOM 132 CZ ARG 16 23.899 19.050 51.861 1.00 0.00 ATOM 133 NH1 ARG 16 24.339 18.253 52.821 1.00 0.00 ATOM 134 NH2 ARG 16 22.672 18.873 51.372 1.00 0.00 ATOM 135 O ARG 16 21.304 23.505 52.729 1.00 0.00 ATOM 136 C ARG 16 21.726 24.172 51.774 1.00 0.00 ATOM 137 N LYS 17 22.326 25.350 51.916 1.00 0.00 ATOM 138 CA LYS 17 22.542 25.973 53.217 1.00 0.00 ATOM 139 CB LYS 17 23.113 27.382 53.028 1.00 0.00 ATOM 140 CG LYS 17 23.147 28.249 54.271 1.00 0.00 ATOM 141 CD LYS 17 23.478 29.696 53.892 1.00 0.00 ATOM 142 CE LYS 17 23.392 30.619 55.081 1.00 0.00 ATOM 143 NZ LYS 17 23.822 32.014 54.727 1.00 0.00 ATOM 144 O LYS 17 21.229 25.642 55.210 1.00 0.00 ATOM 145 C LYS 17 21.245 26.005 54.026 1.00 0.00 ATOM 146 N TYR 18 20.158 26.423 53.382 1.00 0.00 ATOM 147 CA TYR 18 18.894 26.569 54.073 1.00 0.00 ATOM 148 CB TYR 18 18.062 27.697 53.455 1.00 0.00 ATOM 149 CG TYR 18 18.741 29.030 53.712 1.00 0.00 ATOM 150 CD1 TYR 18 18.745 29.593 54.991 1.00 0.00 ATOM 151 CD2 TYR 18 19.427 29.697 52.699 1.00 0.00 ATOM 152 CE1 TYR 18 19.377 30.790 55.245 1.00 0.00 ATOM 153 CE2 TYR 18 20.070 30.913 52.950 1.00 0.00 ATOM 154 CZ TYR 18 20.031 31.448 54.222 1.00 0.00 ATOM 155 OH TYR 18 20.669 32.625 54.493 1.00 0.00 ATOM 156 O TYR 18 17.403 25.096 55.222 1.00 0.00 ATOM 157 C TYR 18 18.112 25.271 54.224 1.00 0.00 ATOM 158 N ARG 19 18.272 24.348 53.274 1.00 0.00 ATOM 159 CA ARG 19 17.688 23.018 53.429 1.00 0.00 ATOM 160 CB ARG 19 17.932 22.128 52.209 1.00 0.00 ATOM 161 CG ARG 19 17.178 22.607 50.970 1.00 0.00 ATOM 162 CD ARG 19 17.103 21.511 49.883 1.00 0.00 ATOM 163 NE ARG 19 18.415 21.214 49.305 1.00 0.00 ATOM 164 CZ ARG 19 18.993 21.913 48.332 1.00 0.00 ATOM 165 NH1 ARG 19 18.390 22.974 47.817 1.00 0.00 ATOM 166 NH2 ARG 19 20.182 21.546 47.877 1.00 0.00 ATOM 167 O ARG 19 17.511 21.784 55.449 1.00 0.00 ATOM 168 C ARG 19 18.258 22.377 54.679 1.00 0.00 ATOM 169 N LEU 20 19.567 22.547 54.893 1.00 0.00 ATOM 170 CA LEU 20 20.246 21.998 56.060 1.00 0.00 ATOM 171 CB LEU 20 21.767 22.131 55.924 1.00 0.00 ATOM 172 CG LEU 20 22.476 21.178 54.965 1.00 0.00 ATOM 173 CD1 LEU 20 23.930 21.571 54.852 1.00 0.00 ATOM 174 CD2 LEU 20 22.322 19.706 55.407 1.00 0.00 ATOM 175 O LEU 20 19.520 21.999 58.345 1.00 0.00 ATOM 176 C LEU 20 19.800 22.675 57.350 1.00 0.00 ATOM 177 N ARG 21 19.731 24.004 57.330 1.00 0.00 ATOM 178 CA ARG 21 19.402 24.766 58.537 1.00 0.00 ATOM 179 CB ARG 21 19.582 26.251 58.271 1.00 0.00 ATOM 180 CG ARG 21 19.608 27.070 59.509 1.00 0.00 ATOM 181 CD ARG 21 19.901 28.490 59.206 1.00 0.00 ATOM 182 NE ARG 21 21.322 28.732 58.984 1.00 0.00 ATOM 183 CZ ARG 21 21.814 29.917 58.646 1.00 0.00 ATOM 184 NH1 ARG 21 20.999 30.953 58.512 1.00 0.00 ATOM 185 NH2 ARG 21 23.112 30.067 58.444 1.00 0.00 ATOM 186 O ARG 21 17.672 24.351 60.172 1.00 0.00 ATOM 187 C ARG 21 17.962 24.485 58.971 1.00 0.00 ATOM 188 N GLU 22 17.080 24.393 57.973 1.00 0.00 ATOM 189 CA GLU 22 15.656 24.161 58.195 1.00 0.00 ATOM 190 CB GLU 22 14.828 24.828 57.087 1.00 0.00 ATOM 191 CG GLU 22 14.925 26.361 57.047 1.00 0.00 ATOM 192 CD GLU 22 14.520 27.011 58.359 1.00 0.00 ATOM 193 OE1 GLU 22 13.618 26.475 59.045 1.00 0.00 ATOM 194 OE2 GLU 22 15.108 28.061 58.706 1.00 0.00 ATOM 195 O GLU 22 14.153 22.347 58.591 1.00 0.00 ATOM 196 C GLU 22 15.291 22.688 58.250 1.00 0.00 ATOM 197 N GLN 23 16.245 21.823 57.897 1.00 0.00 ATOM 198 CA GLN 23 15.992 20.390 57.743 1.00 0.00 ATOM 199 CB GLN 23 15.922 19.667 59.107 1.00 0.00 ATOM 200 CG GLN 23 17.314 19.476 59.768 1.00 0.00 ATOM 201 CD GLN 23 18.241 18.580 58.932 1.00 0.00 ATOM 202 OE1 GLN 23 17.961 17.391 58.721 1.00 0.00 ATOM 203 NE2 GLN 23 19.336 19.159 58.438 1.00 0.00 ATOM 204 O GLN 23 13.795 19.497 57.343 1.00 0.00 ATOM 205 C GLN 23 14.721 20.199 56.926 1.00 0.00 ATOM 206 N ALA 24 14.683 20.855 55.764 1.00 0.00 ATOM 207 CA ALA 24 13.500 20.852 54.911 1.00 0.00 ATOM 208 CB ALA 24 12.591 22.016 55.269 1.00 0.00 ATOM 209 O ALA 24 14.960 21.361 53.051 1.00 0.00 ATOM 210 C ALA 24 13.868 20.917 53.419 1.00 0.00 ATOM 211 N PHE 25 12.954 20.477 52.562 1.00 0.00 ATOM 212 CA PHE 25 13.153 20.623 51.120 1.00 0.00 ATOM 213 CB PHE 25 13.963 19.443 50.542 1.00 0.00 ATOM 214 CG PHE 25 13.214 18.126 50.529 1.00 0.00 ATOM 215 CD1 PHE 25 12.555 17.701 49.378 1.00 0.00 ATOM 216 CD2 PHE 25 13.134 17.341 51.668 1.00 0.00 ATOM 217 CE1 PHE 25 11.873 16.485 49.355 1.00 0.00 ATOM 218 CE2 PHE 25 12.433 16.096 51.655 1.00 0.00 ATOM 219 CZ PHE 25 11.807 15.687 50.494 1.00 0.00 ATOM 220 O PHE 25 10.781 20.272 51.029 1.00 0.00 ATOM 221 C PHE 25 11.796 20.737 50.466 1.00 0.00 ATOM 222 N ALA 26 11.753 21.352 49.287 1.00 0.00 ATOM 223 CA ALA 26 10.500 21.552 48.593 1.00 0.00 ATOM 224 CB ALA 26 10.371 23.012 48.130 1.00 0.00 ATOM 225 O ALA 26 11.339 20.163 46.771 1.00 0.00 ATOM 226 C ALA 26 10.348 20.602 47.397 1.00 0.00 ATOM 227 N VAL 27 9.096 20.347 47.067 1.00 0.00 ATOM 228 CA VAL 27 8.678 19.519 45.935 1.00 0.00 ATOM 229 CB VAL 27 8.200 18.121 46.415 1.00 0.00 ATOM 230 CG1 VAL 27 7.742 17.207 45.233 1.00 0.00 ATOM 231 CG2 VAL 27 9.320 17.420 47.234 1.00 0.00 ATOM 232 O VAL 27 6.609 20.765 45.945 1.00 0.00 ATOM 233 C VAL 27 7.537 20.256 45.262 1.00 0.00 ATOM 234 N GLU 28 7.602 20.331 43.941 1.00 0.00 ATOM 235 CA GLU 28 6.602 21.058 43.155 1.00 0.00 ATOM 236 CB GLU 28 7.243 22.200 42.375 1.00 0.00 ATOM 237 CG GLU 28 8.075 23.155 43.251 1.00 0.00 ATOM 238 CD GLU 28 8.568 24.349 42.432 1.00 0.00 ATOM 239 OE1 GLU 28 7.883 24.705 41.457 1.00 0.00 ATOM 240 OE2 GLU 28 9.646 24.910 42.733 1.00 0.00 ATOM 241 O GLU 28 6.251 19.237 41.582 1.00 0.00 ATOM 242 C GLU 28 5.764 20.183 42.225 1.00 0.00 ATOM 243 N GLY 29 4.482 20.512 42.178 1.00 0.00 ATOM 244 CA GLY 29 3.578 19.932 41.213 1.00 0.00 ATOM 245 O GLY 29 3.255 18.061 42.627 1.00 0.00 ATOM 246 C GLY 29 2.777 18.774 41.770 1.00 0.00 ATOM 247 N PRO 30 1.547 18.580 41.276 1.00 0.00 ATOM 248 CA PRO 30 0.678 17.544 41.835 1.00 0.00 ATOM 249 CB PRO 30 -0.612 17.638 40.987 1.00 0.00 ATOM 250 CG PRO 30 -0.276 18.518 39.804 1.00 0.00 ATOM 251 CD PRO 30 0.898 19.366 40.204 1.00 0.00 ATOM 252 O PRO 30 0.926 15.311 42.620 1.00 0.00 ATOM 253 C PRO 30 1.223 16.118 41.748 1.00 0.00 ATOM 254 N LYS 31 1.949 15.792 40.682 1.00 0.00 ATOM 255 CA LYS 31 2.374 14.398 40.476 1.00 0.00 ATOM 256 CB LYS 31 2.991 14.200 39.085 1.00 0.00 ATOM 257 CG LYS 31 2.014 14.277 37.947 1.00 0.00 ATOM 258 CD LYS 31 2.656 13.853 36.607 1.00 0.00 ATOM 259 CE LYS 31 2.064 14.666 35.446 1.00 0.00 ATOM 260 NZ LYS 31 2.444 14.113 34.109 1.00 0.00 ATOM 261 O LYS 31 3.206 12.986 42.267 1.00 0.00 ATOM 262 C LYS 31 3.372 14.003 41.572 1.00 0.00 ATOM 263 N LEU 32 4.393 14.834 41.752 1.00 0.00 ATOM 264 CA LEU 32 5.419 14.536 42.696 1.00 0.00 ATOM 265 CB LEU 32 6.688 15.356 42.429 1.00 0.00 ATOM 266 CG LEU 32 7.456 15.036 41.140 1.00 0.00 ATOM 267 CD1 LEU 32 8.484 16.132 40.921 1.00 0.00 ATOM 268 CD2 LEU 32 8.111 13.663 41.194 1.00 0.00 ATOM 269 O LEU 32 5.246 13.899 44.985 1.00 0.00 ATOM 270 C LEU 32 4.929 14.724 44.128 1.00 0.00 ATOM 271 N VAL 33 4.146 15.772 44.385 1.00 0.00 ATOM 272 CA VAL 33 3.668 16.015 45.745 1.00 0.00 ATOM 273 CB VAL 33 2.970 17.411 45.884 1.00 0.00 ATOM 274 CG1 VAL 33 2.288 17.535 47.238 1.00 0.00 ATOM 275 CG2 VAL 33 4.005 18.547 45.723 1.00 0.00 ATOM 276 O VAL 33 2.938 14.302 47.255 1.00 0.00 ATOM 277 C VAL 33 2.754 14.867 46.173 1.00 0.00 ATOM 278 N GLY 34 1.812 14.491 45.303 1.00 0.00 ATOM 279 CA GLY 34 0.887 13.385 45.574 1.00 0.00 ATOM 280 O GLY 34 1.328 11.402 46.869 1.00 0.00 ATOM 281 C GLY 34 1.617 12.091 45.884 1.00 0.00 ATOM 282 N GLU 35 2.611 11.763 45.079 1.00 0.00 ATOM 283 CA GLU 35 3.323 10.534 45.336 1.00 0.00 ATOM 284 CB GLU 35 4.169 10.113 44.151 1.00 0.00 ATOM 285 CG GLU 35 4.548 8.643 44.280 1.00 0.00 ATOM 286 CD GLU 35 4.535 7.920 42.984 1.00 0.00 ATOM 287 OE1 GLU 35 4.440 8.598 41.931 1.00 0.00 ATOM 288 OE2 GLU 35 4.603 6.665 43.035 1.00 0.00 ATOM 289 O GLU 35 4.344 9.456 47.212 1.00 0.00 ATOM 290 C GLU 35 4.180 10.523 46.590 1.00 0.00 ATOM 291 N MET 36 4.725 11.673 46.972 1.00 0.00 ATOM 292 CA MET 36 5.671 11.691 48.082 1.00 0.00 ATOM 293 CB MET 36 6.829 12.645 47.769 1.00 0.00 ATOM 294 CG MET 36 7.618 12.307 46.500 1.00 0.00 ATOM 295 SD MET 36 8.993 13.694 46.109 1.00 0.00 ATOM 296 CE MET 36 10.153 13.463 47.685 1.00 0.00 ATOM 297 O MET 36 5.616 11.745 50.507 1.00 0.00 ATOM 298 C MET 36 5.022 12.010 49.453 1.00 0.00 ATOM 299 N LEU 37 3.802 12.548 49.440 1.00 0.00 ATOM 300 CA LEU 37 3.076 12.824 50.705 1.00 0.00 ATOM 301 CB LEU 37 1.647 13.370 50.448 1.00 0.00 ATOM 302 CG LEU 37 1.547 14.875 50.217 1.00 0.00 ATOM 303 CD1 LEU 37 0.192 15.247 49.576 1.00 0.00 ATOM 304 CD2 LEU 37 1.795 15.679 51.507 1.00 0.00 ATOM 305 O LEU 37 3.241 11.892 52.903 1.00 0.00 ATOM 306 C LEU 37 3.034 11.669 51.714 1.00 0.00 ATOM 307 N PRO 38 2.711 10.440 51.262 1.00 0.00 ATOM 308 CA PRO 38 2.651 9.326 52.223 1.00 0.00 ATOM 309 CB PRO 38 2.142 8.151 51.379 1.00 0.00 ATOM 310 CG PRO 38 1.504 8.783 50.174 1.00 0.00 ATOM 311 CD PRO 38 2.336 10.010 49.905 1.00 0.00 ATOM 312 O PRO 38 4.033 8.138 53.785 1.00 0.00 ATOM 313 C PRO 38 3.993 8.943 52.838 1.00 0.00 ATOM 314 N PHE 39 5.089 9.479 52.320 1.00 0.00 ATOM 315 CA PHE 39 6.419 8.976 52.717 1.00 0.00 ATOM 316 CB PHE 39 7.122 8.399 51.501 1.00 0.00 ATOM 317 CG PHE 39 6.385 7.251 50.890 1.00 0.00 ATOM 318 CD1 PHE 39 6.437 5.990 51.470 1.00 0.00 ATOM 319 CD2 PHE 39 5.597 7.447 49.761 1.00 0.00 ATOM 320 CE1 PHE 39 5.719 4.923 50.914 1.00 0.00 ATOM 321 CE2 PHE 39 4.893 6.383 49.188 1.00 0.00 ATOM 322 CZ PHE 39 4.952 5.121 49.770 1.00 0.00 ATOM 323 O PHE 39 8.450 9.677 53.835 1.00 0.00 ATOM 324 C PHE 39 7.328 10.003 53.402 1.00 0.00 ATOM 325 N TYR 40 6.870 11.242 53.447 1.00 0.00 ATOM 326 CA TYR 40 7.643 12.364 53.972 1.00 0.00 ATOM 327 CB TYR 40 8.209 13.251 52.840 1.00 0.00 ATOM 328 CG TYR 40 9.302 12.548 52.108 1.00 0.00 ATOM 329 CD1 TYR 40 10.640 12.704 52.496 1.00 0.00 ATOM 330 CD2 TYR 40 8.996 11.668 51.066 1.00 0.00 ATOM 331 CE1 TYR 40 11.640 12.023 51.844 1.00 0.00 ATOM 332 CE2 TYR 40 9.985 10.950 50.425 1.00 0.00 ATOM 333 CZ TYR 40 11.309 11.145 50.806 1.00 0.00 ATOM 334 OH TYR 40 12.296 10.445 50.154 1.00 0.00 ATOM 335 O TYR 40 5.522 13.165 54.631 1.00 0.00 ATOM 336 C TYR 40 6.730 13.176 54.835 1.00 0.00 ATOM 337 N ARG 41 7.323 13.867 55.801 1.00 0.00 ATOM 338 CA ARG 41 6.568 14.655 56.751 1.00 0.00 ATOM 339 CB ARG 41 7.367 14.791 58.037 1.00 0.00 ATOM 340 CG ARG 41 6.540 14.828 59.301 1.00 0.00 ATOM 341 CD ARG 41 5.723 16.078 59.387 1.00 0.00 ATOM 342 NE ARG 41 5.065 16.194 60.689 1.00 0.00 ATOM 343 CZ ARG 41 4.265 17.200 61.038 1.00 0.00 ATOM 344 NH1 ARG 41 3.716 17.220 62.265 1.00 0.00 ATOM 345 NH2 ARG 41 4.019 18.192 60.172 1.00 0.00 ATOM 346 O ARG 41 7.296 16.791 55.998 1.00 0.00 ATOM 347 C ARG 41 6.352 16.027 56.145 1.00 0.00 ATOM 348 N CYS 42 5.106 16.346 55.827 1.00 0.00 ATOM 349 CA CYS 42 4.796 17.634 55.214 1.00 0.00 ATOM 350 CB CYS 42 3.573 17.504 54.307 1.00 0.00 ATOM 351 SG CYS 42 3.176 19.072 53.493 1.00 0.00 ATOM 352 O CYS 42 3.822 18.606 57.204 1.00 0.00 ATOM 353 C CYS 42 4.614 18.748 56.272 1.00 0.00 ATOM 354 N ARG 43 5.374 19.830 56.105 1.00 0.00 ATOM 355 CA ARG 43 5.418 21.006 56.978 1.00 0.00 ATOM 356 CB ARG 43 6.874 21.507 56.929 1.00 0.00 ATOM 357 CG ARG 43 7.310 22.602 57.895 1.00 0.00 ATOM 358 CD ARG 43 8.846 22.672 57.889 1.00 0.00 ATOM 359 NE ARG 43 9.374 23.946 58.358 1.00 0.00 ATOM 360 CZ ARG 43 10.657 24.181 58.628 1.00 0.00 ATOM 361 NH1 ARG 43 11.040 25.377 59.061 1.00 0.00 ATOM 362 NH2 ARG 43 11.558 23.222 58.479 1.00 0.00 ATOM 363 O ARG 43 3.868 22.860 57.215 1.00 0.00 ATOM 364 C ARG 43 4.475 22.105 56.457 1.00 0.00 ATOM 365 N MET 44 4.427 22.217 55.130 1.00 0.00 ATOM 366 CA MET 44 3.708 23.292 54.470 1.00 0.00 ATOM 367 CB MET 44 4.617 24.513 54.352 1.00 0.00 ATOM 368 CG MET 44 4.098 25.601 53.447 1.00 0.00 ATOM 369 SD MET 44 5.119 27.286 53.678 1.00 0.00 ATOM 370 CE MET 44 3.997 28.096 55.040 1.00 0.00 ATOM 371 O MET 44 3.968 22.098 52.405 1.00 0.00 ATOM 372 C MET 44 3.249 22.826 53.089 1.00 0.00 ATOM 373 N LEU 45 2.045 23.241 52.703 1.00 0.00 ATOM 374 CA LEU 45 1.477 22.889 51.400 1.00 0.00 ATOM 375 CB LEU 45 0.524 21.706 51.528 1.00 0.00 ATOM 376 CG LEU 45 -0.036 21.153 50.222 1.00 0.00 ATOM 377 CD1 LEU 45 1.091 20.580 49.333 1.00 0.00 ATOM 378 CD2 LEU 45 -1.085 20.082 50.520 1.00 0.00 ATOM 379 O LEU 45 -0.141 24.646 51.514 1.00 0.00 ATOM 380 C LEU 45 0.761 24.124 50.876 1.00 0.00 ATOM 381 N VAL 46 1.185 24.598 49.715 1.00 0.00 ATOM 382 CA VAL 46 0.712 25.877 49.170 1.00 0.00 ATOM 383 CB VAL 46 1.880 26.853 49.133 1.00 0.00 ATOM 384 CG1 VAL 46 1.569 28.060 48.328 1.00 0.00 ATOM 385 CG2 VAL 46 2.243 27.270 50.564 1.00 0.00 ATOM 386 O VAL 46 0.952 24.952 46.967 1.00 0.00 ATOM 387 C VAL 46 0.227 25.573 47.756 1.00 0.00 ATOM 388 N GLY 47 -1.004 25.941 47.446 1.00 0.00 ATOM 389 CA GLY 47 -1.496 25.665 46.113 1.00 0.00 ATOM 390 O GLY 47 -3.420 26.912 46.748 1.00 0.00 ATOM 391 C GLY 47 -2.821 26.336 45.851 1.00 0.00 ATOM 392 N THR 48 -3.284 26.241 44.611 1.00 0.00 ATOM 393 CA THR 48 -4.614 26.707 44.272 1.00 0.00 ATOM 394 CB THR 48 -4.786 26.841 42.757 1.00 0.00 ATOM 395 CG2 THR 48 -3.878 27.927 42.201 1.00 0.00 ATOM 396 OG1 THR 48 -4.481 25.578 42.135 1.00 0.00 ATOM 397 O THR 48 -5.272 24.515 44.970 1.00 0.00 ATOM 398 C THR 48 -5.616 25.689 44.786 1.00 0.00 ATOM 399 N ALA 49 -6.855 26.137 45.007 1.00 0.00 ATOM 400 CA ALA 49 -7.937 25.265 45.477 1.00 0.00 ATOM 401 CB ALA 49 -9.287 26.020 45.459 1.00 0.00 ATOM 402 O ALA 49 -8.206 22.886 45.268 1.00 0.00 ATOM 403 C ALA 49 -8.039 23.966 44.679 1.00 0.00 ATOM 404 N ALA 50 -7.931 24.059 43.350 1.00 0.00 ATOM 405 CA ALA 50 -8.080 22.875 42.481 1.00 0.00 ATOM 406 CB ALA 50 -8.134 23.278 41.004 1.00 0.00 ATOM 407 O ALA 50 -7.184 20.648 42.661 1.00 0.00 ATOM 408 C ALA 50 -6.962 21.858 42.737 1.00 0.00 ATOM 409 N MET 51 -5.775 22.358 43.061 1.00 0.00 ATOM 410 CA MET 51 -4.650 21.487 43.413 1.00 0.00 ATOM 411 CB MET 51 -3.319 22.228 43.276 1.00 0.00 ATOM 412 CG MET 51 -3.010 22.664 41.841 1.00 0.00 ATOM 413 SD MET 51 -2.776 21.118 40.662 1.00 0.00 ATOM 414 CE MET 51 -4.571 21.050 39.847 1.00 0.00 ATOM 415 O MET 51 -4.559 19.692 44.992 1.00 0.00 ATOM 416 C MET 51 -4.802 20.884 44.801 1.00 0.00 ATOM 417 N LEU 52 -5.218 21.690 45.771 1.00 0.00 ATOM 418 CA LEU 52 -5.316 21.202 47.149 1.00 0.00 ATOM 419 CB LEU 52 -5.516 22.369 48.119 1.00 0.00 ATOM 420 CG LEU 52 -4.350 23.357 48.221 1.00 0.00 ATOM 421 CD1 LEU 52 -4.746 24.535 49.095 1.00 0.00 ATOM 422 CD2 LEU 52 -3.116 22.655 48.798 1.00 0.00 ATOM 423 O LEU 52 -6.296 19.233 48.151 1.00 0.00 ATOM 424 C LEU 52 -6.426 20.151 47.341 1.00 0.00 ATOM 425 N ARG 53 -7.519 20.289 46.606 1.00 0.00 ATOM 426 CA ARG 53 -8.623 19.354 46.764 1.00 0.00 ATOM 427 CB ARG 53 -9.844 19.832 45.981 1.00 0.00 ATOM 428 CG ARG 53 -9.735 19.588 44.475 1.00 0.00 ATOM 429 CD ARG 53 -11.027 19.888 43.762 1.00 0.00 ATOM 430 NE ARG 53 -12.048 18.889 44.063 1.00 0.00 ATOM 431 CZ ARG 53 -13.210 18.792 43.428 1.00 0.00 ATOM 432 NH1 ARG 53 -14.070 17.851 43.781 1.00 0.00 ATOM 433 NH2 ARG 53 -13.515 19.635 42.442 1.00 0.00 ATOM 434 O ARG 53 -8.804 16.942 46.828 1.00 0.00 ATOM 435 C ARG 53 -8.233 17.927 46.336 1.00 0.00 ATOM 436 N ALA 54 -7.243 17.833 45.441 1.00 0.00 ATOM 437 CA ALA 54 -6.855 16.554 44.848 1.00 0.00 ATOM 438 CB ALA 54 -6.255 16.757 43.469 1.00 0.00 ATOM 439 O ALA 54 -5.671 14.580 45.472 1.00 0.00 ATOM 440 C ALA 54 -5.901 15.754 45.730 1.00 0.00 ATOM 441 N VAL 55 -5.353 16.375 46.771 1.00 0.00 ATOM 442 CA VAL 55 -4.464 15.650 47.681 1.00 0.00 ATOM 443 CB VAL 55 -3.056 16.305 47.773 1.00 0.00 ATOM 444 CG1 VAL 55 -2.338 16.234 46.419 1.00 0.00 ATOM 445 CG2 VAL 55 -3.151 17.729 48.216 1.00 0.00 ATOM 446 O VAL 55 -5.749 16.538 49.499 1.00 0.00 ATOM 447 C VAL 55 -5.086 15.577 49.066 1.00 0.00 ATOM 448 N SER 56 -4.872 14.471 49.779 1.00 0.00 ATOM 449 CA SER 56 -5.376 14.407 51.151 1.00 0.00 ATOM 450 CB SER 56 -5.410 12.992 51.751 1.00 0.00 ATOM 451 OG SER 56 -4.355 12.192 51.269 1.00 0.00 ATOM 452 O SER 56 -3.334 15.344 51.952 1.00 0.00 ATOM 453 C SER 56 -4.566 15.363 51.987 1.00 0.00 ATOM 454 N THR 57 -5.277 16.252 52.669 1.00 0.00 ATOM 455 CA THR 57 -4.678 17.287 53.479 1.00 0.00 ATOM 456 CB THR 57 -5.750 18.061 54.266 1.00 0.00 ATOM 457 CG2 THR 57 -5.303 19.492 54.534 1.00 0.00 ATOM 458 OG1 THR 57 -6.978 18.073 53.522 1.00 0.00 ATOM 459 O THR 57 -4.054 15.681 55.140 1.00 0.00 ATOM 460 C THR 57 -3.697 16.635 54.439 1.00 0.00 ATOM 461 N PRO 58 -2.443 17.124 54.451 1.00 0.00 ATOM 462 CA PRO 58 -1.426 16.560 55.337 1.00 0.00 ATOM 463 CB PRO 58 -0.162 17.353 54.985 1.00 0.00 ATOM 464 CG PRO 58 -0.460 18.069 53.704 1.00 0.00 ATOM 465 CD PRO 58 -1.934 18.251 53.654 1.00 0.00 ATOM 466 O PRO 58 -2.307 17.901 57.114 1.00 0.00 ATOM 467 C PRO 58 -1.790 16.826 56.790 1.00 0.00 ATOM 468 N HIS 59 -1.543 15.845 57.647 1.00 0.00 ATOM 469 CA HIS 59 -1.792 16.056 59.065 1.00 0.00 ATOM 470 CB HIS 59 -1.860 14.736 59.846 1.00 0.00 ATOM 471 CG HIS 59 -3.259 14.276 60.141 1.00 0.00 ATOM 472 CD2 HIS 59 -4.113 14.606 61.141 1.00 0.00 ATOM 473 ND1 HIS 59 -3.928 13.359 59.356 1.00 0.00 ATOM 474 CE1 HIS 59 -5.131 13.144 59.861 1.00 0.00 ATOM 475 NE2 HIS 59 -5.268 13.888 60.944 1.00 0.00 ATOM 476 O HIS 59 0.459 16.895 59.464 1.00 0.00 ATOM 477 C HIS 59 -0.763 17.031 59.644 1.00 0.00 ATOM 478 N ASP 60 -1.283 18.065 60.298 1.00 0.00 ATOM 479 CA ASP 60 -0.435 19.053 60.972 1.00 0.00 ATOM 480 CB ASP 60 0.345 18.389 62.120 1.00 0.00 ATOM 481 CG ASP 60 0.844 19.397 63.138 1.00 0.00 ATOM 482 OD1 ASP 60 0.056 20.288 63.524 1.00 0.00 ATOM 483 OD2 ASP 60 2.023 19.307 63.530 1.00 0.00 ATOM 484 O ASP 60 1.694 20.018 60.395 1.00 0.00 ATOM 485 C ASP 60 0.529 19.821 60.060 1.00 0.00 ATOM 486 N ALA 61 0.041 20.256 58.906 1.00 0.00 ATOM 487 CA ALA 61 0.833 21.114 58.042 1.00 0.00 ATOM 488 CB ALA 61 1.011 20.489 56.652 1.00 0.00 ATOM 489 O ALA 61 -1.024 22.621 58.134 1.00 0.00 ATOM 490 C ALA 61 0.179 22.483 57.941 1.00 0.00 ATOM 491 N GLU 62 0.981 23.497 57.665 1.00 0.00 ATOM 492 CA GLU 62 0.436 24.772 57.247 1.00 0.00 ATOM 493 CB GLU 62 1.434 25.884 57.485 1.00 0.00 ATOM 494 CG GLU 62 0.892 27.226 57.109 1.00 0.00 ATOM 495 CD GLU 62 1.405 28.310 58.006 1.00 0.00 ATOM 496 OE1 GLU 62 0.658 29.290 58.199 1.00 0.00 ATOM 497 OE2 GLU 62 2.548 28.169 58.514 1.00 0.00 ATOM 498 O GLU 62 0.870 24.567 54.869 1.00 0.00 ATOM 499 C GLU 62 0.023 24.717 55.765 1.00 0.00 ATOM 500 N VAL 63 -1.281 24.834 55.530 1.00 0.00 ATOM 501 CA VAL 63 -1.853 24.743 54.201 1.00 0.00 ATOM 502 CB VAL 63 -2.992 23.699 54.162 1.00 0.00 ATOM 503 CG1 VAL 63 -3.634 23.656 52.787 1.00 0.00 ATOM 504 CG2 VAL 63 -2.446 22.323 54.543 1.00 0.00 ATOM 505 O VAL 63 -3.164 26.728 54.513 1.00 0.00 ATOM 506 C VAL 63 -2.367 26.113 53.788 1.00 0.00 ATOM 507 N VAL 64 -1.884 26.615 52.654 1.00 0.00 ATOM 508 CA VAL 64 -2.271 27.964 52.202 1.00 0.00 ATOM 509 CB VAL 64 -1.074 28.952 52.067 1.00 0.00 ATOM 510 CG1 VAL 64 -1.571 30.354 51.694 1.00 0.00 ATOM 511 CG2 VAL 64 -0.235 29.027 53.365 1.00 0.00 ATOM 512 O VAL 64 -2.281 27.329 49.934 1.00 0.00 ATOM 513 C VAL 64 -2.923 27.803 50.858 1.00 0.00 ATOM 514 N GLU 65 -4.196 28.168 50.748 1.00 0.00 ATOM 515 CA GLU 65 -4.857 28.140 49.452 1.00 0.00 ATOM 516 CB GLU 65 -6.362 27.853 49.586 1.00 0.00 ATOM 517 CG GLU 65 -7.140 27.895 48.258 1.00 0.00 ATOM 518 CD GLU 65 -8.656 28.056 48.452 1.00 0.00 ATOM 519 OE1 GLU 65 -9.281 27.124 48.999 1.00 0.00 ATOM 520 OE2 GLU 65 -9.225 29.103 48.044 1.00 0.00 ATOM 521 O GLU 65 -4.968 30.521 49.371 1.00 0.00 ATOM 522 C GLU 65 -4.631 29.489 48.792 1.00 0.00 ATOM 523 N LEU 66 -4.082 29.467 47.580 1.00 0.00 ATOM 524 CA LEU 66 -3.760 30.684 46.846 1.00 0.00 ATOM 525 CB LEU 66 -2.320 30.612 46.347 1.00 0.00 ATOM 526 CG LEU 66 -1.230 30.628 47.427 1.00 0.00 ATOM 527 CD1 LEU 66 0.103 30.438 46.772 1.00 0.00 ATOM 528 CD2 LEU 66 -1.235 31.913 48.216 1.00 0.00 ATOM 529 O LEU 66 -5.200 29.954 45.073 1.00 0.00 ATOM 530 C LEU 66 -4.713 30.917 45.675 1.00 0.00 ATOM 531 N PRO 67 -4.963 32.188 45.321 1.00 0.00 ATOM 532 CA PRO 67 -5.883 32.414 44.211 1.00 0.00 ATOM 533 CB PRO 67 -6.097 33.935 44.234 1.00 0.00 ATOM 534 CG PRO 67 -4.836 34.470 44.831 1.00 0.00 ATOM 535 CD PRO 67 -4.427 33.452 45.864 1.00 0.00 ATOM 536 O PRO 67 -4.004 31.927 42.814 1.00 0.00 ATOM 537 C PRO 67 -5.235 31.999 42.904 1.00 0.00 ATOM 538 N GLU 68 -6.072 31.741 41.909 1.00 0.00 ATOM 539 CA GLU 68 -5.656 31.478 40.531 1.00 0.00 ATOM 540 CB GLU 68 -6.906 31.463 39.641 1.00 0.00 ATOM 541 CG GLU 68 -6.902 30.416 38.530 1.00 0.00 ATOM 542 CD GLU 68 -6.586 29.017 39.036 1.00 0.00 ATOM 543 OE1 GLU 68 -5.488 28.516 38.708 1.00 0.00 ATOM 544 OE2 GLU 68 -7.411 28.421 39.773 1.00 0.00 ATOM 545 O GLU 68 -3.734 32.237 39.286 1.00 0.00 ATOM 546 C GLU 68 -4.677 32.549 40.020 1.00 0.00 ATOM 547 N SER 69 -4.877 33.792 40.455 1.00 0.00 ATOM 548 CA SER 69 -4.019 34.906 40.037 1.00 0.00 ATOM 549 CB SER 69 -4.686 36.232 40.370 1.00 0.00 ATOM 550 OG SER 69 -4.786 36.385 41.769 1.00 0.00 ATOM 551 O SER 69 -1.749 35.654 40.133 1.00 0.00 ATOM 552 C SER 69 -2.608 34.925 40.633 1.00 0.00 ATOM 553 N PHE 70 -2.381 34.186 41.718 1.00 0.00 ATOM 554 CA PHE 70 -1.060 34.168 42.352 1.00 0.00 ATOM 555 CB PHE 70 -1.034 33.260 43.581 1.00 0.00 ATOM 556 CG PHE 70 0.336 33.156 44.228 1.00 0.00 ATOM 557 CD1 PHE 70 0.743 34.092 45.168 1.00 0.00 ATOM 558 CD2 PHE 70 1.212 32.130 43.882 1.00 0.00 ATOM 559 CE1 PHE 70 2.009 34.014 45.768 1.00 0.00 ATOM 560 CE2 PHE 70 2.483 32.034 44.484 1.00 0.00 ATOM 561 CZ PHE 70 2.877 32.988 45.424 1.00 0.00 ATOM 562 O PHE 70 -0.218 32.690 40.672 1.00 0.00 ATOM 563 C PHE 70 -0.009 33.679 41.354 1.00 0.00 ATOM 564 N ASP 71 1.118 34.384 41.289 1.00 0.00 ATOM 565 CA ASP 71 2.184 34.028 40.373 1.00 0.00 ATOM 566 CB ASP 71 2.867 35.288 39.847 1.00 0.00 ATOM 567 CG ASP 71 3.857 34.996 38.749 1.00 0.00 ATOM 568 OD1 ASP 71 4.230 33.815 38.567 1.00 0.00 ATOM 569 OD2 ASP 71 4.278 35.954 38.063 1.00 0.00 ATOM 570 O ASP 71 4.060 33.561 41.799 1.00 0.00 ATOM 571 C ASP 71 3.203 33.108 41.038 1.00 0.00 ATOM 572 N PHE 72 3.144 31.825 40.708 1.00 0.00 ATOM 573 CA PHE 72 4.056 30.855 41.329 1.00 0.00 ATOM 574 CB PHE 72 3.658 29.404 41.011 1.00 0.00 ATOM 575 CG PHE 72 2.620 28.869 41.969 1.00 0.00 ATOM 576 CD1 PHE 72 1.270 29.214 41.808 1.00 0.00 ATOM 577 CD2 PHE 72 2.993 28.116 43.078 1.00 0.00 ATOM 578 CE1 PHE 72 0.311 28.777 42.699 1.00 0.00 ATOM 579 CE2 PHE 72 2.025 27.680 43.978 1.00 0.00 ATOM 580 CZ PHE 72 0.668 28.016 43.772 1.00 0.00 ATOM 581 O PHE 72 6.371 30.583 41.805 1.00 0.00 ATOM 582 C PHE 72 5.535 31.097 41.060 1.00 0.00 ATOM 583 N LYS 73 5.871 31.884 40.033 1.00 0.00 ATOM 584 CA LYS 73 7.272 32.282 39.829 1.00 0.00 ATOM 585 CB LYS 73 7.471 33.093 38.536 1.00 0.00 ATOM 586 CG LYS 73 7.155 32.292 37.274 1.00 0.00 ATOM 587 CD LYS 73 7.255 33.130 35.987 1.00 0.00 ATOM 588 CE LYS 73 6.951 32.249 34.771 1.00 0.00 ATOM 589 NZ LYS 73 7.247 32.939 33.472 1.00 0.00 ATOM 590 O LYS 73 9.026 33.221 41.162 1.00 0.00 ATOM 591 C LYS 73 7.809 33.058 41.026 1.00 0.00 ATOM 592 N ARG 74 6.910 33.552 41.887 1.00 0.00 ATOM 593 CA ARG 74 7.343 34.264 43.091 1.00 0.00 ATOM 594 CB ARG 74 6.171 34.958 43.778 1.00 0.00 ATOM 595 CG ARG 74 5.649 36.127 42.978 1.00 0.00 ATOM 596 CD ARG 74 4.282 36.588 43.480 1.00 0.00 ATOM 597 NE ARG 74 4.409 37.257 44.760 1.00 0.00 ATOM 598 CZ ARG 74 3.386 37.623 45.521 1.00 0.00 ATOM 599 NH1 ARG 74 2.133 37.352 45.151 1.00 0.00 ATOM 600 NH2 ARG 74 3.625 38.269 46.651 1.00 0.00 ATOM 601 O ARG 74 8.925 33.772 44.827 1.00 0.00 ATOM 602 C ARG 74 8.059 33.331 44.061 1.00 0.00 ATOM 603 N ILE 75 7.730 32.038 43.982 1.00 0.00 ATOM 604 CA ILE 75 8.254 31.041 44.928 1.00 0.00 ATOM 605 CB ILE 75 7.160 30.614 45.934 1.00 0.00 ATOM 606 CG1 ILE 75 5.950 30.025 45.205 1.00 0.00 ATOM 607 CG2 ILE 75 6.798 31.796 46.872 1.00 0.00 ATOM 608 CD1 ILE 75 4.932 29.339 46.118 1.00 0.00 ATOM 609 O ILE 75 9.738 29.126 44.921 1.00 0.00 ATOM 610 C ILE 75 8.928 29.812 44.277 1.00 0.00 ATOM 611 N SER 76 8.612 29.543 43.014 1.00 0.00 ATOM 612 CA SER 76 9.125 28.346 42.340 1.00 0.00 ATOM 613 CB SER 76 8.156 27.895 41.230 1.00 0.00 ATOM 614 OG SER 76 8.715 26.861 40.425 1.00 0.00 ATOM 615 O SER 76 11.049 29.549 41.521 1.00 0.00 ATOM 616 C SER 76 10.543 28.461 41.787 1.00 0.00 ATOM 617 N THR 77 11.166 27.300 41.589 1.00 0.00 ATOM 618 CA THR 77 12.478 27.211 40.995 1.00 0.00 ATOM 619 CB THR 77 13.351 26.145 41.705 1.00 0.00 ATOM 620 CG2 THR 77 13.579 26.544 43.180 1.00 0.00 ATOM 621 OG1 THR 77 12.699 24.861 41.647 1.00 0.00 ATOM 622 O THR 77 13.366 26.694 38.851 1.00 0.00 ATOM 623 C THR 77 12.354 26.823 39.533 1.00 0.00 ATOM 624 N GLN 78 11.124 26.633 39.060 1.00 0.00 ATOM 625 CA GLN 78 10.890 26.006 37.757 1.00 0.00 ATOM 626 CB GLN 78 9.746 24.995 37.840 1.00 0.00 ATOM 627 CG GLN 78 10.022 23.803 38.769 1.00 0.00 ATOM 628 CD GLN 78 11.261 23.030 38.374 1.00 0.00 ATOM 629 OE1 GLN 78 12.303 23.134 39.025 1.00 0.00 ATOM 630 NE2 GLN 78 11.163 22.258 37.297 1.00 0.00 ATOM 631 O GLN 78 9.963 28.055 36.984 1.00 0.00 ATOM 632 C GLN 78 10.585 27.042 36.699 1.00 0.00 ATOM 633 N THR 79 11.031 26.801 35.473 1.00 0.00 ATOM 634 CA THR 79 10.793 27.775 34.397 1.00 0.00 ATOM 635 CB THR 79 11.584 27.437 33.138 1.00 0.00 ATOM 636 CG2 THR 79 12.944 28.124 33.177 1.00 0.00 ATOM 637 OG1 THR 79 11.811 26.035 33.104 1.00 0.00 ATOM 638 O THR 79 8.837 29.085 33.914 1.00 0.00 ATOM 639 C THR 79 9.292 27.966 34.131 1.00 0.00 ATOM 640 N THR 80 8.523 26.882 34.224 1.00 0.00 ATOM 641 CA THR 80 7.057 26.952 34.093 1.00 0.00 ATOM 642 CB THR 80 6.554 26.242 32.797 1.00 0.00 ATOM 643 CG2 THR 80 5.093 26.595 32.533 1.00 0.00 ATOM 644 OG1 THR 80 7.353 26.661 31.688 1.00 0.00 ATOM 645 O THR 80 5.987 25.166 35.287 1.00 0.00 ATOM 646 C THR 80 6.372 26.343 35.314 1.00 0.00 ATOM 647 N PRO 81 6.207 27.142 36.391 1.00 0.00 ATOM 648 CA PRO 81 5.748 26.546 37.643 1.00 0.00 ATOM 649 CB PRO 81 5.737 27.735 38.626 1.00 0.00 ATOM 650 CG PRO 81 6.598 28.783 37.996 1.00 0.00 ATOM 651 CD PRO 81 6.417 28.597 36.521 1.00 0.00 ATOM 652 O PRO 81 3.498 26.411 36.799 1.00 0.00 ATOM 653 C PRO 81 4.354 25.936 37.556 1.00 0.00 ATOM 654 N GLN 82 4.166 24.864 38.317 1.00 0.00 ATOM 655 CA GLN 82 2.876 24.234 38.560 1.00 0.00 ATOM 656 CB GLN 82 3.039 22.712 38.629 1.00 0.00 ATOM 657 CG GLN 82 3.435 22.081 37.311 1.00 0.00 ATOM 658 CD GLN 82 3.612 20.583 37.430 1.00 0.00 ATOM 659 OE1 GLN 82 2.676 19.834 37.203 1.00 0.00 ATOM 660 NE2 GLN 82 4.807 20.144 37.807 1.00 0.00 ATOM 661 O GLN 82 3.104 24.968 40.835 1.00 0.00 ATOM 662 C GLN 82 2.330 24.745 39.894 1.00 0.00 ATOM 663 N PRO 83 1.007 24.905 40.003 1.00 0.00 ATOM 664 CA PRO 83 0.415 25.590 41.160 1.00 0.00 ATOM 665 CB PRO 83 -0.962 26.047 40.632 1.00 0.00 ATOM 666 CG PRO 83 -1.256 25.160 39.505 1.00 0.00 ATOM 667 CD PRO 83 -0.009 24.493 39.015 1.00 0.00 ATOM 668 O PRO 83 -0.790 24.821 43.087 1.00 0.00 ATOM 669 C PRO 83 0.267 24.789 42.461 1.00 0.00 ATOM 670 N LEU 84 1.326 24.079 42.860 1.00 0.00 ATOM 671 CA LEU 84 1.341 23.340 44.101 1.00 0.00 ATOM 672 CB LEU 84 0.670 21.957 43.904 1.00 0.00 ATOM 673 CG LEU 84 0.446 21.099 45.143 1.00 0.00 ATOM 674 CD1 LEU 84 -0.584 21.752 46.066 1.00 0.00 ATOM 675 CD2 LEU 84 0.025 19.661 44.701 1.00 0.00 ATOM 676 O LEU 84 3.633 22.730 43.724 1.00 0.00 ATOM 677 C LEU 84 2.809 23.171 44.517 1.00 0.00 ATOM 678 N MET 85 3.121 23.556 45.746 1.00 0.00 ATOM 679 CA MET 85 4.469 23.422 46.255 1.00 0.00 ATOM 680 CB MET 85 5.196 24.778 46.189 1.00 0.00 ATOM 681 CG MET 85 6.689 24.709 46.527 1.00 0.00 ATOM 682 SD MET 85 7.566 26.428 46.021 1.00 0.00 ATOM 683 CE MET 85 9.426 25.942 46.495 1.00 0.00 ATOM 684 O MET 85 3.593 23.514 48.484 1.00 0.00 ATOM 685 C MET 85 4.339 22.929 47.685 1.00 0.00 ATOM 686 N ALA 86 5.031 21.832 47.995 1.00 0.00 ATOM 687 CA ALA 86 5.031 21.245 49.343 1.00 0.00 ATOM 688 CB ALA 86 4.693 19.716 49.261 1.00 0.00 ATOM 689 O ALA 86 7.402 21.453 49.289 1.00 0.00 ATOM 690 C ALA 86 6.391 21.448 49.977 1.00 0.00 ATOM 691 N VAL 87 6.426 21.587 51.300 1.00 0.00 ATOM 692 CA VAL 87 7.680 21.566 52.007 1.00 0.00 ATOM 693 CB VAL 87 7.911 22.834 52.851 1.00 0.00 ATOM 694 CG1 VAL 87 9.218 22.673 53.657 1.00 0.00 ATOM 695 CG2 VAL 87 8.009 24.093 51.945 1.00 0.00 ATOM 696 O VAL 87 6.684 20.160 53.681 1.00 0.00 ATOM 697 C VAL 87 7.634 20.326 52.901 1.00 0.00 ATOM 698 N PHE 88 8.640 19.467 52.765 1.00 0.00 ATOM 699 CA PHE 88 8.759 18.253 53.571 1.00 0.00 ATOM 700 CB PHE 88 8.945 17.027 52.677 1.00 0.00 ATOM 701 CG PHE 88 7.750 16.701 51.828 1.00 0.00 ATOM 702 CD1 PHE 88 6.584 16.174 52.396 1.00 0.00 ATOM 703 CD2 PHE 88 7.808 16.868 50.451 1.00 0.00 ATOM 704 CE1 PHE 88 5.469 15.860 51.593 1.00 0.00 ATOM 705 CE2 PHE 88 6.709 16.526 49.637 1.00 0.00 ATOM 706 CZ PHE 88 5.540 16.028 50.220 1.00 0.00 ATOM 707 O PHE 88 10.959 19.006 54.082 1.00 0.00 ATOM 708 C PHE 88 9.977 18.339 54.443 1.00 0.00 ATOM 709 N ASP 89 9.937 17.632 55.578 1.00 0.00 ATOM 710 CA ASP 89 11.111 17.429 56.387 1.00 0.00 ATOM 711 CB ASP 89 10.746 16.664 57.663 1.00 0.00 ATOM 712 CG ASP 89 10.059 17.528 58.703 1.00 0.00 ATOM 713 OD1 ASP 89 9.903 18.756 58.495 1.00 0.00 ATOM 714 OD2 ASP 89 9.692 16.950 59.743 1.00 0.00 ATOM 715 O ASP 89 11.825 15.561 55.035 1.00 0.00 ATOM 716 C ASP 89 12.144 16.598 55.642 1.00 0.00 ATOM 717 N LEU 90 13.390 17.044 55.718 1.00 0.00 ATOM 718 CA LEU 90 14.519 16.252 55.289 1.00 0.00 ATOM 719 CB LEU 90 15.769 17.119 55.437 1.00 0.00 ATOM 720 CG LEU 90 16.960 17.036 54.499 1.00 0.00 ATOM 721 CD1 LEU 90 16.538 17.124 53.059 1.00 0.00 ATOM 722 CD2 LEU 90 17.918 18.172 54.831 1.00 0.00 ATOM 723 O LEU 90 14.517 15.185 57.439 1.00 0.00 ATOM 724 C LEU 90 14.574 15.029 56.217 1.00 0.00 ATOM 725 N PRO 91 14.635 13.808 55.651 1.00 0.00 ATOM 726 CA PRO 91 14.668 12.593 56.452 1.00 0.00 ATOM 727 CB PRO 91 14.955 11.490 55.430 1.00 0.00 ATOM 728 CG PRO 91 14.523 12.018 54.164 1.00 0.00 ATOM 729 CD PRO 91 14.652 13.515 54.211 1.00 0.00 ATOM 730 O PRO 91 16.872 13.183 57.140 1.00 0.00 ATOM 731 C PRO 91 15.801 12.661 57.454 1.00 0.00 ATOM 732 N ALA 92 15.543 12.181 58.660 1.00 0.00 ATOM 733 CA ALA 92 16.517 12.259 59.718 1.00 0.00 ATOM 734 CB ALA 92 15.920 11.743 61.021 1.00 0.00 ATOM 735 O ALA 92 17.655 10.180 59.450 1.00 0.00 ATOM 736 C ALA 92 17.684 11.402 59.271 1.00 0.00 ATOM 737 N GLU 93 18.695 12.054 58.683 1.00 0.00 ATOM 738 CA GLU 93 19.801 11.381 57.970 1.00 0.00 ATOM 739 CB GLU 93 21.013 12.304 57.820 1.00 0.00 ATOM 740 CG GLU 93 21.938 11.923 56.664 1.00 0.00 ATOM 741 CD GLU 93 22.738 13.102 56.134 1.00 0.00 ATOM 742 OE1 GLU 93 23.969 13.137 56.364 1.00 0.00 ATOM 743 OE2 GLU 93 22.139 13.991 55.488 1.00 0.00 ATOM 744 O GLU 93 20.754 9.870 59.602 1.00 0.00 ATOM 745 C GLU 93 20.200 10.000 58.506 1.00 0.00 ATOM 746 N PRO 94 19.926 8.957 57.707 1.00 0.00 ATOM 747 CA PRO 94 19.987 7.606 58.242 1.00 0.00 ATOM 748 CB PRO 94 19.003 6.849 57.349 1.00 0.00 ATOM 749 CG PRO 94 19.126 7.537 55.998 1.00 0.00 ATOM 750 CD PRO 94 19.554 8.973 56.277 1.00 0.00 ATOM 751 O PRO 94 22.229 7.356 57.377 1.00 0.00 ATOM 752 C PRO 94 21.379 6.962 58.186 1.00 0.00 ATOM 753 N GLU 95 21.601 6.012 59.087 1.00 0.00 ATOM 754 CA GLU 95 22.648 5.032 58.912 1.00 0.00 ATOM 755 CB GLU 95 22.506 3.934 59.961 1.00 0.00 ATOM 756 CG GLU 95 23.638 3.808 60.919 1.00 0.00 ATOM 757 CD GLU 95 24.977 3.748 60.237 1.00 0.00 ATOM 758 OE1 GLU 95 25.206 2.809 59.420 1.00 0.00 ATOM 759 OE2 GLU 95 25.795 4.649 60.537 1.00 0.00 ATOM 760 O GLU 95 21.280 4.195 57.115 1.00 0.00 ATOM 761 C GLU 95 22.434 4.411 57.528 1.00 0.00 ATOM 762 N PRO 96 23.522 4.174 56.775 1.00 0.00 ATOM 763 CA PRO 96 23.305 3.431 55.529 1.00 0.00 ATOM 764 CB PRO 96 24.693 3.409 54.886 1.00 0.00 ATOM 765 CG PRO 96 25.644 3.633 55.997 1.00 0.00 ATOM 766 CD PRO 96 24.935 4.552 56.951 1.00 0.00 ATOM 767 O PRO 96 23.376 1.364 56.748 1.00 0.00 ATOM 768 C PRO 96 22.855 2.002 55.827 1.00 0.00 ATOM 769 N VAL 97 21.912 1.518 55.027 1.00 0.00 ATOM 770 CA VAL 97 21.306 0.225 55.200 1.00 0.00 ATOM 771 CB VAL 97 19.780 0.400 55.544 1.00 0.00 ATOM 772 CG1 VAL 97 18.984 -0.874 55.284 1.00 0.00 ATOM 773 CG2 VAL 97 19.602 0.886 56.999 1.00 0.00 ATOM 774 O VAL 97 21.411 0.069 52.787 1.00 0.00 ATOM 775 C VAL 97 21.513 -0.533 53.878 1.00 0.00 ATOM 776 N VAL 98 21.858 -1.818 53.970 1.00 0.00 ATOM 777 CA VAL 98 21.876 -2.703 52.780 1.00 0.00 ATOM 778 CB VAL 98 23.152 -3.611 52.680 1.00 0.00 ATOM 779 CG1 VAL 98 23.143 -4.435 51.355 1.00 0.00 ATOM 780 CG2 VAL 98 24.441 -2.800 52.753 1.00 0.00 ATOM 781 O VAL 98 20.514 -4.403 53.743 1.00 0.00 ATOM 782 C VAL 98 20.645 -3.599 52.832 1.00 0.00 ATOM 783 N GLU 99 19.730 -3.471 51.864 1.00 0.00 ATOM 784 CA GLU 99 18.600 -4.408 51.785 1.00 0.00 ATOM 785 CB GLU 99 17.280 -3.801 52.303 1.00 0.00 ATOM 786 CG GLU 99 17.286 -3.561 53.826 1.00 0.00 ATOM 787 CD GLU 99 16.081 -2.785 54.384 1.00 0.00 ATOM 788 OE1 GLU 99 15.690 -3.118 55.534 1.00 0.00 ATOM 789 OE2 GLU 99 15.556 -1.848 53.713 1.00 0.00 ATOM 790 O GLU 99 18.076 -3.903 49.524 1.00 0.00 ATOM 791 C GLU 99 18.507 -4.733 50.307 1.00 0.00 ATOM 792 N GLY 100 18.974 -5.920 49.934 1.00 0.00 ATOM 793 CA GLY 100 19.142 -6.266 48.536 1.00 0.00 ATOM 794 O GLY 100 21.099 -4.833 48.516 1.00 0.00 ATOM 795 C GLY 100 20.245 -5.465 47.857 1.00 0.00 ATOM 796 N LEU 101 20.228 -5.482 46.527 1.00 0.00 ATOM 797 CA LEU 101 21.197 -4.746 45.762 1.00 0.00 ATOM 798 CB LEU 101 20.939 -4.964 44.266 1.00 0.00 ATOM 799 CG LEU 101 21.760 -4.083 43.333 1.00 0.00 ATOM 800 CD1 LEU 101 23.297 -4.354 43.583 1.00 0.00 ATOM 801 CD2 LEU 101 21.334 -4.392 41.875 1.00 0.00 ATOM 802 O LEU 101 19.970 -2.668 46.030 1.00 0.00 ATOM 803 C LEU 101 21.072 -3.258 46.109 1.00 0.00 ATOM 804 N THR 102 22.209 -2.679 46.471 1.00 0.00 ATOM 805 CA THR 102 22.296 -1.327 46.989 1.00 0.00 ATOM 806 CB THR 102 22.739 -1.386 48.461 1.00 0.00 ATOM 807 CG2 THR 102 22.917 0.032 49.068 1.00 0.00 ATOM 808 OG1 THR 102 21.748 -2.112 49.206 1.00 0.00 ATOM 809 O THR 102 24.459 -1.067 46.000 1.00 0.00 ATOM 810 C THR 102 23.330 -0.589 46.157 1.00 0.00 ATOM 811 N LEU 103 22.946 0.569 45.617 1.00 0.00 ATOM 812 CA LEU 103 23.841 1.369 44.802 1.00 0.00 ATOM 813 CB LEU 103 23.069 2.144 43.721 1.00 0.00 ATOM 814 CG LEU 103 22.163 1.299 42.858 1.00 0.00 ATOM 815 CD1 LEU 103 21.543 2.250 41.813 1.00 0.00 ATOM 816 CD2 LEU 103 22.961 0.140 42.214 1.00 0.00 ATOM 817 O LEU 103 24.061 2.911 46.623 1.00 0.00 ATOM 818 C LEU 103 24.609 2.345 45.650 1.00 0.00 ATOM 819 N LEU 104 25.890 2.506 45.321 1.00 0.00 ATOM 820 CA LEU 104 26.663 3.587 45.885 1.00 0.00 ATOM 821 CB LEU 104 27.827 3.065 46.740 1.00 0.00 ATOM 822 CG LEU 104 28.653 4.096 47.541 1.00 0.00 ATOM 823 CD1 LEU 104 29.598 4.893 46.674 1.00 0.00 ATOM 824 CD2 LEU 104 27.813 5.040 48.323 1.00 0.00 ATOM 825 O LEU 104 27.840 3.948 43.828 1.00 0.00 ATOM 826 C LEU 104 27.180 4.445 44.735 1.00 0.00 ATOM 827 N LEU 105 26.869 5.728 44.787 1.00 0.00 ATOM 828 CA LEU 105 27.325 6.674 43.773 1.00 0.00 ATOM 829 CB LEU 105 26.221 7.677 43.443 1.00 0.00 ATOM 830 CG LEU 105 24.874 7.068 43.040 1.00 0.00 ATOM 831 CD1 LEU 105 24.037 8.182 42.429 1.00 0.00 ATOM 832 CD2 LEU 105 25.057 5.886 42.049 1.00 0.00 ATOM 833 O LEU 105 28.396 8.214 45.254 1.00 0.00 ATOM 834 C LEU 105 28.529 7.398 44.337 1.00 0.00 ATOM 835 N ASP 106 29.710 7.099 43.795 1.00 0.00 ATOM 836 CA ASP 106 30.980 7.707 44.282 1.00 0.00 ATOM 837 CB ASP 106 32.131 6.678 44.184 1.00 0.00 ATOM 838 CG ASP 106 33.485 7.238 44.623 1.00 0.00 ATOM 839 OD1 ASP 106 33.518 8.177 45.447 1.00 0.00 ATOM 840 OD2 ASP 106 34.542 6.713 44.173 1.00 0.00 ATOM 841 O ASP 106 31.906 8.726 42.329 1.00 0.00 ATOM 842 C ASP 106 31.336 8.913 43.409 1.00 0.00 ATOM 843 N GLY 107 31.015 10.126 43.857 1.00 0.00 ATOM 844 CA GLY 107 31.392 11.340 43.116 1.00 0.00 ATOM 845 O GLY 107 31.184 12.035 40.825 1.00 0.00 ATOM 846 C GLY 107 30.639 11.516 41.804 1.00 0.00 ATOM 847 N VAL 108 29.368 11.112 41.793 1.00 0.00 ATOM 848 CA VAL 108 28.501 11.289 40.627 1.00 0.00 ATOM 849 CB VAL 108 27.455 10.172 40.510 1.00 0.00 ATOM 850 CG1 VAL 108 26.505 10.439 39.316 1.00 0.00 ATOM 851 CG2 VAL 108 28.148 8.833 40.301 1.00 0.00 ATOM 852 O VAL 108 26.824 12.829 41.481 1.00 0.00 ATOM 853 C VAL 108 27.861 12.670 40.808 1.00 0.00 ATOM 854 N GLN 109 28.527 13.672 40.241 1.00 0.00 ATOM 855 CA GLN 109 28.212 15.071 40.532 1.00 0.00 ATOM 856 CB GLN 109 29.426 15.976 40.301 1.00 0.00 ATOM 857 CG GLN 109 30.708 15.344 40.781 1.00 0.00 ATOM 858 CD GLN 109 31.746 16.342 41.211 1.00 0.00 ATOM 859 OE1 GLN 109 31.890 17.416 40.609 1.00 0.00 ATOM 860 NE2 GLN 109 32.482 16.000 42.271 1.00 0.00 ATOM 861 O GLN 109 26.345 16.497 40.170 1.00 0.00 ATOM 862 C GLN 109 27.030 15.585 39.737 1.00 0.00 ATOM 863 N ASP 110 26.789 15.016 38.571 1.00 0.00 ATOM 864 CA ASP 110 25.791 15.589 37.687 1.00 0.00 ATOM 865 CB ASP 110 25.974 15.073 36.264 1.00 0.00 ATOM 866 CG ASP 110 24.977 15.698 35.298 1.00 0.00 ATOM 867 OD1 ASP 110 25.129 16.878 34.982 1.00 0.00 ATOM 868 OD2 ASP 110 24.027 15.012 34.886 1.00 0.00 ATOM 869 O ASP 110 23.992 14.146 38.337 1.00 0.00 ATOM 870 C ASP 110 24.369 15.299 38.179 1.00 0.00 ATOM 871 N PRO 111 23.585 16.361 38.436 1.00 0.00 ATOM 872 CA PRO 111 22.188 16.219 38.860 1.00 0.00 ATOM 873 CB PRO 111 21.690 17.679 38.932 1.00 0.00 ATOM 874 CG PRO 111 22.907 18.477 39.113 1.00 0.00 ATOM 875 CD PRO 111 24.007 17.773 38.397 1.00 0.00 ATOM 876 O PRO 111 20.537 14.582 38.327 1.00 0.00 ATOM 877 C PRO 111 21.348 15.398 37.890 1.00 0.00 ATOM 878 N GLY 112 21.538 15.614 36.585 1.00 0.00 ATOM 879 CA GLY 112 20.844 14.822 35.565 1.00 0.00 ATOM 880 O GLY 112 20.144 12.542 35.734 1.00 0.00 ATOM 881 C GLY 112 21.096 13.338 35.719 1.00 0.00 ATOM 882 N ASN 113 22.375 12.958 35.819 1.00 0.00 ATOM 883 CA ASN 113 22.762 11.564 35.990 1.00 0.00 ATOM 884 CB ASN 113 24.293 11.397 35.994 1.00 0.00 ATOM 885 CG ASN 113 24.905 11.618 34.617 1.00 0.00 ATOM 886 ND2 ASN 113 26.186 11.990 34.576 1.00 0.00 ATOM 887 OD1 ASN 113 24.226 11.487 33.602 1.00 0.00 ATOM 888 O ASN 113 21.652 9.841 37.241 1.00 0.00 ATOM 889 C ASN 113 22.158 10.972 37.267 1.00 0.00 ATOM 890 N VAL 114 22.176 11.739 38.368 1.00 0.00 ATOM 891 CA VAL 114 21.678 11.200 39.637 1.00 0.00 ATOM 892 CB VAL 114 22.049 12.082 40.871 1.00 0.00 ATOM 893 CG1 VAL 114 21.306 11.605 42.134 1.00 0.00 ATOM 894 CG2 VAL 114 23.587 12.066 41.125 1.00 0.00 ATOM 895 O VAL 114 19.699 9.883 39.963 1.00 0.00 ATOM 896 C VAL 114 20.174 10.942 39.546 1.00 0.00 ATOM 897 N GLY 115 19.437 11.890 38.963 1.00 0.00 ATOM 898 CA GLY 115 18.000 11.723 38.737 1.00 0.00 ATOM 899 O GLY 115 16.749 9.748 38.190 1.00 0.00 ATOM 900 C GLY 115 17.689 10.501 37.895 1.00 0.00 ATOM 901 N THR 116 18.423 10.348 36.798 1.00 0.00 ATOM 902 CA THR 116 18.226 9.192 35.931 1.00 0.00 ATOM 903 CB THR 116 19.106 9.280 34.678 1.00 0.00 ATOM 904 CG2 THR 116 18.880 8.077 33.758 1.00 0.00 ATOM 905 OG1 THR 116 18.771 10.487 33.972 1.00 0.00 ATOM 906 O THR 116 17.738 6.916 36.534 1.00 0.00 ATOM 907 C THR 116 18.477 7.895 36.704 1.00 0.00 ATOM 908 N ILE 117 19.544 7.874 37.493 1.00 0.00 ATOM 909 CA ILE 117 19.891 6.704 38.310 1.00 0.00 ATOM 910 CB ILE 117 21.272 6.846 38.992 1.00 0.00 ATOM 911 CG1 ILE 117 22.348 6.636 37.929 1.00 0.00 ATOM 912 CG2 ILE 117 21.447 5.803 40.130 1.00 0.00 ATOM 913 CD1 ILE 117 23.724 7.270 38.318 1.00 0.00 ATOM 914 O ILE 117 18.414 5.234 39.472 1.00 0.00 ATOM 915 C ILE 117 18.783 6.400 39.310 1.00 0.00 ATOM 916 N LEU 118 18.268 7.433 39.983 1.00 0.00 ATOM 917 CA LEU 118 17.135 7.226 40.892 1.00 0.00 ATOM 918 CB LEU 118 16.705 8.534 41.577 1.00 0.00 ATOM 919 CG LEU 118 17.686 9.115 42.606 1.00 0.00 ATOM 920 CD1 LEU 118 17.140 10.469 43.104 1.00 0.00 ATOM 921 CD2 LEU 118 17.878 8.133 43.784 1.00 0.00 ATOM 922 O LEU 118 15.264 5.725 40.765 1.00 0.00 ATOM 923 C LEU 118 15.934 6.580 40.190 1.00 0.00 ATOM 924 N ARG 119 15.604 7.055 38.982 1.00 0.00 ATOM 925 CA ARG 119 14.486 6.482 38.223 1.00 0.00 ATOM 926 CB ARG 119 14.181 7.314 36.976 1.00 0.00 ATOM 927 CG ARG 119 13.732 8.726 37.325 1.00 0.00 ATOM 928 CD ARG 119 13.453 9.590 36.097 1.00 0.00 ATOM 929 NE ARG 119 12.705 8.827 35.114 1.00 0.00 ATOM 930 CZ ARG 119 12.321 9.273 33.922 1.00 0.00 ATOM 931 NH1 ARG 119 12.587 10.520 33.536 1.00 0.00 ATOM 932 NH2 ARG 119 11.661 8.458 33.115 1.00 0.00 ATOM 933 O ARG 119 13.838 4.184 37.881 1.00 0.00 ATOM 934 C ARG 119 14.752 5.031 37.837 1.00 0.00 ATOM 935 N THR 120 15.988 4.739 37.446 1.00 0.00 ATOM 936 CA THR 120 16.386 3.361 37.140 1.00 0.00 ATOM 937 CB THR 120 17.830 3.316 36.596 1.00 0.00 ATOM 938 CG2 THR 120 18.385 1.859 36.594 1.00 0.00 ATOM 939 OG1 THR 120 17.827 3.826 35.261 1.00 0.00 ATOM 940 O THR 120 15.741 1.366 38.294 1.00 0.00 ATOM 941 C THR 120 16.285 2.459 38.372 1.00 0.00 ATOM 942 N ALA 121 16.800 2.935 39.506 1.00 0.00 ATOM 943 CA ALA 121 16.707 2.214 40.779 1.00 0.00 ATOM 944 CB ALA 121 17.366 3.050 41.903 1.00 0.00 ATOM 945 O ALA 121 14.875 0.799 41.470 1.00 0.00 ATOM 946 C ALA 121 15.230 1.916 41.111 1.00 0.00 ATOM 947 N ASP 122 14.360 2.902 40.943 1.00 0.00 ATOM 948 CA ASP 122 12.949 2.694 41.196 1.00 0.00 ATOM 949 CB ASP 122 12.166 4.019 41.139 1.00 0.00 ATOM 950 CG ASP 122 10.744 3.882 41.634 1.00 0.00 ATOM 951 OD1 ASP 122 10.451 3.047 42.519 1.00 0.00 ATOM 952 OD2 ASP 122 9.896 4.624 41.138 1.00 0.00 ATOM 953 O ASP 122 11.626 0.768 40.685 1.00 0.00 ATOM 954 C ASP 122 12.359 1.665 40.239 1.00 0.00 ATOM 955 N TRP 123 12.650 1.802 38.945 1.00 0.00 ATOM 956 CA TRP 123 12.134 0.878 37.923 1.00 0.00 ATOM 957 CB TRP 123 12.752 1.200 36.541 1.00 0.00 ATOM 958 CG TRP 123 12.075 0.462 35.406 1.00 0.00 ATOM 959 CD1 TRP 123 12.370 -0.788 34.912 1.00 0.00 ATOM 960 CD2 TRP 123 10.966 0.939 34.655 1.00 0.00 ATOM 961 CE2 TRP 123 10.633 -0.063 33.711 1.00 0.00 ATOM 962 CE3 TRP 123 10.222 2.130 34.682 1.00 0.00 ATOM 963 NE1 TRP 123 11.506 -1.107 33.888 1.00 0.00 ATOM 964 CZ2 TRP 123 9.592 0.095 32.797 1.00 0.00 ATOM 965 CZ3 TRP 123 9.176 2.278 33.787 1.00 0.00 ATOM 966 CH2 TRP 123 8.875 1.263 32.852 1.00 0.00 ATOM 967 O TRP 123 11.576 -1.468 38.158 1.00 0.00 ATOM 968 C TRP 123 12.436 -0.592 38.291 1.00 0.00 ATOM 969 N PHE 124 13.679 -0.854 38.709 1.00 0.00 ATOM 970 CA PHE 124 14.129 -2.235 38.976 1.00 0.00 ATOM 971 CB PHE 124 15.568 -2.390 38.528 1.00 0.00 ATOM 972 CG PHE 124 15.703 -2.391 37.018 1.00 0.00 ATOM 973 CD1 PHE 124 15.223 -3.472 36.267 1.00 0.00 ATOM 974 CD2 PHE 124 16.227 -1.281 36.359 1.00 0.00 ATOM 975 CE1 PHE 124 15.299 -3.478 34.864 1.00 0.00 ATOM 976 CE2 PHE 124 16.346 -1.293 34.952 1.00 0.00 ATOM 977 CZ PHE 124 15.865 -2.379 34.220 1.00 0.00 ATOM 978 O PHE 124 14.231 -3.850 40.791 1.00 0.00 ATOM 979 C PHE 124 13.946 -2.688 40.432 1.00 0.00 ATOM 980 N GLY 125 13.480 -1.779 41.270 1.00 0.00 ATOM 981 CA GLY 125 13.092 -2.118 42.654 1.00 0.00 ATOM 982 O GLY 125 14.235 -2.741 44.682 1.00 0.00 ATOM 983 C GLY 125 14.268 -2.078 43.631 1.00 0.00 ATOM 984 N ILE 126 15.314 -1.314 43.290 1.00 0.00 ATOM 985 CA ILE 126 16.393 -1.024 44.232 1.00 0.00 ATOM 986 CB ILE 126 17.521 -0.157 43.556 1.00 0.00 ATOM 987 CG1 ILE 126 18.206 -0.928 42.409 1.00 0.00 ATOM 988 CG2 ILE 126 18.510 0.434 44.614 1.00 0.00 ATOM 989 CD1 ILE 126 19.498 -1.568 42.700 1.00 0.00 ATOM 990 O ILE 126 15.121 0.740 45.267 1.00 0.00 ATOM 991 C ILE 126 15.839 -0.244 45.437 1.00 0.00 ATOM 992 N ARG 127 16.114 -0.693 46.651 1.00 0.00 ATOM 993 CA ARG 127 15.533 -0.024 47.817 1.00 0.00 ATOM 994 CB ARG 127 15.165 -1.064 48.877 1.00 0.00 ATOM 995 CG ARG 127 13.982 -1.937 48.393 1.00 0.00 ATOM 996 CD ARG 127 14.004 -3.270 49.053 1.00 0.00 ATOM 997 NE ARG 127 13.730 -3.170 50.482 1.00 0.00 ATOM 998 CZ ARG 127 13.166 -4.139 51.184 1.00 0.00 ATOM 999 NH1 ARG 127 12.809 -5.255 50.563 1.00 0.00 ATOM 1000 NH2 ARG 127 12.941 -3.990 52.485 1.00 0.00 ATOM 1001 O ARG 127 15.857 1.902 49.195 1.00 0.00 ATOM 1002 C ARG 127 16.380 1.055 48.437 1.00 0.00 ATOM 1003 N HIS 128 17.684 1.030 48.149 1.00 0.00 ATOM 1004 CA HIS 128 18.615 1.964 48.799 1.00 0.00 ATOM 1005 CB HIS 128 19.345 1.315 50.011 1.00 0.00 ATOM 1006 CG HIS 128 18.430 0.997 51.140 1.00 0.00 ATOM 1007 CD2 HIS 128 17.725 -0.122 51.428 1.00 0.00 ATOM 1008 ND1 HIS 128 18.087 1.925 52.094 1.00 0.00 ATOM 1009 CE1 HIS 128 17.229 1.382 52.943 1.00 0.00 ATOM 1010 NE2 HIS 128 16.994 0.140 52.562 1.00 0.00 ATOM 1011 O HIS 128 20.216 1.648 47.098 1.00 0.00 ATOM 1012 C HIS 128 19.637 2.443 47.846 1.00 0.00 ATOM 1013 N VAL 129 19.865 3.754 47.876 1.00 0.00 ATOM 1014 CA VAL 129 20.899 4.380 47.029 1.00 0.00 ATOM 1015 CB VAL 129 20.321 5.226 45.843 1.00 0.00 ATOM 1016 CG1 VAL 129 21.432 6.012 45.134 1.00 0.00 ATOM 1017 CG2 VAL 129 19.567 4.335 44.826 1.00 0.00 ATOM 1018 O VAL 129 21.180 6.181 48.625 1.00 0.00 ATOM 1019 C VAL 129 21.709 5.259 47.974 1.00 0.00 ATOM 1020 N TRP 130 23.000 4.971 48.056 1.00 0.00 ATOM 1021 CA TRP 130 23.868 5.746 48.902 1.00 0.00 ATOM 1022 CB TRP 130 24.881 4.842 49.629 1.00 0.00 ATOM 1023 CG TRP 130 24.327 3.723 50.470 1.00 0.00 ATOM 1024 CD1 TRP 130 23.043 3.560 50.942 1.00 0.00 ATOM 1025 CD2 TRP 130 25.094 2.667 50.991 1.00 0.00 ATOM 1026 CE2 TRP 130 24.230 1.837 51.734 1.00 0.00 ATOM 1027 CE3 TRP 130 26.447 2.313 50.868 1.00 0.00 ATOM 1028 NE1 TRP 130 22.977 2.405 51.698 1.00 0.00 ATOM 1029 CZ2 TRP 130 24.674 0.668 52.361 1.00 0.00 ATOM 1030 CZ3 TRP 130 26.898 1.146 51.501 1.00 0.00 ATOM 1031 CH2 TRP 130 26.001 0.346 52.254 1.00 0.00 ATOM 1032 O TRP 130 24.976 6.443 46.903 1.00 0.00 ATOM 1033 C TRP 130 24.648 6.731 48.061 1.00 0.00 ATOM 1034 N LEU 131 24.957 7.881 48.636 1.00 0.00 ATOM 1035 CA LEU 131 25.629 8.944 47.895 1.00 0.00 ATOM 1036 CB LEU 131 24.704 10.173 47.777 1.00 0.00 ATOM 1037 CG LEU 131 23.468 9.702 47.021 1.00 0.00 ATOM 1038 CD1 LEU 131 22.151 9.942 47.771 1.00 0.00 ATOM 1039 CD2 LEU 131 23.436 10.140 45.569 1.00 0.00 ATOM 1040 O LEU 131 27.008 9.767 49.709 1.00 0.00 ATOM 1041 C LEU 131 26.952 9.296 48.558 1.00 0.00 ATOM 1042 N GLY 132 28.040 9.046 47.853 1.00 0.00 ATOM 1043 CA GLY 132 29.350 9.309 48.435 1.00 0.00 ATOM 1044 O GLY 132 29.104 11.560 47.679 1.00 0.00 ATOM 1045 C GLY 132 29.842 10.712 48.181 1.00 0.00 ATOM 1046 N THR 133 31.119 10.921 48.501 1.00 0.00 ATOM 1047 CA THR 133 31.808 12.187 48.401 1.00 0.00 ATOM 1048 CB THR 133 33.345 11.972 48.609 1.00 0.00 ATOM 1049 CG2 THR 133 34.143 13.286 48.460 1.00 0.00 ATOM 1050 OG1 THR 133 33.574 11.419 49.910 1.00 0.00 ATOM 1051 O THR 133 31.947 12.308 46.025 1.00 0.00 ATOM 1052 C THR 133 31.597 12.864 47.057 1.00 0.00 ATOM 1053 N GLY 134 31.022 14.056 47.079 1.00 0.00 ATOM 1054 CA GLY 134 30.949 14.867 45.882 1.00 0.00 ATOM 1055 O GLY 134 29.629 15.178 43.931 1.00 0.00 ATOM 1056 C GLY 134 29.772 14.550 44.970 1.00 0.00 ATOM 1057 N SER 135 28.925 13.609 45.351 1.00 0.00 ATOM 1058 CA SER 135 27.710 13.315 44.557 1.00 0.00 ATOM 1059 CB SER 135 27.145 11.946 44.921 1.00 0.00 ATOM 1060 OG SER 135 28.049 10.934 44.490 1.00 0.00 ATOM 1061 O SER 135 26.648 15.184 45.656 1.00 0.00 ATOM 1062 C SER 135 26.647 14.415 44.692 1.00 0.00 ATOM 1063 N ALA 136 25.788 14.535 43.688 1.00 0.00 ATOM 1064 CA ALA 136 24.735 15.564 43.676 1.00 0.00 ATOM 1065 CB ALA 136 23.942 15.505 42.361 1.00 0.00 ATOM 1066 O ALA 136 23.640 14.307 45.395 1.00 0.00 ATOM 1067 C ALA 136 23.803 15.409 44.873 1.00 0.00 ATOM 1068 N ASP 137 23.211 16.514 45.315 1.00 0.00 ATOM 1069 CA ASP 137 22.270 16.501 46.436 1.00 0.00 ATOM 1070 CB ASP 137 22.153 17.930 47.027 1.00 0.00 ATOM 1071 CG ASP 137 21.221 18.020 48.242 1.00 0.00 ATOM 1072 OD1 ASP 137 20.549 17.040 48.614 1.00 0.00 ATOM 1073 OD2 ASP 137 21.170 19.105 48.848 1.00 0.00 ATOM 1074 O ASP 137 20.254 16.693 45.150 1.00 0.00 ATOM 1075 C ASP 137 20.901 16.001 45.931 1.00 0.00 ATOM 1076 N VAL 138 20.450 14.835 46.389 1.00 0.00 ATOM 1077 CA VAL 138 19.184 14.251 45.888 1.00 0.00 ATOM 1078 CB VAL 138 18.947 12.776 46.325 1.00 0.00 ATOM 1079 CG1 VAL 138 19.959 11.856 45.664 1.00 0.00 ATOM 1080 CG2 VAL 138 18.972 12.641 47.865 1.00 0.00 ATOM 1081 O VAL 138 16.934 15.012 45.527 1.00 0.00 ATOM 1082 C VAL 138 17.950 15.094 46.230 1.00 0.00 ATOM 1083 N PHE 139 18.060 15.912 47.275 1.00 0.00 ATOM 1084 CA PHE 139 16.948 16.762 47.712 1.00 0.00 ATOM 1085 CB PHE 139 16.849 16.777 49.231 1.00 0.00 ATOM 1086 CG PHE 139 16.519 15.422 49.801 1.00 0.00 ATOM 1087 CD1 PHE 139 15.263 14.861 49.587 1.00 0.00 ATOM 1088 CD2 PHE 139 17.471 14.699 50.510 1.00 0.00 ATOM 1089 CE1 PHE 139 14.952 13.595 50.069 1.00 0.00 ATOM 1090 CE2 PHE 139 17.163 13.430 51.015 1.00 0.00 ATOM 1091 CZ PHE 139 15.905 12.883 50.790 1.00 0.00 ATOM 1092 O PHE 139 16.148 19.015 47.456 1.00 0.00 ATOM 1093 C PHE 139 16.987 18.164 47.124 1.00 0.00 ATOM 1094 N SER 140 17.963 18.410 46.252 1.00 0.00 ATOM 1095 CA SER 140 18.028 19.687 45.521 1.00 0.00 ATOM 1096 CB SER 140 19.364 19.828 44.776 1.00 0.00 ATOM 1097 OG SER 140 19.465 18.820 43.772 1.00 0.00 ATOM 1098 O SER 140 16.454 18.598 44.096 1.00 0.00 ATOM 1099 C SER 140 16.846 19.671 44.534 1.00 0.00 ATOM 1100 N PRO 141 16.246 20.845 44.235 1.00 0.00 ATOM 1101 CA PRO 141 15.156 20.938 43.258 1.00 0.00 ATOM 1102 CB PRO 141 15.034 22.436 43.022 1.00 0.00 ATOM 1103 CG PRO 141 15.462 23.051 44.315 1.00 0.00 ATOM 1104 CD PRO 141 16.539 22.155 44.855 1.00 0.00 ATOM 1105 O PRO 141 14.596 19.633 41.321 1.00 0.00 ATOM 1106 C PRO 141 15.472 20.256 41.929 1.00 0.00 ATOM 1107 N LYS 142 16.709 20.392 41.461 1.00 0.00 ATOM 1108 CA LYS 142 17.024 19.830 40.154 1.00 0.00 ATOM 1109 CB LYS 142 18.411 20.260 39.670 1.00 0.00 ATOM 1110 CG LYS 142 18.675 19.847 38.218 1.00 0.00 ATOM 1111 CD LYS 142 19.456 20.906 37.434 1.00 0.00 ATOM 1112 CE LYS 142 19.423 20.608 35.929 1.00 0.00 ATOM 1113 NZ LYS 142 19.903 21.768 35.076 1.00 0.00 ATOM 1114 O LYS 142 16.197 17.743 39.251 1.00 0.00 ATOM 1115 C LYS 142 16.839 18.300 40.158 1.00 0.00 ATOM 1116 N VAL 143 17.350 17.627 41.183 1.00 0.00 ATOM 1117 CA VAL 143 17.150 16.183 41.281 1.00 0.00 ATOM 1118 CB VAL 143 18.087 15.521 42.300 1.00 0.00 ATOM 1119 CG1 VAL 143 17.762 13.990 42.425 1.00 0.00 ATOM 1120 CG2 VAL 143 19.556 15.776 41.879 1.00 0.00 ATOM 1121 O VAL 143 15.139 14.972 40.875 1.00 0.00 ATOM 1122 C VAL 143 15.707 15.804 41.577 1.00 0.00 ATOM 1123 N VAL 144 15.110 16.441 42.588 1.00 0.00 ATOM 1124 CA VAL 144 13.732 16.134 42.998 1.00 0.00 ATOM 1125 CB VAL 144 13.236 17.090 44.125 1.00 0.00 ATOM 1126 CG1 VAL 144 11.708 17.064 44.252 1.00 0.00 ATOM 1127 CG2 VAL 144 13.912 16.717 45.451 1.00 0.00 ATOM 1128 O VAL 144 12.020 15.259 41.552 1.00 0.00 ATOM 1129 C VAL 144 12.767 16.212 41.825 1.00 0.00 ATOM 1130 N GLN 145 12.778 17.349 41.133 1.00 0.00 ATOM 1131 CA GLN 145 11.841 17.573 40.050 1.00 0.00 ATOM 1132 CB GLN 145 11.900 19.020 39.562 1.00 0.00 ATOM 1133 CG GLN 145 11.458 20.009 40.654 1.00 0.00 ATOM 1134 CD GLN 145 10.054 19.736 41.202 1.00 0.00 ATOM 1135 OE1 GLN 145 9.874 19.665 42.405 1.00 0.00 ATOM 1136 NE2 GLN 145 9.060 19.607 40.316 1.00 0.00 ATOM 1137 O GLN 145 11.084 16.396 38.108 1.00 0.00 ATOM 1138 C GLN 145 12.020 16.595 38.878 1.00 0.00 ATOM 1139 N ALA 146 13.206 16.000 38.762 1.00 0.00 ATOM 1140 CA ALA 146 13.490 15.031 37.698 1.00 0.00 ATOM 1141 CB ALA 146 14.871 15.287 37.122 1.00 0.00 ATOM 1142 O ALA 146 13.740 12.647 37.454 1.00 0.00 ATOM 1143 C ALA 146 13.384 13.582 38.194 1.00 0.00 ATOM 1144 N SER 147 12.881 13.399 39.419 1.00 0.00 ATOM 1145 CA SER 147 12.908 12.081 40.071 1.00 0.00 ATOM 1146 CB SER 147 12.978 12.252 41.614 1.00 0.00 ATOM 1147 OG SER 147 11.755 12.771 42.124 1.00 0.00 ATOM 1148 O SER 147 11.878 9.901 39.944 1.00 0.00 ATOM 1149 C SER 147 11.779 11.106 39.669 1.00 0.00 ATOM 1150 N MET 148 10.720 11.610 39.034 1.00 0.00 ATOM 1151 CA MET 148 9.580 10.771 38.600 1.00 0.00 ATOM 1152 CB MET 148 10.000 9.775 37.501 1.00 0.00 ATOM 1153 CG MET 148 9.553 10.109 36.082 1.00 0.00 ATOM 1154 SD MET 148 8.663 8.621 35.087 1.00 0.00 ATOM 1155 CE MET 148 9.208 7.047 36.118 1.00 0.00 ATOM 1156 O MET 148 8.390 8.901 39.541 1.00 0.00 ATOM 1157 C MET 148 8.927 9.993 39.750 1.00 0.00 ATOM 1158 N GLY 149 8.988 10.548 40.960 1.00 0.00 ATOM 1159 CA GLY 149 8.416 9.892 42.130 1.00 0.00 ATOM 1160 O GLY 149 8.899 8.190 43.723 1.00 0.00 ATOM 1161 C GLY 149 9.321 8.873 42.789 1.00 0.00 ATOM 1162 N ALA 150 10.567 8.764 42.321 1.00 0.00 ATOM 1163 CA ALA 150 11.441 7.684 42.817 1.00 0.00 ATOM 1164 CB ALA 150 12.756 7.647 42.053 1.00 0.00 ATOM 1165 O ALA 150 11.911 6.720 45.009 1.00 0.00 ATOM 1166 C ALA 150 11.701 7.759 44.340 1.00 0.00 ATOM 1167 N LEU 151 11.667 8.969 44.888 1.00 0.00 ATOM 1168 CA LEU 151 11.917 9.153 46.319 1.00 0.00 ATOM 1169 CB LEU 151 12.238 10.616 46.636 1.00 0.00 ATOM 1170 CG LEU 151 13.423 11.151 45.817 1.00 0.00 ATOM 1171 CD1 LEU 151 13.512 12.670 45.875 1.00 0.00 ATOM 1172 CD2 LEU 151 14.748 10.504 46.268 1.00 0.00 ATOM 1173 O LEU 151 10.960 8.534 48.435 1.00 0.00 ATOM 1174 C LEU 151 10.792 8.632 47.214 1.00 0.00 ATOM 1175 N ALA 152 9.668 8.262 46.620 1.00 0.00 ATOM 1176 CA ALA 152 8.630 7.563 47.365 1.00 0.00 ATOM 1177 CB ALA 152 7.325 7.501 46.553 1.00 0.00 ATOM 1178 O ALA 152 8.604 5.654 48.816 1.00 0.00 ATOM 1179 C ALA 152 9.070 6.166 47.794 1.00 0.00 ATOM 1180 N ARG 153 9.945 5.529 47.013 1.00 0.00 ATOM 1181 CA ARG 153 10.258 4.149 47.250 1.00 0.00 ATOM 1182 CB ARG 153 9.681 3.275 46.157 1.00 0.00 ATOM 1183 CG ARG 153 8.199 2.992 46.300 1.00 0.00 ATOM 1184 CD ARG 153 7.674 2.422 44.985 1.00 0.00 ATOM 1185 NE ARG 153 7.919 3.377 43.912 1.00 0.00 ATOM 1186 CZ ARG 153 7.100 4.374 43.611 1.00 0.00 ATOM 1187 NH1 ARG 153 5.969 4.536 44.298 1.00 0.00 ATOM 1188 NH2 ARG 153 7.412 5.210 42.625 1.00 0.00 ATOM 1189 O ARG 153 12.115 2.798 47.807 1.00 0.00 ATOM 1190 C ARG 153 11.743 3.870 47.359 1.00 0.00 ATOM 1191 N VAL 154 12.576 4.808 46.921 1.00 0.00 ATOM 1192 CA VAL 154 14.038 4.625 46.956 1.00 0.00 ATOM 1193 CB VAL 154 14.711 4.943 45.590 1.00 0.00 ATOM 1194 CG1 VAL 154 16.232 4.750 45.687 1.00 0.00 ATOM 1195 CG2 VAL 154 14.106 4.079 44.458 1.00 0.00 ATOM 1196 O VAL 154 14.424 6.782 48.003 1.00 0.00 ATOM 1197 C VAL 154 14.564 5.539 48.067 1.00 0.00 ATOM 1198 N GLN 155 15.112 4.922 49.114 1.00 0.00 ATOM 1199 CA GLN 155 15.677 5.689 50.222 1.00 0.00 ATOM 1200 CB GLN 155 15.676 4.912 51.547 1.00 0.00 ATOM 1201 CG GLN 155 16.256 5.788 52.701 1.00 0.00 ATOM 1202 CD GLN 155 16.567 5.030 53.991 1.00 0.00 ATOM 1203 OE1 GLN 155 17.472 4.179 54.043 1.00 0.00 ATOM 1204 NE2 GLN 155 15.853 5.378 55.056 1.00 0.00 ATOM 1205 O GLN 155 17.996 5.290 49.710 1.00 0.00 ATOM 1206 C GLN 155 17.114 6.135 49.918 1.00 0.00 ATOM 1207 N PRO 156 17.356 7.456 49.882 1.00 0.00 ATOM 1208 CA PRO 156 18.703 7.896 49.552 1.00 0.00 ATOM 1209 CB PRO 156 18.448 9.116 48.689 1.00 0.00 ATOM 1210 CG PRO 156 17.162 9.743 49.303 1.00 0.00 ATOM 1211 CD PRO 156 16.397 8.576 49.978 1.00 0.00 ATOM 1212 O PRO 156 18.970 8.811 51.739 1.00 0.00 ATOM 1213 C PRO 156 19.517 8.226 50.802 1.00 0.00 ATOM 1214 N THR 157 20.801 7.875 50.822 1.00 0.00 ATOM 1215 CA THR 157 21.586 8.030 52.038 1.00 0.00 ATOM 1216 CB THR 157 21.856 6.664 52.747 1.00 0.00 ATOM 1217 CG2 THR 157 22.639 6.881 54.057 1.00 0.00 ATOM 1218 OG1 THR 157 20.604 6.041 53.078 1.00 0.00 ATOM 1219 O THR 157 23.795 8.114 51.204 1.00 0.00 ATOM 1220 C THR 157 22.897 8.723 51.737 1.00 0.00 ATOM 1221 N PRO 158 23.000 10.023 52.066 1.00 0.00 ATOM 1222 CA PRO 158 24.324 10.658 51.962 1.00 0.00 ATOM 1223 CB PRO 158 24.040 12.124 52.325 1.00 0.00 ATOM 1224 CG PRO 158 22.532 12.274 52.171 1.00 0.00 ATOM 1225 CD PRO 158 21.947 10.963 52.504 1.00 0.00 ATOM 1226 O PRO 158 24.944 9.910 54.161 1.00 0.00 ATOM 1227 C PRO 158 25.282 10.021 52.973 1.00 0.00 ATOM 1228 N LEU 159 26.465 9.607 52.536 1.00 0.00 ATOM 1229 CA LEU 159 27.387 8.932 53.437 1.00 0.00 ATOM 1230 CB LEU 159 28.196 7.849 52.718 1.00 0.00 ATOM 1231 CG LEU 159 27.469 6.689 52.034 1.00 0.00 ATOM 1232 CD1 LEU 159 28.473 5.710 51.474 1.00 0.00 ATOM 1233 CD2 LEU 159 26.584 5.972 53.028 1.00 0.00 ATOM 1234 O LEU 159 28.740 10.887 53.465 1.00 0.00 ATOM 1235 C LEU 159 28.340 9.910 54.091 1.00 0.00 ATOM 1236 N LYS 160 28.681 9.642 55.354 1.00 0.00 ATOM 1237 CA LYS 160 29.672 10.414 56.087 1.00 0.00 ATOM 1238 CB LYS 160 29.582 10.114 57.588 1.00 0.00 ATOM 1239 CG LYS 160 28.353 10.618 58.312 1.00 0.00 ATOM 1240 CD LYS 160 28.542 10.443 59.822 1.00 0.00 ATOM 1241 CE LYS 160 27.241 10.670 60.577 1.00 0.00 ATOM 1242 NZ LYS 160 26.123 9.890 59.960 1.00 0.00 ATOM 1243 O LYS 160 31.961 10.905 55.431 1.00 0.00 ATOM 1244 C LYS 160 31.084 10.037 55.626 1.00 0.00 ATOM 1245 N ASN 161 31.319 8.734 55.505 1.00 0.00 ATOM 1246 CA ASN 161 32.661 8.227 55.211 1.00 0.00 ATOM 1247 CB ASN 161 33.426 7.879 56.487 1.00 0.00 ATOM 1248 CG ASN 161 34.914 7.491 56.228 1.00 0.00 ATOM 1249 ND2 ASN 161 35.727 7.618 57.265 1.00 0.00 ATOM 1250 OD1 ASN 161 35.305 7.066 55.137 1.00 0.00 ATOM 1251 O ASN 161 32.314 5.886 54.907 1.00 0.00 ATOM 1252 C ASN 161 32.463 6.992 54.370 1.00 0.00 ATOM 1253 N THR 162 32.475 7.194 53.061 1.00 0.00 ATOM 1254 CA THR 162 32.243 6.110 52.082 1.00 0.00 ATOM 1255 CB THR 162 32.479 6.616 50.634 1.00 0.00 ATOM 1256 CG2 THR 162 32.217 5.517 49.611 1.00 0.00 ATOM 1257 OG1 THR 162 31.619 7.736 50.380 1.00 0.00 ATOM 1258 O THR 162 32.691 3.768 52.376 1.00 0.00 ATOM 1259 C THR 162 33.149 4.907 52.322 1.00 0.00 ATOM 1260 N VAL 163 34.441 5.180 52.463 1.00 0.00 ATOM 1261 CA VAL 163 35.428 4.137 52.617 1.00 0.00 ATOM 1262 CB VAL 163 36.881 4.692 52.572 1.00 0.00 ATOM 1263 CG1 VAL 163 37.881 3.621 53.019 1.00 0.00 ATOM 1264 CG2 VAL 163 37.209 5.159 51.150 1.00 0.00 ATOM 1265 O VAL 163 35.141 2.123 53.821 1.00 0.00 ATOM 1266 C VAL 163 35.179 3.344 53.883 1.00 0.00 ATOM 1267 N ASP 164 34.959 4.038 55.000 1.00 0.00 ATOM 1268 CA ASP 164 34.682 3.410 56.303 1.00 0.00 ATOM 1269 CB ASP 164 34.373 4.476 57.349 1.00 0.00 ATOM 1270 CG ASP 164 35.536 4.822 58.206 1.00 0.00 ATOM 1271 OD1 ASP 164 35.269 5.105 59.403 1.00 0.00 ATOM 1272 OD2 ASP 164 36.700 4.821 57.713 1.00 0.00 ATOM 1273 O ASP 164 33.430 1.404 56.758 1.00 0.00 ATOM 1274 C ASP 164 33.441 2.512 56.215 1.00 0.00 ATOM 1275 N THR 165 32.394 3.022 55.567 1.00 0.00 ATOM 1276 CA THR 165 31.166 2.288 55.357 1.00 0.00 ATOM 1277 CB THR 165 30.113 3.182 54.689 1.00 0.00 ATOM 1278 CG2 THR 165 28.856 2.386 54.312 1.00 0.00 ATOM 1279 OG1 THR 165 29.749 4.198 55.622 1.00 0.00 ATOM 1280 O THR 165 30.926 -0.047 54.848 1.00 0.00 ATOM 1281 C THR 165 31.383 1.051 54.497 1.00 0.00 ATOM 1282 N LEU 166 32.070 1.210 53.361 1.00 0.00 ATOM 1283 CA LEU 166 32.378 0.058 52.534 1.00 0.00 ATOM 1284 CB LEU 166 33.112 0.477 51.261 1.00 0.00 ATOM 1285 CG LEU 166 32.273 1.066 50.149 1.00 0.00 ATOM 1286 CD1 LEU 166 33.196 1.333 48.942 1.00 0.00 ATOM 1287 CD2 LEU 166 31.084 0.159 49.766 1.00 0.00 ATOM 1288 O LEU 166 32.937 -2.173 53.218 1.00 0.00 ATOM 1289 C LEU 166 33.216 -0.977 53.285 1.00 0.00 ATOM 1290 N ALA 167 34.237 -0.522 53.985 1.00 0.00 ATOM 1291 CA ALA 167 35.111 -1.423 54.733 1.00 0.00 ATOM 1292 CB ALA 167 36.205 -0.665 55.403 1.00 0.00 ATOM 1293 O ALA 167 34.425 -3.406 55.888 1.00 0.00 ATOM 1294 C ALA 167 34.284 -2.198 55.751 1.00 0.00 ATOM 1295 N TYR 168 33.373 -1.500 56.412 1.00 0.00 ATOM 1296 CA TYR 168 32.560 -2.099 57.460 1.00 0.00 ATOM 1297 CB TYR 168 31.763 -1.003 58.163 1.00 0.00 ATOM 1298 CG TYR 168 30.750 -1.490 59.163 1.00 0.00 ATOM 1299 CD1 TYR 168 31.160 -2.077 60.373 1.00 0.00 ATOM 1300 CD2 TYR 168 29.392 -1.344 58.922 1.00 0.00 ATOM 1301 CE1 TYR 168 30.237 -2.515 61.299 1.00 0.00 ATOM 1302 CE2 TYR 168 28.449 -1.779 59.859 1.00 0.00 ATOM 1303 CZ TYR 168 28.881 -2.359 61.027 1.00 0.00 ATOM 1304 OH TYR 168 27.945 -2.781 61.937 1.00 0.00 ATOM 1305 O TYR 168 31.609 -4.336 57.416 1.00 0.00 ATOM 1306 C TYR 168 31.636 -3.204 56.900 1.00 0.00 ATOM 1307 N PHE 169 30.879 -2.873 55.863 1.00 0.00 ATOM 1308 CA PHE 169 29.973 -3.857 55.245 1.00 0.00 ATOM 1309 CB PHE 169 28.986 -3.184 54.303 1.00 0.00 ATOM 1310 CG PHE 169 27.893 -2.490 55.025 1.00 0.00 ATOM 1311 CD1 PHE 169 26.950 -3.225 55.734 1.00 0.00 ATOM 1312 CD2 PHE 169 27.842 -1.113 55.081 1.00 0.00 ATOM 1313 CE1 PHE 169 25.915 -2.576 56.435 1.00 0.00 ATOM 1314 CE2 PHE 169 26.817 -0.456 55.772 1.00 0.00 ATOM 1315 CZ PHE 169 25.853 -1.185 56.445 1.00 0.00 ATOM 1316 O PHE 169 30.324 -6.163 54.685 1.00 0.00 ATOM 1317 C PHE 169 30.730 -4.990 54.582 1.00 0.00 ATOM 1318 N ARG 170 31.873 -4.652 53.982 1.00 0.00 ATOM 1319 CA ARG 170 32.746 -5.652 53.367 1.00 0.00 ATOM 1320 CB ARG 170 33.935 -4.985 52.634 1.00 0.00 ATOM 1321 CG ARG 170 34.870 -5.986 51.966 1.00 0.00 ATOM 1322 CD ARG 170 36.168 -5.382 51.403 1.00 0.00 ATOM 1323 NE ARG 170 36.850 -4.461 52.317 1.00 0.00 ATOM 1324 CZ ARG 170 37.693 -4.809 53.285 1.00 0.00 ATOM 1325 NH1 ARG 170 37.993 -6.087 53.511 1.00 0.00 ATOM 1326 NH2 ARG 170 38.246 -3.865 54.046 1.00 0.00 ATOM 1327 O ARG 170 33.265 -7.898 54.138 1.00 0.00 ATOM 1328 C ARG 170 33.247 -6.684 54.397 1.00 0.00 ATOM 1329 N ARG 171 33.643 -6.206 55.577 1.00 0.00 ATOM 1330 CA ARG 171 34.136 -7.099 56.619 1.00 0.00 ATOM 1331 CB ARG 171 34.946 -6.320 57.666 1.00 0.00 ATOM 1332 CG ARG 171 36.451 -6.094 57.196 1.00 0.00 ATOM 1333 CD ARG 171 37.168 -4.980 57.981 1.00 0.00 ATOM 1334 NE ARG 171 37.403 -5.302 59.403 1.00 0.00 ATOM 1335 CZ ARG 171 38.512 -5.884 59.890 1.00 0.00 ATOM 1336 NH1 ARG 171 38.622 -6.116 61.203 1.00 0.00 ATOM 1337 NH2 ARG 171 39.512 -6.238 58.999 1.00 0.00 ATOM 1338 O ARG 171 33.273 -8.973 57.870 1.00 0.00 ATOM 1339 C ARG 171 33.012 -7.949 57.242 1.00 0.00 ATOM 1340 N GLN 172 31.757 -7.544 57.038 1.00 0.00 ATOM 1341 CA GLN 172 30.609 -8.402 57.423 1.00 0.00 ATOM 1342 CB GLN 172 29.382 -7.568 57.726 1.00 0.00 ATOM 1343 CG GLN 172 29.759 -6.390 58.539 1.00 0.00 ATOM 1344 CD GLN 172 28.648 -5.862 59.347 1.00 0.00 ATOM 1345 OE1 GLN 172 28.418 -6.288 60.500 1.00 0.00 ATOM 1346 NE2 GLN 172 27.957 -4.892 58.785 1.00 0.00 ATOM 1347 O GLN 172 29.417 -10.352 56.671 1.00 0.00 ATOM 1348 C GLN 172 30.264 -9.492 56.401 1.00 0.00 ATOM 1349 N GLY 173 30.943 -9.478 55.262 1.00 0.00 ATOM 1350 CA GLY 173 30.766 -10.501 54.242 1.00 0.00 ATOM 1351 O GLY 173 29.304 -10.949 52.402 1.00 0.00 ATOM 1352 C GLY 173 29.735 -10.109 53.192 1.00 0.00 ATOM 1353 N ILE 174 29.331 -8.842 53.186 1.00 0.00 ATOM 1354 CA ILE 174 28.541 -8.293 52.052 1.00 0.00 ATOM 1355 CB ILE 174 27.732 -7.067 52.459 1.00 0.00 ATOM 1356 CG1 ILE 174 26.725 -7.479 53.541 1.00 0.00 ATOM 1357 CG2 ILE 174 27.051 -6.368 51.206 1.00 0.00 ATOM 1358 CD1 ILE 174 26.093 -6.357 54.197 1.00 0.00 ATOM 1359 O ILE 174 30.454 -7.239 51.022 1.00 0.00 ATOM 1360 C ILE 174 29.465 -7.982 50.870 1.00 0.00 ATOM 1361 N PRO 175 29.187 -8.598 49.703 1.00 0.00 ATOM 1362 CA PRO 175 30.027 -8.383 48.544 1.00 0.00 ATOM 1363 CB PRO 175 29.430 -9.335 47.480 1.00 0.00 ATOM 1364 CG PRO 175 28.036 -9.608 47.958 1.00 0.00 ATOM 1365 CD PRO 175 28.076 -9.533 49.437 1.00 0.00 ATOM 1366 O PRO 175 28.820 -6.356 48.030 1.00 0.00 ATOM 1367 C PRO 175 29.916 -6.943 48.043 1.00 0.00 ATOM 1368 N VAL 176 31.047 -6.401 47.633 1.00 0.00 ATOM 1369 CA VAL 176 31.120 -5.047 47.141 1.00 0.00 ATOM 1370 CB VAL 176 32.046 -4.150 48.011 1.00 0.00 ATOM 1371 CG1 VAL 176 32.004 -2.712 47.501 1.00 0.00 ATOM 1372 CG2 VAL 176 31.630 -4.211 49.488 1.00 0.00 ATOM 1373 O VAL 176 32.762 -5.314 45.401 1.00 0.00 ATOM 1374 C VAL 176 31.589 -5.065 45.694 1.00 0.00 ATOM 1375 N TYR 177 30.659 -4.804 44.796 1.00 0.00 ATOM 1376 CA TYR 177 30.934 -4.802 43.367 1.00 0.00 ATOM 1377 CB TYR 177 29.712 -5.341 42.612 1.00 0.00 ATOM 1378 CG TYR 177 29.448 -6.780 42.909 1.00 0.00 ATOM 1379 CD1 TYR 177 28.628 -7.153 43.973 1.00 0.00 ATOM 1380 CD2 TYR 177 30.007 -7.779 42.116 1.00 0.00 ATOM 1381 CE1 TYR 177 28.389 -8.486 44.249 1.00 0.00 ATOM 1382 CE2 TYR 177 29.770 -9.110 42.373 1.00 0.00 ATOM 1383 CZ TYR 177 28.956 -9.456 43.444 1.00 0.00 ATOM 1384 OH TYR 177 28.725 -10.783 43.730 1.00 0.00 ATOM 1385 O TYR 177 30.736 -2.410 43.558 1.00 0.00 ATOM 1386 C TYR 177 31.208 -3.372 42.927 1.00 0.00 ATOM 1387 N GLY 178 32.000 -3.235 41.876 1.00 0.00 ATOM 1388 CA GLY 178 32.310 -1.923 41.300 1.00 0.00 ATOM 1389 O GLY 178 32.836 -2.984 39.221 1.00 0.00 ATOM 1390 C GLY 178 32.355 -1.992 39.794 1.00 0.00 ATOM 1391 N ALA 179 31.898 -0.919 39.146 1.00 0.00 ATOM 1392 CA ALA 179 31.897 -0.833 37.692 1.00 0.00 ATOM 1393 CB ALA 179 30.686 -0.033 37.219 1.00 0.00 ATOM 1394 O ALA 179 33.486 0.986 37.611 1.00 0.00 ATOM 1395 C ALA 179 33.195 -0.162 37.222 1.00 0.00 ATOM 1396 N PHE 180 33.986 -0.901 36.443 1.00 0.00 ATOM 1397 CA PHE 180 35.300 -0.438 35.993 1.00 0.00 ATOM 1398 CB PHE 180 36.407 -1.198 36.710 1.00 0.00 ATOM 1399 CG PHE 180 36.511 -0.866 38.178 1.00 0.00 ATOM 1400 CD1 PHE 180 37.263 0.227 38.607 1.00 0.00 ATOM 1401 CD2 PHE 180 35.864 -1.649 39.124 1.00 0.00 ATOM 1402 CE1 PHE 180 37.360 0.535 39.978 1.00 0.00 ATOM 1403 CE2 PHE 180 35.951 -1.357 40.477 1.00 0.00 ATOM 1404 CZ PHE 180 36.722 -0.267 40.905 1.00 0.00 ATOM 1405 O PHE 180 34.679 -1.449 33.935 1.00 0.00 ATOM 1406 C PHE 180 35.448 -0.685 34.515 1.00 0.00 ATOM 1407 N LEU 181 36.430 -0.040 33.901 1.00 0.00 ATOM 1408 CA LEU 181 36.695 -0.265 32.489 1.00 0.00 ATOM 1409 CB LEU 181 37.419 0.942 31.893 1.00 0.00 ATOM 1410 CG LEU 181 36.569 2.220 31.841 1.00 0.00 ATOM 1411 CD1 LEU 181 37.366 3.396 31.254 1.00 0.00 ATOM 1412 CD2 LEU 181 35.253 1.996 31.057 1.00 0.00 ATOM 1413 O LEU 181 37.503 -2.100 31.159 1.00 0.00 ATOM 1414 C LEU 181 37.479 -1.554 32.264 1.00 0.00 ATOM 1415 N ASP 182 38.142 -2.003 33.321 1.00 0.00 ATOM 1416 CA ASP 182 38.880 -3.268 33.340 1.00 0.00 ATOM 1417 CB ASP 182 40.380 -3.014 33.557 1.00 0.00 ATOM 1418 CG ASP 182 41.187 -4.304 33.752 1.00 0.00 ATOM 1419 OD1 ASP 182 40.725 -5.204 34.491 1.00 0.00 ATOM 1420 OD2 ASP 182 42.299 -4.413 33.181 1.00 0.00 ATOM 1421 O ASP 182 38.293 -3.617 35.645 1.00 0.00 ATOM 1422 C ASP 182 38.328 -4.093 34.499 1.00 0.00 ATOM 1423 N GLY 183 37.903 -5.318 34.222 1.00 0.00 ATOM 1424 CA GLY 183 37.341 -6.170 35.261 1.00 0.00 ATOM 1425 O GLY 183 36.843 -7.615 33.436 1.00 0.00 ATOM 1426 C GLY 183 36.698 -7.382 34.627 1.00 0.00 ATOM 1427 N GLN 184 35.968 -8.151 35.421 1.00 0.00 ATOM 1428 CA GLN 184 35.251 -9.312 34.892 1.00 0.00 ATOM 1429 CB GLN 184 34.816 -10.202 36.051 1.00 0.00 ATOM 1430 CG GLN 184 34.086 -11.456 35.591 1.00 0.00 ATOM 1431 CD GLN 184 33.903 -12.453 36.714 1.00 0.00 ATOM 1432 OE1 GLN 184 33.738 -12.074 37.872 1.00 0.00 ATOM 1433 NE2 GLN 184 33.908 -13.730 36.369 1.00 0.00 ATOM 1434 O GLN 184 33.235 -8.074 34.601 1.00 0.00 ATOM 1435 C GLN 184 34.000 -8.889 34.113 1.00 0.00 ATOM 1436 N SER 185 33.772 -9.463 32.931 1.00 0.00 ATOM 1437 CA SER 185 32.522 -9.198 32.208 1.00 0.00 ATOM 1438 CB SER 185 32.362 -10.103 30.987 1.00 0.00 ATOM 1439 OG SER 185 31.036 -9.978 30.495 1.00 0.00 ATOM 1440 O SER 185 31.260 -10.496 33.771 1.00 0.00 ATOM 1441 C SER 185 31.343 -9.441 33.133 1.00 0.00 ATOM 1442 N LEU 186 30.416 -8.483 33.205 1.00 0.00 ATOM 1443 CA LEU 186 29.203 -8.623 34.021 1.00 0.00 ATOM 1444 CB LEU 186 28.358 -7.331 34.023 1.00 0.00 ATOM 1445 CG LEU 186 27.287 -7.106 32.947 1.00 0.00 ATOM 1446 CD1 LEU 186 26.250 -6.095 33.384 1.00 0.00 ATOM 1447 CD2 LEU 186 27.911 -6.685 31.631 1.00 0.00 ATOM 1448 O LEU 186 27.525 -10.301 34.379 1.00 0.00 ATOM 1449 C LEU 186 28.330 -9.810 33.591 1.00 0.00 ATOM 1450 N TYR 187 28.469 -10.240 32.343 1.00 0.00 ATOM 1451 CA TYR 187 27.745 -11.419 31.859 1.00 0.00 ATOM 1452 CB TYR 187 27.665 -11.419 30.328 1.00 0.00 ATOM 1453 CG TYR 187 27.107 -10.116 29.809 1.00 0.00 ATOM 1454 CD1 TYR 187 25.931 -9.575 30.335 1.00 0.00 ATOM 1455 CD2 TYR 187 27.759 -9.421 28.812 1.00 0.00 ATOM 1456 CE1 TYR 187 25.428 -8.353 29.876 1.00 0.00 ATOM 1457 CE2 TYR 187 27.259 -8.219 28.334 1.00 0.00 ATOM 1458 CZ TYR 187 26.103 -7.686 28.879 1.00 0.00 ATOM 1459 OH TYR 187 25.639 -6.473 28.372 1.00 0.00 ATOM 1460 O TYR 187 27.634 -13.739 32.365 1.00 0.00 ATOM 1461 C TYR 187 28.330 -12.734 32.353 1.00 0.00 ATOM 1462 N GLU 188 29.603 -12.716 32.751 1.00 0.00 ATOM 1463 CA GLU 188 30.290 -13.920 33.226 1.00 0.00 ATOM 1464 CB GLU 188 31.718 -13.992 32.661 1.00 0.00 ATOM 1465 CG GLU 188 31.767 -13.941 31.140 1.00 0.00 ATOM 1466 CD GLU 188 33.184 -14.007 30.565 1.00 0.00 ATOM 1467 OE1 GLU 188 34.177 -13.764 31.291 1.00 0.00 ATOM 1468 OE2 GLU 188 33.291 -14.290 29.366 1.00 0.00 ATOM 1469 O GLU 188 30.597 -15.085 35.298 1.00 0.00 ATOM 1470 C GLU 188 30.339 -14.017 34.757 1.00 0.00 ATOM 1471 N ALA 189 30.110 -12.905 35.448 1.00 0.00 ATOM 1472 CA ALA 189 30.219 -12.893 36.886 1.00 0.00 ATOM 1473 CB ALA 189 30.333 -11.446 37.390 1.00 0.00 ATOM 1474 O ALA 189 27.887 -13.289 37.039 1.00 0.00 ATOM 1475 C ALA 189 28.989 -13.580 37.470 1.00 0.00 ATOM 1476 N PRO 190 29.167 -14.503 38.442 1.00 0.00 ATOM 1477 CA PRO 190 27.942 -15.004 39.060 1.00 0.00 ATOM 1478 CB PRO 190 28.388 -16.262 39.835 1.00 0.00 ATOM 1479 CG PRO 190 29.882 -16.407 39.580 1.00 0.00 ATOM 1480 CD PRO 190 30.381 -15.107 39.022 1.00 0.00 ATOM 1481 O PRO 190 28.303 -13.356 40.734 1.00 0.00 ATOM 1482 C PRO 190 27.485 -13.912 40.010 1.00 0.00 ATOM 1483 N LEU 191 26.217 -13.569 39.977 1.00 0.00 ATOM 1484 CA LEU 191 25.716 -12.486 40.808 1.00 0.00 ATOM 1485 CB LEU 191 24.984 -11.461 39.918 1.00 0.00 ATOM 1486 CG LEU 191 25.765 -10.735 38.804 1.00 0.00 ATOM 1487 CD1 LEU 191 24.865 -9.849 37.934 1.00 0.00 ATOM 1488 CD2 LEU 191 26.936 -9.950 39.416 1.00 0.00 ATOM 1489 O LEU 191 24.082 -14.067 41.584 1.00 0.00 ATOM 1490 C LEU 191 24.734 -13.037 41.835 1.00 0.00 ATOM 1491 N PRO 192 24.592 -12.342 42.985 1.00 0.00 ATOM 1492 CA PRO 192 23.540 -12.753 43.907 1.00 0.00 ATOM 1493 CB PRO 192 23.868 -11.971 45.202 1.00 0.00 ATOM 1494 CG PRO 192 25.170 -11.304 44.985 1.00 0.00 ATOM 1495 CD PRO 192 25.348 -11.190 43.509 1.00 0.00 ATOM 1496 O PRO 192 22.107 -11.464 42.499 1.00 0.00 ATOM 1497 C PRO 192 22.187 -12.331 43.376 1.00 0.00 ATOM 1498 N ASN 193 21.120 -12.947 43.883 1.00 0.00 ATOM 1499 CA ASN 193 19.768 -12.504 43.518 1.00 0.00 ATOM 1500 CB ASN 193 18.717 -13.380 44.215 1.00 0.00 ATOM 1501 CG ASN 193 17.288 -13.073 43.762 1.00 0.00 ATOM 1502 ND2 ASN 193 16.757 -13.927 42.899 1.00 0.00 ATOM 1503 OD1 ASN 193 16.659 -12.102 44.204 1.00 0.00 ATOM 1504 O ASN 193 20.210 -10.612 44.915 1.00 0.00 ATOM 1505 C ASN 193 19.592 -11.054 43.952 1.00 0.00 ATOM 1506 N PHE 194 18.713 -10.339 43.259 1.00 0.00 ATOM 1507 CA PHE 194 18.399 -8.945 43.578 1.00 0.00 ATOM 1508 CB PHE 194 17.232 -8.485 42.701 1.00 0.00 ATOM 1509 CG PHE 194 17.313 -7.056 42.302 1.00 0.00 ATOM 1510 CD1 PHE 194 17.858 -6.712 41.073 1.00 0.00 ATOM 1511 CD2 PHE 194 16.834 -6.046 43.137 1.00 0.00 ATOM 1512 CE1 PHE 194 17.920 -5.381 40.663 1.00 0.00 ATOM 1513 CE2 PHE 194 16.914 -4.701 42.751 1.00 0.00 ATOM 1514 CZ PHE 194 17.463 -4.379 41.504 1.00 0.00 ATOM 1515 O PHE 194 18.353 -7.644 45.615 1.00 0.00 ATOM 1516 C PHE 194 18.040 -8.708 45.053 1.00 0.00 ATOM 1517 N THR 195 17.401 -9.687 45.686 1.00 0.00 ATOM 1518 CA THR 195 16.988 -9.535 47.087 1.00 0.00 ATOM 1519 CB THR 195 15.834 -10.469 47.421 1.00 0.00 ATOM 1520 CG2 THR 195 14.601 -10.079 46.643 1.00 0.00 ATOM 1521 OG1 THR 195 16.222 -11.805 47.098 1.00 0.00 ATOM 1522 O THR 195 17.901 -9.613 49.302 1.00 0.00 ATOM 1523 C THR 195 18.089 -9.822 48.095 1.00 0.00 ATOM 1524 N GLU 196 19.225 -10.323 47.623 1.00 0.00 ATOM 1525 CA GLU 196 20.344 -10.618 48.516 1.00 0.00 ATOM 1526 CB GLU 196 21.194 -11.746 47.960 1.00 0.00 ATOM 1527 CG GLU 196 20.446 -13.077 47.916 1.00 0.00 ATOM 1528 CD GLU 196 21.314 -14.199 47.375 1.00 0.00 ATOM 1529 OE1 GLU 196 22.104 -14.766 48.163 1.00 0.00 ATOM 1530 OE2 GLU 196 21.199 -14.529 46.180 1.00 0.00 ATOM 1531 O GLU 196 21.263 -8.537 47.860 1.00 0.00 ATOM 1532 C GLU 196 21.203 -9.380 48.726 1.00 0.00 ATOM 1533 N PRO 197 21.841 -9.262 49.900 1.00 0.00 ATOM 1534 CA PRO 197 22.655 -8.079 50.173 1.00 0.00 ATOM 1535 CB PRO 197 23.054 -8.258 51.652 1.00 0.00 ATOM 1536 CG PRO 197 22.957 -9.718 51.920 1.00 0.00 ATOM 1537 CD PRO 197 21.814 -10.200 51.047 1.00 0.00 ATOM 1538 O PRO 197 24.621 -8.924 49.077 1.00 0.00 ATOM 1539 C PRO 197 23.874 -7.975 49.251 1.00 0.00 ATOM 1540 N ALA 198 24.040 -6.821 48.616 1.00 0.00 ATOM 1541 CA ALA 198 25.216 -6.574 47.791 1.00 0.00 ATOM 1542 CB ALA 198 25.081 -7.221 46.393 1.00 0.00 ATOM 1543 O ALA 198 24.272 -4.417 47.526 1.00 0.00 ATOM 1544 C ALA 198 25.291 -5.078 47.601 1.00 0.00 ATOM 1545 N ILE 199 26.502 -4.566 47.493 1.00 0.00 ATOM 1546 CA ILE 199 26.687 -3.147 47.198 1.00 0.00 ATOM 1547 CB ILE 199 27.593 -2.477 48.267 1.00 0.00 ATOM 1548 CG1 ILE 199 26.914 -2.531 49.658 1.00 0.00 ATOM 1549 CG2 ILE 199 27.941 -1.052 47.834 1.00 0.00 ATOM 1550 CD1 ILE 199 27.932 -2.488 50.842 1.00 0.00 ATOM 1551 O ILE 199 28.226 -3.839 45.498 1.00 0.00 ATOM 1552 C ILE 199 27.315 -3.049 45.819 1.00 0.00 ATOM 1553 N LEU 200 26.827 -2.103 45.008 1.00 0.00 ATOM 1554 CA LEU 200 27.365 -1.866 43.677 1.00 0.00 ATOM 1555 CB LEU 200 26.305 -2.166 42.585 1.00 0.00 ATOM 1556 CG LEU 200 26.640 -1.734 41.148 1.00 0.00 ATOM 1557 CD1 LEU 200 27.961 -2.396 40.700 1.00 0.00 ATOM 1558 CD2 LEU 200 25.487 -2.166 40.203 1.00 0.00 ATOM 1559 O LEU 200 26.971 0.517 43.699 1.00 0.00 ATOM 1560 C LEU 200 27.790 -0.412 43.594 1.00 0.00 ATOM 1561 N VAL 201 29.076 -0.227 43.389 1.00 0.00 ATOM 1562 CA VAL 201 29.661 1.107 43.389 1.00 0.00 ATOM 1563 CB VAL 201 31.083 1.118 44.029 1.00 0.00 ATOM 1564 CG1 VAL 201 31.671 2.564 44.029 1.00 0.00 ATOM 1565 CG2 VAL 201 31.064 0.519 45.519 1.00 0.00 ATOM 1566 O VAL 201 30.319 0.942 41.073 1.00 0.00 ATOM 1567 C VAL 201 29.767 1.627 41.961 1.00 0.00 ATOM 1568 N LEU 202 29.288 2.851 41.755 1.00 0.00 ATOM 1569 CA LEU 202 29.344 3.511 40.447 1.00 0.00 ATOM 1570 CB LEU 202 27.926 3.736 39.929 1.00 0.00 ATOM 1571 CG LEU 202 27.288 2.337 39.719 1.00 0.00 ATOM 1572 CD1 LEU 202 25.843 2.297 40.117 1.00 0.00 ATOM 1573 CD2 LEU 202 27.523 1.915 38.267 1.00 0.00 ATOM 1574 O LEU 202 29.721 5.638 41.486 1.00 0.00 ATOM 1575 C LEU 202 30.069 4.851 40.602 1.00 0.00 ATOM 1576 N GLY 203 31.069 5.112 39.762 1.00 0.00 ATOM 1577 CA GLY 203 31.760 6.416 39.782 1.00 0.00 ATOM 1578 O GLY 203 30.726 6.838 37.679 1.00 0.00 ATOM 1579 C GLY 203 31.390 7.291 38.592 1.00 0.00 ATOM 1580 N SER 204 31.862 8.534 38.548 1.00 0.00 ATOM 1581 CA SER 204 31.605 9.336 37.348 1.00 0.00 ATOM 1582 CB SER 204 31.987 10.774 37.550 1.00 0.00 ATOM 1583 OG SER 204 33.394 10.884 37.600 1.00 0.00 ATOM 1584 O SER 204 33.494 8.305 36.353 1.00 0.00 ATOM 1585 C SER 204 32.391 8.795 36.171 1.00 0.00 ATOM 1586 N GLU 205 31.815 8.898 34.970 1.00 0.00 ATOM 1587 CA GLU 205 32.516 8.595 33.719 1.00 0.00 ATOM 1588 CB GLU 205 31.556 8.733 32.532 1.00 0.00 ATOM 1589 CG GLU 205 32.189 9.092 31.218 1.00 0.00 ATOM 1590 CD GLU 205 31.165 9.384 30.135 1.00 0.00 ATOM 1591 OE1 GLU 205 30.064 9.914 30.439 1.00 0.00 ATOM 1592 OE2 GLU 205 31.480 9.084 28.968 1.00 0.00 ATOM 1593 O GLU 205 34.762 8.993 32.952 1.00 0.00 ATOM 1594 C GLU 205 33.782 9.456 33.542 1.00 0.00 ATOM 1595 N GLY 206 33.759 10.682 34.071 1.00 0.00 ATOM 1596 CA GLY 206 34.922 11.573 34.058 1.00 0.00 ATOM 1597 O GLY 206 37.261 11.200 34.311 1.00 0.00 ATOM 1598 C GLY 206 36.156 11.096 34.821 1.00 0.00 ATOM 1599 N ARG 207 35.983 10.574 36.035 1.00 0.00 ATOM 1600 CA ARG 207 37.116 10.104 36.840 1.00 0.00 ATOM 1601 CB ARG 207 37.340 11.009 38.062 1.00 0.00 ATOM 1602 CG ARG 207 36.114 11.792 38.544 1.00 0.00 ATOM 1603 CD ARG 207 35.947 13.140 37.824 1.00 0.00 ATOM 1604 NE ARG 207 34.538 13.428 37.550 1.00 0.00 ATOM 1605 CZ ARG 207 33.686 13.967 38.421 1.00 0.00 ATOM 1606 NH1 ARG 207 32.427 14.170 38.065 1.00 0.00 ATOM 1607 NH2 ARG 207 34.083 14.304 39.642 1.00 0.00 ATOM 1608 O ARG 207 38.022 8.019 37.649 1.00 0.00 ATOM 1609 C ARG 207 37.022 8.634 37.267 1.00 0.00 ATOM 1610 N GLY 208 35.826 8.074 37.215 1.00 0.00 ATOM 1611 CA GLY 208 35.614 6.697 37.648 1.00 0.00 ATOM 1612 O GLY 208 35.724 7.619 39.864 1.00 0.00 ATOM 1613 C GLY 208 35.684 6.604 39.165 1.00 0.00 ATOM 1614 N ILE 209 35.714 5.377 39.664 1.00 0.00 ATOM 1615 CA ILE 209 35.770 5.130 41.100 1.00 0.00 ATOM 1616 CB ILE 209 35.518 3.642 41.355 1.00 0.00 ATOM 1617 CG1 ILE 209 34.094 3.302 40.834 1.00 0.00 ATOM 1618 CG2 ILE 209 35.744 3.309 42.842 1.00 0.00 ATOM 1619 CD1 ILE 209 33.611 1.839 40.991 1.00 0.00 ATOM 1620 O ILE 209 38.158 5.289 41.016 1.00 0.00 ATOM 1621 C ILE 209 37.125 5.593 41.624 1.00 0.00 ATOM 1622 N SER 210 37.139 6.333 42.735 1.00 0.00 ATOM 1623 CA SER 210 38.403 6.840 43.263 1.00 0.00 ATOM 1624 CB SER 210 38.146 7.804 44.409 1.00 0.00 ATOM 1625 OG SER 210 37.596 7.097 45.497 1.00 0.00 ATOM 1626 O SER 210 38.740 4.638 44.145 1.00 0.00 ATOM 1627 C SER 210 39.268 5.682 43.753 1.00 0.00 ATOM 1628 N PRO 211 40.605 5.861 43.741 1.00 0.00 ATOM 1629 CA PRO 211 41.491 4.790 44.190 1.00 0.00 ATOM 1630 CB PRO 211 42.877 5.449 44.136 1.00 0.00 ATOM 1631 CG PRO 211 42.744 6.439 43.058 1.00 0.00 ATOM 1632 CD PRO 211 41.379 7.027 43.271 1.00 0.00 ATOM 1633 O PRO 211 41.203 3.034 45.816 1.00 0.00 ATOM 1634 C PRO 211 41.169 4.262 45.607 1.00 0.00 ATOM 1635 N GLU 212 40.821 5.150 46.544 1.00 0.00 ATOM 1636 CA GLU 212 40.591 4.722 47.938 1.00 0.00 ATOM 1637 CB GLU 212 40.541 5.896 48.940 1.00 0.00 ATOM 1638 CG GLU 212 40.807 5.454 50.417 1.00 0.00 ATOM 1639 CD GLU 212 40.561 6.533 51.476 1.00 0.00 ATOM 1640 OE1 GLU 212 40.908 6.299 52.657 1.00 0.00 ATOM 1641 OE2 GLU 212 40.003 7.596 51.151 1.00 0.00 ATOM 1642 O GLU 212 39.267 2.948 48.855 1.00 0.00 ATOM 1643 C GLU 212 39.326 3.886 48.051 1.00 0.00 ATOM 1644 N VAL 213 38.315 4.229 47.265 1.00 0.00 ATOM 1645 CA VAL 213 37.089 3.441 47.196 1.00 0.00 ATOM 1646 CB VAL 213 35.929 4.267 46.554 1.00 0.00 ATOM 1647 CG1 VAL 213 34.645 3.406 46.336 1.00 0.00 ATOM 1648 CG2 VAL 213 35.571 5.446 47.470 1.00 0.00 ATOM 1649 O VAL 213 36.823 1.057 46.869 1.00 0.00 ATOM 1650 C VAL 213 37.319 2.117 46.447 1.00 0.00 ATOM 1651 N ALA 214 38.071 2.177 45.347 1.00 0.00 ATOM 1652 CA ALA 214 38.383 0.985 44.564 1.00 0.00 ATOM 1653 CB ALA 214 39.227 1.340 43.329 1.00 0.00 ATOM 1654 O ALA 214 38.874 -1.266 45.269 1.00 0.00 ATOM 1655 C ALA 214 39.095 -0.063 45.441 1.00 0.00 ATOM 1656 N ALA 215 39.914 0.388 46.390 1.00 0.00 ATOM 1657 CA ALA 215 40.585 -0.537 47.300 1.00 0.00 ATOM 1658 CB ALA 215 41.624 0.191 48.179 1.00 0.00 ATOM 1659 O ALA 215 39.997 -2.429 48.647 1.00 0.00 ATOM 1660 C ALA 215 39.626 -1.367 48.167 1.00 0.00 ATOM 1661 N GLU 216 38.393 -0.910 48.345 1.00 0.00 ATOM 1662 CA GLU 216 37.418 -1.635 49.148 1.00 0.00 ATOM 1663 CB GLU 216 36.527 -0.643 49.903 1.00 0.00 ATOM 1664 CG GLU 216 37.277 0.235 50.893 1.00 0.00 ATOM 1665 CD GLU 216 37.983 -0.551 52.008 1.00 0.00 ATOM 1666 OE1 GLU 216 37.574 -1.685 52.357 1.00 0.00 ATOM 1667 OE2 GLU 216 38.965 -0.020 52.536 1.00 0.00 ATOM 1668 O GLU 216 35.650 -3.242 48.907 1.00 0.00 ATOM 1669 C GLU 216 36.522 -2.574 48.336 1.00 0.00 ATOM 1670 N ILE 217 36.698 -2.577 47.019 1.00 0.00 ATOM 1671 CA ILE 217 35.858 -3.354 46.112 1.00 0.00 ATOM 1672 CB ILE 217 36.018 -2.854 44.663 1.00 0.00 ATOM 1673 CG1 ILE 217 35.738 -1.343 44.539 1.00 0.00 ATOM 1674 CG2 ILE 217 35.233 -3.703 43.710 1.00 0.00 ATOM 1675 CD1 ILE 217 34.349 -0.877 44.768 1.00 0.00 ATOM 1676 O ILE 217 37.501 -5.089 45.992 1.00 0.00 ATOM 1677 C ILE 217 36.297 -4.807 46.109 1.00 0.00 ATOM 1678 N THR 218 35.347 -5.734 46.246 1.00 0.00 ATOM 1679 CA THR 218 35.715 -7.163 46.255 1.00 0.00 ATOM 1680 CB THR 218 34.868 -8.013 47.236 1.00 0.00 ATOM 1681 CG2 THR 218 35.086 -7.554 48.643 1.00 0.00 ATOM 1682 OG1 THR 218 33.473 -7.928 46.895 1.00 0.00 ATOM 1683 O THR 218 36.398 -8.715 44.582 1.00 0.00 ATOM 1684 C THR 218 35.668 -7.783 44.865 1.00 0.00 ATOM 1685 N ASP 219 34.839 -7.229 43.998 1.00 0.00 ATOM 1686 CA ASP 219 34.535 -7.832 42.698 1.00 0.00 ATOM 1687 CB ASP 219 33.226 -8.619 42.795 1.00 0.00 ATOM 1688 CG ASP 219 33.310 -9.790 43.770 1.00 0.00 ATOM 1689 OD1 ASP 219 33.626 -10.898 43.300 1.00 0.00 ATOM 1690 OD2 ASP 219 33.106 -9.616 44.994 1.00 0.00 ATOM 1691 O ASP 219 33.404 -5.981 41.638 1.00 0.00 ATOM 1692 C ASP 219 34.393 -6.728 41.646 1.00 0.00 ATOM 1693 N ARG 220 35.372 -6.634 40.749 1.00 0.00 ATOM 1694 CA ARG 220 35.300 -5.641 39.662 1.00 0.00 ATOM 1695 CB ARG 220 36.702 -5.286 39.157 1.00 0.00 ATOM 1696 CG ARG 220 37.561 -4.629 40.161 1.00 0.00 ATOM 1697 CD ARG 220 38.993 -4.507 39.596 1.00 0.00 ATOM 1698 NE ARG 220 39.515 -3.220 40.016 1.00 0.00 ATOM 1699 CZ ARG 220 39.796 -2.198 39.215 1.00 0.00 ATOM 1700 NH1 ARG 220 40.257 -1.086 39.769 1.00 0.00 ATOM 1701 NH2 ARG 220 39.667 -2.284 37.886 1.00 0.00 ATOM 1702 O ARG 220 34.797 -7.263 37.992 1.00 0.00 ATOM 1703 C ARG 220 34.501 -6.175 38.481 1.00 0.00 ATOM 1704 N LEU 221 33.540 -5.383 38.019 1.00 0.00 ATOM 1705 CA LEU 221 32.705 -5.708 36.873 1.00 0.00 ATOM 1706 CB LEU 221 31.209 -5.641 37.255 1.00 0.00 ATOM 1707 CG LEU 221 30.795 -6.506 38.463 1.00 0.00 ATOM 1708 CD1 LEU 221 29.314 -6.292 38.748 1.00 0.00 ATOM 1709 CD2 LEU 221 31.061 -7.995 38.143 1.00 0.00 ATOM 1710 O LEU 221 33.165 -3.522 35.938 1.00 0.00 ATOM 1711 C LEU 221 32.944 -4.727 35.727 1.00 0.00 ATOM 1712 N THR 222 32.825 -5.236 34.511 1.00 0.00 ATOM 1713 CA THR 222 32.946 -4.396 33.334 1.00 0.00 ATOM 1714 CB THR 222 34.284 -4.649 32.624 1.00 0.00 ATOM 1715 CG2 THR 222 34.514 -3.638 31.531 1.00 0.00 ATOM 1716 OG1 THR 222 35.351 -4.518 33.570 1.00 0.00 ATOM 1717 O THR 222 31.353 -5.871 32.319 1.00 0.00 ATOM 1718 C THR 222 31.797 -4.725 32.389 1.00 0.00 ATOM 1719 N ILE 223 31.336 -3.722 31.653 1.00 0.00 ATOM 1720 CA ILE 223 30.420 -3.934 30.548 1.00 0.00 ATOM 1721 CB ILE 223 29.347 -2.817 30.477 1.00 0.00 ATOM 1722 CG1 ILE 223 28.583 -2.720 31.816 1.00 0.00 ATOM 1723 CG2 ILE 223 28.407 -3.055 29.273 1.00 0.00 ATOM 1724 CD1 ILE 223 27.740 -1.430 31.944 1.00 0.00 ATOM 1725 O ILE 223 31.786 -2.874 28.885 1.00 0.00 ATOM 1726 C ILE 223 31.260 -3.918 29.282 1.00 0.00 ATOM 1727 N PRO 224 31.376 -5.071 28.619 1.00 0.00 ATOM 1728 CA PRO 224 32.292 -5.189 27.488 1.00 0.00 ATOM 1729 CB PRO 224 32.196 -6.676 27.093 1.00 0.00 ATOM 1730 CG PRO 224 31.433 -7.350 28.214 1.00 0.00 ATOM 1731 CD PRO 224 30.618 -6.311 28.887 1.00 0.00 ATOM 1732 O PRO 224 30.664 -4.199 26.010 1.00 0.00 ATOM 1733 C PRO 224 31.865 -4.310 26.305 1.00 0.00 ATOM 1734 N ALA 225 32.843 -3.675 25.667 1.00 0.00 ATOM 1735 CA ALA 225 32.601 -2.978 24.402 1.00 0.00 ATOM 1736 CB ALA 225 33.516 -1.779 24.248 1.00 0.00 ATOM 1737 O ALA 225 33.626 -4.863 23.342 1.00 0.00 ATOM 1738 C ALA 225 32.809 -3.941 23.256 1.00 0.00 ATOM 1739 N SER 226 32.080 -3.726 22.171 1.00 0.00 ATOM 1740 CA SER 226 32.196 -4.606 21.015 1.00 0.00 ATOM 1741 CB SER 226 31.205 -5.769 21.116 1.00 0.00 ATOM 1742 OG SER 226 29.885 -5.270 21.229 1.00 0.00 ATOM 1743 O SER 226 31.344 -4.393 18.813 1.00 0.00 ATOM 1744 C SER 226 31.970 -3.865 19.727 1.00 0.00 ATOM 1745 N GLY 227 32.503 -2.649 19.645 1.00 0.00 ATOM 1746 CA GLY 227 32.377 -1.824 18.445 1.00 0.00 ATOM 1747 O GLY 227 34.109 -3.172 17.458 1.00 0.00 ATOM 1748 C GLY 227 33.348 -2.195 17.342 1.00 0.00 ATOM 1749 N LEU 228 33.331 -1.396 16.278 1.00 0.00 ATOM 1750 CA LEU 228 34.146 -1.644 15.082 1.00 0.00 ATOM 1751 CB LEU 228 33.481 -1.021 13.833 1.00 0.00 ATOM 1752 CG LEU 228 32.309 -1.729 13.110 1.00 0.00 ATOM 1753 CD1 LEU 228 32.758 -2.995 12.372 1.00 0.00 ATOM 1754 CD2 LEU 228 31.104 -2.037 14.016 1.00 0.00 ATOM 1755 O LEU 228 36.423 -1.325 14.289 1.00 0.00 ATOM 1756 C LEU 228 35.622 -1.201 15.226 1.00 0.00 ATOM 1757 N SER 229 35.969 -0.682 16.404 1.00 0.00 ATOM 1758 CA SER 229 37.360 -0.358 16.731 1.00 0.00 ATOM 1759 CB SER 229 37.600 1.162 16.735 1.00 0.00 ATOM 1760 OG SER 229 36.884 1.799 17.784 1.00 0.00 ATOM 1761 O SER 229 37.000 -0.740 19.071 1.00 0.00 ATOM 1762 C SER 229 37.700 -0.974 18.085 1.00 0.00 ATOM 1763 N VAL 230 38.759 -1.786 18.107 1.00 0.00 ATOM 1764 CA VAL 230 39.236 -2.426 19.336 1.00 0.00 ATOM 1765 CB VAL 230 39.956 -3.794 19.080 1.00 0.00 ATOM 1766 CG1 VAL 230 38.938 -4.937 19.034 1.00 0.00 ATOM 1767 CG2 VAL 230 40.814 -3.770 17.806 1.00 0.00 ATOM 1768 O VAL 230 39.609 -0.580 20.817 1.00 0.00 ATOM 1769 C VAL 230 40.120 -1.476 20.133 1.00 0.00 ATOM 1770 N GLU 235 36.473 4.341 25.544 1.00 0.00 ATOM 1771 CA GLU 235 36.578 5.064 26.813 1.00 0.00 ATOM 1772 CB GLU 235 36.409 6.571 26.603 1.00 0.00 ATOM 1773 CG GLU 235 37.509 7.214 25.767 1.00 0.00 ATOM 1774 CD GLU 235 37.697 8.690 26.094 1.00 0.00 ATOM 1775 OE1 GLU 235 36.910 9.244 26.909 1.00 0.00 ATOM 1776 OE2 GLU 235 38.639 9.289 25.537 1.00 0.00 ATOM 1777 O GLU 235 35.772 3.428 28.359 1.00 0.00 ATOM 1778 C GLU 235 35.586 4.530 27.840 1.00 0.00 ATOM 1779 N SER 236 34.536 5.290 28.140 1.00 0.00 ATOM 1780 CA SER 236 33.586 4.861 29.162 1.00 0.00 ATOM 1781 CB SER 236 33.891 5.542 30.502 1.00 0.00 ATOM 1782 OG SER 236 33.061 5.013 31.518 1.00 0.00 ATOM 1783 O SER 236 31.891 6.040 27.973 1.00 0.00 ATOM 1784 C SER 236 32.147 5.140 28.765 1.00 0.00 ATOM 1785 N LEU 237 31.216 4.357 29.314 1.00 0.00 ATOM 1786 CA LEU 237 29.798 4.632 29.137 1.00 0.00 ATOM 1787 CB LEU 237 28.964 3.367 29.331 1.00 0.00 ATOM 1788 CG LEU 237 28.970 2.329 28.210 1.00 0.00 ATOM 1789 CD1 LEU 237 28.284 1.076 28.710 1.00 0.00 ATOM 1790 CD2 LEU 237 28.312 2.897 26.945 1.00 0.00 ATOM 1791 O LEU 237 29.942 5.705 31.261 1.00 0.00 ATOM 1792 C LEU 237 29.371 5.653 30.180 1.00 0.00 ATOM 1793 N ASN 238 28.360 6.458 29.847 1.00 0.00 ATOM 1794 CA ASN 238 27.758 7.367 30.815 1.00 0.00 ATOM 1795 CB ASN 238 26.539 8.030 30.158 1.00 0.00 ATOM 1796 CG ASN 238 25.686 8.802 31.156 1.00 0.00 ATOM 1797 ND2 ASN 238 25.927 10.108 31.273 1.00 0.00 ATOM 1798 OD1 ASN 238 24.847 8.225 31.827 1.00 0.00 ATOM 1799 O ASN 238 26.962 5.408 31.978 1.00 0.00 ATOM 1800 C ASN 238 27.376 6.559 32.082 1.00 0.00 ATOM 1801 N VAL 239 27.544 7.143 33.272 1.00 0.00 ATOM 1802 CA VAL 239 27.303 6.383 34.508 1.00 0.00 ATOM 1803 CB VAL 239 27.756 7.184 35.784 1.00 0.00 ATOM 1804 CG1 VAL 239 26.997 8.497 35.896 1.00 0.00 ATOM 1805 CG2 VAL 239 27.573 6.326 37.048 1.00 0.00 ATOM 1806 O VAL 239 25.611 4.825 35.181 1.00 0.00 ATOM 1807 C VAL 239 25.848 5.898 34.655 1.00 0.00 ATOM 1808 N ALA 240 24.878 6.694 34.213 1.00 0.00 ATOM 1809 CA ALA 240 23.480 6.275 34.344 1.00 0.00 ATOM 1810 CB ALA 240 22.544 7.471 34.073 1.00 0.00 ATOM 1811 O ALA 240 22.405 4.219 33.652 1.00 0.00 ATOM 1812 C ALA 240 23.198 5.117 33.367 1.00 0.00 ATOM 1813 N ILE 241 23.796 5.184 32.178 1.00 0.00 ATOM 1814 CA ILE 241 23.676 4.098 31.199 1.00 0.00 ATOM 1815 CB ILE 241 24.371 4.473 29.852 1.00 0.00 ATOM 1816 CG1 ILE 241 23.631 5.636 29.166 1.00 0.00 ATOM 1817 CG2 ILE 241 24.550 3.246 28.921 1.00 0.00 ATOM 1818 CD1 ILE 241 22.195 5.249 28.633 1.00 0.00 ATOM 1819 O ILE 241 23.606 1.740 31.733 1.00 0.00 ATOM 1820 C ILE 241 24.251 2.806 31.784 1.00 0.00 ATOM 1821 N ALA 242 25.456 2.891 32.354 1.00 0.00 ATOM 1822 CA ALA 242 26.093 1.736 32.947 1.00 0.00 ATOM 1823 CB ALA 242 27.516 2.101 33.468 1.00 0.00 ATOM 1824 O ALA 242 25.042 -0.012 34.220 1.00 0.00 ATOM 1825 C ALA 242 25.227 1.199 34.090 1.00 0.00 ATOM 1826 N THR 243 24.665 2.103 34.889 1.00 0.00 ATOM 1827 CA THR 243 23.805 1.680 36.002 1.00 0.00 ATOM 1828 CB THR 243 23.331 2.923 36.802 1.00 0.00 ATOM 1829 CG2 THR 243 22.398 2.534 37.954 1.00 0.00 ATOM 1830 OG1 THR 243 24.469 3.611 37.320 1.00 0.00 ATOM 1831 O THR 243 22.225 -0.139 36.113 1.00 0.00 ATOM 1832 C THR 243 22.589 0.872 35.516 1.00 0.00 ATOM 1833 N ALA 244 21.963 1.347 34.446 1.00 0.00 ATOM 1834 CA ALA 244 20.785 0.696 33.865 1.00 0.00 ATOM 1835 CB ALA 244 20.218 1.545 32.713 1.00 0.00 ATOM 1836 O ALA 244 20.411 -1.665 33.573 1.00 0.00 ATOM 1837 C ALA 244 21.147 -0.705 33.353 1.00 0.00 ATOM 1838 N ILE 245 22.280 -0.808 32.668 1.00 0.00 ATOM 1839 CA ILE 245 22.738 -2.089 32.153 1.00 0.00 ATOM 1840 CB ILE 245 24.002 -1.937 31.280 1.00 0.00 ATOM 1841 CG1 ILE 245 23.609 -1.260 29.955 1.00 0.00 ATOM 1842 CG2 ILE 245 24.598 -3.322 30.950 1.00 0.00 ATOM 1843 CD1 ILE 245 24.798 -0.580 29.255 1.00 0.00 ATOM 1844 O ILE 245 22.456 -4.218 33.288 1.00 0.00 ATOM 1845 C ILE 245 22.961 -3.061 33.317 1.00 0.00 ATOM 1846 N LEU 246 23.667 -2.592 34.341 1.00 0.00 ATOM 1847 CA LEU 246 23.991 -3.444 35.511 1.00 0.00 ATOM 1848 CB LEU 246 24.984 -2.758 36.465 1.00 0.00 ATOM 1849 CG LEU 246 26.416 -2.718 35.911 1.00 0.00 ATOM 1850 CD1 LEU 246 27.199 -1.458 36.389 1.00 0.00 ATOM 1851 CD2 LEU 246 27.156 -3.990 36.274 1.00 0.00 ATOM 1852 O LEU 246 22.557 -5.091 36.517 1.00 0.00 ATOM 1853 C LEU 246 22.726 -3.888 36.258 1.00 0.00 ATOM 1854 N CYS 247 21.858 -2.935 36.615 1.00 0.00 ATOM 1855 CA CYS 247 20.574 -3.277 37.255 1.00 0.00 ATOM 1856 CB CYS 247 19.771 -2.018 37.576 1.00 0.00 ATOM 1857 SG CYS 247 20.547 -1.047 38.847 1.00 0.00 ATOM 1858 O CYS 247 19.120 -5.174 37.048 1.00 0.00 ATOM 1859 C CYS 247 19.710 -4.227 36.460 1.00 0.00 ATOM 1860 N SER 248 19.595 -3.992 35.146 1.00 0.00 ATOM 1861 CA SER 248 18.806 -4.876 34.270 1.00 0.00 ATOM 1862 CB SER 248 18.819 -4.415 32.796 1.00 0.00 ATOM 1863 OG SER 248 18.390 -5.458 31.912 1.00 0.00 ATOM 1864 O SER 248 18.544 -7.223 34.639 1.00 0.00 ATOM 1865 C SER 248 19.311 -6.299 34.386 1.00 0.00 ATOM 1866 N GLU 249 20.618 -6.466 34.228 1.00 0.00 ATOM 1867 CA GLU 249 21.220 -7.786 34.253 1.00 0.00 ATOM 1868 CB GLU 249 22.698 -7.631 33.877 1.00 0.00 ATOM 1869 CG GLU 249 23.515 -8.844 33.744 1.00 0.00 ATOM 1870 CD GLU 249 22.989 -9.906 32.754 1.00 0.00 ATOM 1871 OE1 GLU 249 22.094 -9.685 31.891 1.00 0.00 ATOM 1872 OE2 GLU 249 23.513 -11.008 32.876 1.00 0.00 ATOM 1873 O GLU 249 20.764 -9.671 35.704 1.00 0.00 ATOM 1874 C GLU 249 21.046 -8.469 35.626 1.00 0.00 ATOM 1875 N TRP 250 21.198 -7.693 36.704 1.00 0.00 ATOM 1876 CA TRP 250 20.992 -8.209 38.063 1.00 0.00 ATOM 1877 CB TRP 250 21.191 -7.102 39.099 1.00 0.00 ATOM 1878 CG TRP 250 22.123 -7.458 40.228 1.00 0.00 ATOM 1879 CD1 TRP 250 21.814 -8.136 41.389 1.00 0.00 ATOM 1880 CD2 TRP 250 23.486 -7.061 40.348 1.00 0.00 ATOM 1881 CE2 TRP 250 23.962 -7.551 41.590 1.00 0.00 ATOM 1882 CE3 TRP 250 24.373 -6.360 39.504 1.00 0.00 ATOM 1883 NE1 TRP 250 22.925 -8.191 42.215 1.00 0.00 ATOM 1884 CZ2 TRP 250 25.271 -7.340 42.024 1.00 0.00 ATOM 1885 CZ3 TRP 250 25.667 -6.139 39.945 1.00 0.00 ATOM 1886 CH2 TRP 250 26.101 -6.634 41.192 1.00 0.00 ATOM 1887 O TRP 250 19.359 -9.836 38.707 1.00 0.00 ATOM 1888 C TRP 250 19.566 -8.754 38.180 1.00 0.00 ATOM 1889 N ARG 251 18.599 -7.986 37.678 1.00 0.00 ATOM 1890 CA ARG 251 17.164 -8.365 37.714 1.00 0.00 ATOM 1891 CB ARG 251 16.313 -7.112 37.446 1.00 0.00 ATOM 1892 CG ARG 251 14.781 -7.361 37.293 1.00 0.00 ATOM 1893 CD ARG 251 14.174 -7.921 38.552 1.00 0.00 ATOM 1894 NE ARG 251 14.049 -6.950 39.641 1.00 0.00 ATOM 1895 CZ ARG 251 13.838 -7.284 40.910 1.00 0.00 ATOM 1896 NH1 ARG 251 13.710 -6.335 41.840 1.00 0.00 ATOM 1897 NH2 ARG 251 13.742 -8.578 41.261 1.00 0.00 ATOM 1898 O ARG 251 15.991 -10.409 37.102 1.00 0.00 ATOM 1899 C ARG 251 16.786 -9.509 36.758 1.00 0.00 ATOM 1900 N ARG 252 17.366 -9.513 35.561 1.00 0.00 ATOM 1901 CA ARG 252 17.140 -10.610 34.612 1.00 0.00 ATOM 1902 CB ARG 252 18.061 -10.447 33.402 1.00 0.00 ATOM 1903 CG ARG 252 17.874 -11.531 32.315 1.00 0.00 ATOM 1904 CD ARG 252 18.919 -11.421 31.222 1.00 0.00 ATOM 1905 NE ARG 252 20.282 -11.760 31.642 1.00 0.00 ATOM 1906 CZ ARG 252 20.746 -12.996 31.776 1.00 0.00 ATOM 1907 NH1 ARG 252 19.948 -14.037 31.568 1.00 0.00 ATOM 1908 NH2 ARG 252 22.005 -13.206 32.157 1.00 0.00 ATOM 1909 O ARG 252 16.739 -12.926 35.021 1.00 0.00 ATOM 1910 C ARG 252 17.437 -11.954 35.256 1.00 0.00 ATOM 1911 N ARG 253 18.507 -12.013 36.050 1.00 0.00 ATOM 1912 CA ARG 253 18.921 -13.284 36.667 1.00 0.00 ATOM 1913 CB ARG 253 20.406 -13.224 36.975 1.00 0.00 ATOM 1914 CG ARG 253 21.184 -13.067 35.744 1.00 0.00 ATOM 1915 CD ARG 253 22.592 -13.464 35.968 1.00 0.00 ATOM 1916 NE ARG 253 23.471 -12.599 35.215 1.00 0.00 ATOM 1917 CZ ARG 253 24.772 -12.531 35.435 1.00 0.00 ATOM 1918 NH1 ARG 253 25.309 -13.270 36.381 1.00 0.00 ATOM 1919 NH2 ARG 253 25.515 -11.719 34.713 1.00 0.00 ATOM 1920 O ARG 253 18.428 -14.713 38.556 1.00 0.00 ATOM 1921 C ARG 253 18.172 -13.654 37.952 1.00 0.00 ATOM 1922 N SER 254 17.250 -12.799 38.367 1.00 0.00 ATOM 1923 CA SER 254 16.603 -12.959 39.663 1.00 0.00 ATOM 1924 CB SER 254 16.391 -11.588 40.303 1.00 0.00 ATOM 1925 OG SER 254 17.669 -10.986 40.512 1.00 0.00 ATOM 1926 O SER 254 14.833 -14.197 38.585 1.00 0.00 ATOM 1927 C SER 254 15.316 -13.772 39.650 1.00 0.00 ENDMDL # command:# Prefix for output files set to decoys/ # command:# request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_64099545.pdb -s /var/tmp/to_scwrl_64099545.seq -o /var/tmp/from_scwrl_64099545.pdb > /var/tmp/scwrl_64099545.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_64099545.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 193 # copying to AlignedFragments data structure # command:Warning: Couldn't open file decoys/model2.gdt for output # fraction of real conformation used = 1.000 # GDT_score = -38.600 # GDT_score(maxd=8.000,maxw=2.900)= -39.371 # GDT_score(maxd=8.000,maxw=3.200)= -38.048 # GDT_score(maxd=8.000,maxw=3.500)= -36.625 # GDT_score(maxd=10.000,maxw=3.800)= -38.134 # GDT_score(maxd=10.000,maxw=4.000)= -37.157 # GDT_score(maxd=10.000,maxw=4.200)= -36.158 # GDT_score(maxd=12.000,maxw=4.300)= -38.090 # GDT_score(maxd=12.000,maxw=4.500)= -37.098 # GDT_score(maxd=12.000,maxw=4.700)= -36.129 # GDT_score(maxd=14.000,maxw=5.200)= -35.946 # GDT_score(maxd=14.000,maxw=5.500)= -34.536 # command:# request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_963246202.pdb -s /var/tmp/to_scwrl_963246202.seq -o /var/tmp/from_scwrl_963246202.pdb > /var/tmp/scwrl_963246202.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_963246202.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 237 # copying to AlignedFragments data structure # command:Warning: Couldn't open file decoys/model3.gdt for output # fraction of real conformation used = 1.000 # GDT_score = -45.900 # GDT_score(maxd=8.000,maxw=2.900)= -47.066 # GDT_score(maxd=8.000,maxw=3.200)= -45.399 # GDT_score(maxd=8.000,maxw=3.500)= -43.680 # GDT_score(maxd=10.000,maxw=3.800)= -46.017 # GDT_score(maxd=10.000,maxw=4.000)= -44.839 # GDT_score(maxd=10.000,maxw=4.200)= -43.656 # GDT_score(maxd=12.000,maxw=4.300)= -46.979 # GDT_score(maxd=12.000,maxw=4.500)= -45.757 # GDT_score(maxd=12.000,maxw=4.700)= -44.479 # GDT_score(maxd=14.000,maxw=5.200)= -44.705 # GDT_score(maxd=14.000,maxw=5.500)= -42.850 # command:# request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1471332573.pdb -s /var/tmp/to_scwrl_1471332573.seq -o /var/tmp/from_scwrl_1471332573.pdb > /var/tmp/scwrl_1471332573.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1471332573.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 237 # copying to AlignedFragments data structure # command:Warning: Couldn't open file decoys/model4.gdt for output # fraction of real conformation used = 1.000 # GDT_score = -46.000 # GDT_score(maxd=8.000,maxw=2.900)= -47.066 # GDT_score(maxd=8.000,maxw=3.200)= -45.400 # GDT_score(maxd=8.000,maxw=3.500)= -43.683 # GDT_score(maxd=10.000,maxw=3.800)= -46.023 # GDT_score(maxd=10.000,maxw=4.000)= -44.845 # GDT_score(maxd=10.000,maxw=4.200)= -43.659 # GDT_score(maxd=12.000,maxw=4.300)= -46.985 # GDT_score(maxd=12.000,maxw=4.500)= -45.759 # GDT_score(maxd=12.000,maxw=4.700)= -44.481 # GDT_score(maxd=14.000,maxw=5.200)= -44.707 # GDT_score(maxd=14.000,maxw=5.500)= -42.854 # command:# request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_508801009.pdb -s /var/tmp/to_scwrl_508801009.seq -o /var/tmp/from_scwrl_508801009.pdb > /var/tmp/scwrl_508801009.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_508801009.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 138 # copying to AlignedFragments data structure # command:Warning: Couldn't open file decoys/model5.gdt for output # fraction of real conformation used = 1.000 # GDT_score = -46.100 # GDT_score(maxd=8.000,maxw=2.900)= -47.126 # GDT_score(maxd=8.000,maxw=3.200)= -45.457 # GDT_score(maxd=8.000,maxw=3.500)= -43.715 # GDT_score(maxd=10.000,maxw=3.800)= -46.071 # GDT_score(maxd=10.000,maxw=4.000)= -44.912 # GDT_score(maxd=10.000,maxw=4.200)= -43.735 # GDT_score(maxd=12.000,maxw=4.300)= -47.054 # GDT_score(maxd=12.000,maxw=4.500)= -45.840 # GDT_score(maxd=12.000,maxw=4.700)= -44.567 # GDT_score(maxd=14.000,maxw=5.200)= -44.780 # GDT_score(maxd=14.000,maxw=5.500)= -42.897 # command:# request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_588222637.pdb -s /var/tmp/to_scwrl_588222637.seq -o /var/tmp/from_scwrl_588222637.pdb > /var/tmp/scwrl_588222637.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_588222637.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 T0378.try1-opt2.pdb looking for model 1 # Found a chain break before 238 # copying to AlignedFragments data structure # command:Warning: Couldn't open file decoys/try1.gdt for output # fraction of real conformation used = 1.000 # GDT_score = -46.000 # GDT_score(maxd=8.000,maxw=2.900)= -47.002 # GDT_score(maxd=8.000,maxw=3.200)= -45.392 # GDT_score(maxd=8.000,maxw=3.500)= -43.736 # GDT_score(maxd=10.000,maxw=3.800)= -46.032 # GDT_score(maxd=10.000,maxw=4.000)= -44.928 # GDT_score(maxd=10.000,maxw=4.200)= -43.785 # GDT_score(maxd=12.000,maxw=4.300)= -47.056 # GDT_score(maxd=12.000,maxw=4.500)= -45.861 # GDT_score(maxd=12.000,maxw=4.700)= -44.616 # GDT_score(maxd=14.000,maxw=5.200)= -44.835 # GDT_score(maxd=14.000,maxw=5.500)= -43.001 # command:# Prefix for output files set to # command:Warning: Couldn't open file T0378.try1-real.pdb for output Error: Couldn't open file T0378.try1-real.pdb for output superimposing iter= 0 total_weight= 2927.000 rmsd (weighted)= 10.216 (unweighted)= 12.905 superimposing iter= 1 total_weight= 5706.358 rmsd (weighted)= 5.722 (unweighted)= 12.999 superimposing iter= 2 total_weight= 2651.891 rmsd (weighted)= 4.825 (unweighted)= 13.053 superimposing iter= 3 total_weight= 2135.296 rmsd (weighted)= 4.548 (unweighted)= 13.082 superimposing iter= 4 total_weight= 2026.578 rmsd (weighted)= 4.403 (unweighted)= 13.103 superimposing iter= 5 total_weight= 2008.389 rmsd (weighted)= 4.279 (unweighted)= 13.130 EXPDTA T0378.try1-opt2.pdb MODEL 1 REMARK 44 REMARK 44 model 1 is called T0378.try1-opt2.pdb ATOM 1 N MET A 1 33.713 23.753 51.288 1.00 0.00 ATOM 2 CA MET A 1 34.834 24.673 51.397 1.00 0.00 ATOM 3 CB MET A 1 36.179 23.918 51.157 1.00 0.00 ATOM 4 CG MET A 1 36.510 22.817 52.071 1.00 0.00 ATOM 5 SD MET A 1 38.204 22.246 51.930 1.00 0.00 ATOM 6 CE MET A 1 37.896 20.582 51.311 1.00 0.00 ATOM 7 O MET A 1 35.040 27.005 50.921 1.00 0.00 ATOM 8 C MET A 1 34.763 25.886 50.472 1.00 0.00 ATOM 9 N LEU A 2 34.369 25.702 49.245 1.00 0.00 ATOM 10 CA LEU A 2 34.213 26.831 48.308 1.00 0.00 ATOM 11 CB LEU A 2 34.031 26.300 46.877 1.00 0.00 ATOM 12 CG LEU A 2 35.108 25.384 46.331 1.00 0.00 ATOM 13 CD1 LEU A 2 34.730 24.920 44.934 1.00 0.00 ATOM 14 CD2 LEU A 2 36.459 26.087 46.344 1.00 0.00 ATOM 15 O LEU A 2 32.055 27.239 49.251 1.00 0.00 ATOM 16 C LEU A 2 33.071 27.734 48.736 1.00 0.00 ATOM 17 N SER A 3 33.142 29.099 48.475 1.00 0.00 ATOM 18 CA SER A 3 32.105 30.032 48.915 1.00 0.00 ATOM 19 CB SER A 3 32.454 31.472 48.509 1.00 0.00 ATOM 20 OG SER A 3 33.748 31.848 49.051 1.00 0.00 ATOM 21 O SER A 3 29.802 29.458 49.295 1.00 0.00 ATOM 22 C SER A 3 30.713 29.579 48.473 1.00 0.00 ATOM 23 N ALA A 4 30.524 29.298 47.167 1.00 0.00 ATOM 24 CA ALA A 4 29.222 28.876 46.669 1.00 0.00 ATOM 25 CB ALA A 4 29.249 28.815 45.149 1.00 0.00 ATOM 26 O ALA A 4 27.807 27.204 47.618 1.00 0.00 ATOM 27 C ALA A 4 28.926 27.480 47.206 1.00 0.00 ATOM 28 N ASN A 5 29.918 26.599 47.216 1.00 0.00 ATOM 29 CA ASN A 5 29.670 25.253 47.720 1.00 0.00 ATOM 30 CB ASN A 5 30.927 24.390 47.585 1.00 0.00 ATOM 31 CG ASN A 5 31.213 23.999 46.148 1.00 0.00 ATOM 32 ND2 ASN A 5 32.453 23.609 45.879 1.00 0.00 ATOM 33 OD1 ASN A 5 30.329 24.047 45.294 1.00 0.00 ATOM 34 O ASN A 5 28.332 24.616 49.612 1.00 0.00 ATOM 35 C ASN A 5 29.272 25.280 49.191 1.00 0.00 ATOM 36 N GLN A 6 30.006 26.064 49.966 1.00 0.00 ATOM 37 CA GLN A 6 29.767 26.168 51.411 1.00 0.00 ATOM 38 CB GLN A 6 30.911 26.999 52.065 1.00 0.00 ATOM 39 CG GLN A 6 30.825 27.127 53.591 1.00 0.00 ATOM 40 CD GLN A 6 31.062 25.829 54.362 1.00 0.00 ATOM 41 OE1 GLN A 6 30.809 25.776 55.567 1.00 0.00 ATOM 42 NE2 GLN A 6 31.516 24.783 53.680 1.00 0.00 ATOM 43 O GLN A 6 27.696 26.333 52.594 1.00 0.00 ATOM 44 C GLN A 6 28.423 26.789 51.707 1.00 0.00 ATOM 45 N ILE A 7 28.086 27.845 50.991 1.00 0.00 ATOM 46 CA ILE A 7 26.780 28.482 51.153 1.00 0.00 ATOM 47 CB ILE A 7 26.679 29.716 50.239 1.00 0.00 ATOM 48 CG1 ILE A 7 27.653 30.803 50.698 1.00 0.00 ATOM 49 CG2 ILE A 7 25.270 30.289 50.270 1.00 0.00 ATOM 50 CD1 ILE A 7 27.818 31.935 49.708 1.00 0.00 ATOM 51 O ILE A 7 24.647 27.518 51.506 1.00 0.00 ATOM 52 C ILE A 7 25.634 27.559 50.798 1.00 0.00 ATOM 53 N LYS A 8 25.764 26.859 49.672 1.00 0.00 ATOM 54 CA LYS A 8 24.686 26.032 49.157 1.00 0.00 ATOM 55 CB LYS A 8 25.062 25.452 47.792 1.00 0.00 ATOM 56 CG LYS A 8 25.110 26.479 46.674 1.00 0.00 ATOM 57 CD LYS A 8 25.493 25.838 45.351 1.00 0.00 ATOM 58 CE LYS A 8 25.543 26.865 44.231 1.00 0.00 ATOM 59 NZ LYS A 8 25.945 26.255 42.934 1.00 0.00 ATOM 60 O LYS A 8 23.282 24.411 50.225 1.00 0.00 ATOM 61 C LYS A 8 24.416 24.885 50.125 1.00 0.00 ATOM 62 N PHE A 9 25.458 24.454 50.855 1.00 0.00 ATOM 63 CA PHE A 9 25.266 23.415 51.843 1.00 0.00 ATOM 64 CB PHE A 9 26.605 23.076 52.533 1.00 0.00 ATOM 65 CG PHE A 9 26.500 21.980 53.550 1.00 0.00 ATOM 66 CD1 PHE A 9 26.312 20.658 53.149 1.00 0.00 ATOM 67 CD2 PHE A 9 26.546 22.270 54.908 1.00 0.00 ATOM 68 CE1 PHE A 9 26.167 19.643 54.083 1.00 0.00 ATOM 69 CE2 PHE A 9 26.402 21.259 55.855 1.00 0.00 ATOM 70 CZ PHE A 9 26.212 19.942 55.441 1.00 0.00 ATOM 71 O PHE A 9 23.433 23.071 53.373 1.00 0.00 ATOM 72 C PHE A 9 24.272 23.865 52.933 1.00 0.00 ATOM 73 N LEU A 10 24.360 25.142 53.355 1.00 0.00 ATOM 74 CA LEU A 10 23.445 25.646 54.384 1.00 0.00 ATOM 75 CB LEU A 10 23.806 27.090 54.734 1.00 0.00 ATOM 76 CG LEU A 10 22.926 27.773 55.786 1.00 0.00 ATOM 77 CD1 LEU A 10 22.950 26.968 57.079 1.00 0.00 ATOM 78 CD2 LEU A 10 23.422 29.191 56.026 1.00 0.00 ATOM 79 O LEU A 10 21.114 25.157 54.681 1.00 0.00 ATOM 80 C LEU A 10 21.990 25.573 53.921 1.00 0.00 ATOM 81 N ARG A 11 21.743 25.979 52.670 1.00 0.00 ATOM 82 CA ARG A 11 20.397 25.969 52.092 1.00 0.00 ATOM 83 CB ARG A 11 20.317 26.676 50.699 1.00 0.00 ATOM 84 CG ARG A 11 20.053 28.160 50.834 1.00 0.00 ATOM 85 CD ARG A 11 20.648 28.876 49.614 1.00 0.00 ATOM 86 NE ARG A 11 20.481 30.321 49.891 1.00 0.00 ATOM 87 CZ ARG A 11 21.144 30.928 50.878 1.00 0.00 ATOM 88 NH1 ARG A 11 22.022 30.249 51.618 1.00 0.00 ATOM 89 NH2 ARG A 11 20.996 32.226 51.134 1.00 0.00 ATOM 90 O ARG A 11 18.666 24.315 52.287 1.00 0.00 ATOM 91 C ARG A 11 19.847 24.546 52.020 1.00 0.00 ATOM 92 N SER A 12 20.698 23.619 51.650 1.00 0.00 ATOM 93 CA SER A 12 20.278 22.226 51.554 1.00 0.00 ATOM 94 CB SER A 12 21.326 21.344 50.854 1.00 0.00 ATOM 95 OG SER A 12 22.505 21.204 51.625 1.00 0.00 ATOM 96 O SER A 12 18.954 20.947 53.131 1.00 0.00 ATOM 97 C SER A 12 19.910 21.732 52.955 1.00 0.00 ATOM 98 N LEU A 13 20.698 22.171 53.946 1.00 0.00 ATOM 99 CA LEU A 13 20.432 21.812 55.340 1.00 0.00 ATOM 100 CB LEU A 13 21.557 22.332 56.247 1.00 0.00 ATOM 101 CG LEU A 13 21.280 22.221 57.753 1.00 0.00 ATOM 102 CD1 LEU A 13 21.254 20.750 58.168 1.00 0.00 ATOM 103 CD2 LEU A 13 22.345 22.972 58.538 1.00 0.00 ATOM 104 O LEU A 13 18.253 21.723 56.342 1.00 0.00 ATOM 105 C LEU A 13 19.103 22.417 55.785 1.00 0.00 ATOM 106 N ARG A 14 18.916 23.704 55.531 1.00 0.00 ATOM 107 CA ARG A 14 17.677 24.362 55.928 1.00 0.00 ATOM 108 CB ARG A 14 17.761 25.847 55.594 1.00 0.00 ATOM 109 CG ARG A 14 16.546 26.658 56.011 1.00 0.00 ATOM 110 CD ARG A 14 16.763 28.108 55.639 1.00 0.00 ATOM 111 NE ARG A 14 17.979 28.623 56.257 1.00 0.00 ATOM 112 CZ ARG A 14 18.827 29.457 55.666 1.00 0.00 ATOM 113 NH1 ARG A 14 18.596 29.875 54.426 1.00 0.00 ATOM 114 NH2 ARG A 14 19.907 29.873 56.314 1.00 0.00 ATOM 115 O ARG A 14 15.418 23.584 55.916 1.00 0.00 ATOM 116 C ARG A 14 16.453 23.755 55.268 1.00 0.00 ATOM 117 N GLU A 15 16.578 23.435 53.996 1.00 0.00 ATOM 118 CA GLU A 15 15.449 22.876 53.266 1.00 0.00 ATOM 119 CB GLU A 15 15.819 22.880 51.762 1.00 0.00 ATOM 120 CG GLU A 15 15.981 24.308 51.268 1.00 0.00 ATOM 121 CD GLU A 15 14.703 25.073 51.026 1.00 0.00 ATOM 122 OE1 GLU A 15 14.822 26.242 50.537 1.00 0.00 ATOM 123 OE2 GLU A 15 13.606 24.563 51.303 1.00 0.00 ATOM 124 O GLU A 15 13.833 21.172 53.756 1.00 0.00 ATOM 125 C GLU A 15 15.042 21.528 53.840 1.00 0.00 ATOM 126 N ARG A 16 16.043 20.766 54.349 1.00 0.00 ATOM 127 CA ARG A 16 15.729 19.457 54.917 1.00 0.00 ATOM 128 CB ARG A 16 17.009 18.736 55.344 1.00 0.00 ATOM 129 CG ARG A 16 17.868 18.259 54.184 1.00 0.00 ATOM 130 CD ARG A 16 19.155 17.619 54.678 1.00 0.00 ATOM 131 NE ARG A 16 20.007 17.179 53.575 1.00 0.00 ATOM 132 CZ ARG A 16 21.218 16.654 53.729 1.00 0.00 ATOM 133 NH1 ARG A 16 21.919 16.283 52.666 1.00 0.00 ATOM 134 NH2 ARG A 16 21.725 16.504 54.944 1.00 0.00 ATOM 135 O ARG A 16 13.940 18.754 56.370 1.00 0.00 ATOM 136 C ARG A 16 14.825 19.579 56.134 1.00 0.00 ATOM 137 N LYS A 17 15.100 20.523 57.024 1.00 0.00 ATOM 138 CA LYS A 17 14.281 20.687 58.228 1.00 0.00 ATOM 139 CB LYS A 17 14.818 21.831 59.091 1.00 0.00 ATOM 140 CG LYS A 17 16.151 21.532 59.758 1.00 0.00 ATOM 141 CD LYS A 17 16.624 22.707 60.598 1.00 0.00 ATOM 142 CE LYS A 17 17.968 22.417 61.246 1.00 0.00 ATOM 143 NZ LYS A 17 18.460 23.572 62.046 1.00 0.00 ATOM 144 O LYS A 17 11.926 20.500 58.613 1.00 0.00 ATOM 145 C LYS A 17 12.809 21.003 57.929 1.00 0.00 ATOM 146 N TYR A 18 12.537 21.783 56.882 1.00 0.00 ATOM 147 CA TYR A 18 11.154 22.114 56.547 1.00 0.00 ATOM 148 CB TYR A 18 11.107 23.093 55.372 1.00 0.00 ATOM 149 CG TYR A 18 9.707 23.468 54.942 1.00 0.00 ATOM 150 CD1 TYR A 18 8.966 24.397 55.661 1.00 0.00 ATOM 151 CD2 TYR A 18 9.131 22.891 53.817 1.00 0.00 ATOM 152 CE1 TYR A 18 7.685 24.743 55.276 1.00 0.00 ATOM 153 CE2 TYR A 18 7.851 23.226 53.417 1.00 0.00 ATOM 154 CZ TYR A 18 7.130 24.161 54.157 1.00 0.00 ATOM 155 OH TYR A 18 5.854 24.504 53.770 1.00 0.00 ATOM 156 O TYR A 18 9.253 20.666 56.578 1.00 0.00 ATOM 157 C TYR A 18 10.386 20.861 56.158 1.00 0.00 ATOM 158 N ARG A 19 11.011 20.001 55.365 1.00 0.00 ATOM 159 CA ARG A 19 10.391 18.744 54.993 1.00 0.00 ATOM 160 CB ARG A 19 11.281 17.974 54.015 1.00 0.00 ATOM 161 CG ARG A 19 11.387 18.610 52.639 1.00 0.00 ATOM 162 CD ARG A 19 12.252 17.776 51.709 1.00 0.00 ATOM 163 NE ARG A 19 12.444 18.422 50.413 1.00 0.00 ATOM 164 CZ ARG A 19 11.556 18.390 49.423 1.00 0.00 ATOM 165 NH1 ARG A 19 11.817 19.007 48.280 1.00 0.00 ATOM 166 NH2 ARG A 19 10.411 17.742 49.582 1.00 0.00 ATOM 167 O ARG A 19 9.116 17.257 56.386 1.00 0.00 ATOM 168 C ARG A 19 10.167 17.870 56.218 1.00 0.00 ATOM 169 N LEU A 20 11.165 17.822 57.078 1.00 0.00 ATOM 170 CA LEU A 20 11.119 16.944 58.233 1.00 0.00 ATOM 171 CB LEU A 20 12.451 16.979 58.987 1.00 0.00 ATOM 172 CG LEU A 20 13.645 16.335 58.282 1.00 0.00 ATOM 173 CD1 LEU A 20 14.932 16.605 59.048 1.00 0.00 ATOM 174 CD2 LEU A 20 13.461 14.829 58.178 1.00 0.00 ATOM 175 O LEU A 20 9.255 16.506 59.652 1.00 0.00 ATOM 176 C LEU A 20 10.030 17.343 59.213 1.00 0.00 ATOM 177 N ARG A 21 9.952 18.620 59.553 1.00 0.00 ATOM 178 CA ARG A 21 8.959 19.023 60.518 1.00 0.00 ATOM 179 CB ARG A 21 9.161 20.488 60.914 1.00 0.00 ATOM 180 CG ARG A 21 10.395 20.734 61.766 1.00 0.00 ATOM 181 CD ARG A 21 10.579 22.216 62.053 1.00 0.00 ATOM 182 NE ARG A 21 11.768 22.472 62.863 1.00 0.00 ATOM 183 CZ ARG A 21 12.232 23.684 63.147 1.00 0.00 ATOM 184 NH1 ARG A 21 13.320 23.821 63.892 1.00 0.00 ATOM 185 NH2 ARG A 21 11.606 24.758 62.685 1.00 0.00 ATOM 186 O ARG A 21 6.656 18.372 60.775 1.00 0.00 ATOM 187 C ARG A 21 7.541 18.770 60.009 1.00 0.00 ATOM 188 N GLU A 22 7.314 19.030 58.709 1.00 0.00 ATOM 189 CA GLU A 22 6.020 18.834 58.073 1.00 0.00 ATOM 190 CB GLU A 22 5.924 19.580 56.740 1.00 0.00 ATOM 191 CG GLU A 22 5.970 21.094 56.871 1.00 0.00 ATOM 192 CD GLU A 22 4.803 21.645 57.668 1.00 0.00 ATOM 193 OE1 GLU A 22 3.645 21.351 57.305 1.00 0.00 ATOM 194 OE2 GLU A 22 5.048 22.371 58.653 1.00 0.00 ATOM 195 O GLU A 22 4.658 16.956 57.548 1.00 0.00 ATOM 196 C GLU A 22 5.772 17.355 57.805 1.00 0.00 ATOM 197 N GLN A 23 6.808 16.533 57.887 1.00 0.00 ATOM 198 CA GLN A 23 6.684 15.101 57.653 1.00 0.00 ATOM 199 CB GLN A 23 5.613 14.500 58.565 1.00 0.00 ATOM 200 CG GLN A 23 5.915 14.634 60.049 1.00 0.00 ATOM 201 CD GLN A 23 4.856 13.988 60.920 1.00 0.00 ATOM 202 OE1 GLN A 23 3.934 13.345 60.418 1.00 0.00 ATOM 203 NE2 GLN A 23 4.985 14.156 62.230 1.00 0.00 ATOM 204 O GLN A 23 5.560 13.747 56.012 1.00 0.00 ATOM 205 C GLN A 23 6.280 14.731 56.235 1.00 0.00 ATOM 206 N ALA A 24 6.740 15.501 55.259 1.00 0.00 ATOM 207 CA ALA A 24 6.333 15.281 53.873 1.00 0.00 ATOM 208 CB ALA A 24 5.002 15.962 53.583 1.00 0.00 ATOM 209 O ALA A 24 7.906 16.933 53.141 1.00 0.00 ATOM 210 C ALA A 24 7.275 15.919 52.861 1.00 0.00 ATOM 211 N PHE A 25 7.303 15.338 51.712 1.00 0.00 ATOM 212 CA PHE A 25 8.146 15.815 50.613 1.00 0.00 ATOM 213 CB PHE A 25 9.435 14.999 50.504 1.00 0.00 ATOM 214 CG PHE A 25 9.210 13.550 50.175 1.00 0.00 ATOM 215 CD1 PHE A 25 9.224 13.112 48.862 1.00 0.00 ATOM 216 CD2 PHE A 25 8.982 12.625 51.180 1.00 0.00 ATOM 217 CE1 PHE A 25 9.016 11.781 48.560 1.00 0.00 ATOM 218 CE2 PHE A 25 8.774 11.293 50.877 1.00 0.00 ATOM 219 CZ PHE A 25 8.790 10.869 49.574 1.00 0.00 ATOM 220 O PHE A 25 6.314 15.131 49.237 1.00 0.00 ATOM 221 C PHE A 25 7.366 15.767 49.312 1.00 0.00 ATOM 222 N ALA A 26 7.864 16.386 48.253 1.00 0.00 ATOM 223 CA ALA A 26 7.251 16.410 46.931 1.00 0.00 ATOM 224 CB ALA A 26 7.468 17.747 46.240 1.00 0.00 ATOM 225 O ALA A 26 9.051 15.105 45.988 1.00 0.00 ATOM 226 C ALA A 26 7.846 15.309 46.025 1.00 0.00 ATOM 227 N VAL A 27 6.975 14.641 45.286 1.00 0.00 ATOM 228 CA VAL A 27 7.360 13.643 44.302 1.00 0.00 ATOM 229 CB VAL A 27 6.739 12.278 44.590 1.00 0.00 ATOM 230 CG1 VAL A 27 6.940 11.362 43.375 1.00 0.00 ATOM 231 CG2 VAL A 27 7.379 11.685 45.820 1.00 0.00 ATOM 232 O VAL A 27 5.494 14.201 42.919 1.00 0.00 ATOM 233 C VAL A 27 6.704 14.044 42.993 1.00 0.00 ATOM 234 N GLU A 28 7.503 14.244 41.967 1.00 0.00 ATOM 235 CA GLU A 28 6.990 14.752 40.698 1.00 0.00 ATOM 236 CB GLU A 28 7.822 15.945 40.223 1.00 0.00 ATOM 237 CG GLU A 28 7.717 17.171 41.118 1.00 0.00 ATOM 238 CD GLU A 28 8.494 18.354 40.578 1.00 0.00 ATOM 239 OE1 GLU A 28 9.162 18.201 39.533 1.00 0.00 ATOM 240 OE2 GLU A 28 8.435 19.437 41.198 1.00 0.00 ATOM 241 O GLU A 28 7.996 12.928 39.562 1.00 0.00 ATOM 242 C GLU A 28 7.041 13.682 39.623 1.00 0.00 ATOM 243 N GLY A 29 5.993 13.626 38.796 1.00 0.00 ATOM 244 CA GLY A 29 5.936 12.702 37.678 1.00 0.00 ATOM 245 O GLY A 29 5.017 10.946 39.030 1.00 0.00 ATOM 246 C GLY A 29 5.022 11.516 37.946 1.00 0.00 ATOM 247 N PRO A 30 4.257 11.133 36.929 1.00 0.00 ATOM 248 CA PRO A 30 3.368 9.989 37.038 1.00 0.00 ATOM 249 CB PRO A 30 2.803 9.825 35.626 1.00 0.00 ATOM 250 CG PRO A 30 2.807 11.205 35.059 1.00 0.00 ATOM 251 CD PRO A 30 4.075 11.850 35.541 1.00 0.00 ATOM 252 O PRO A 30 3.625 7.972 38.316 1.00 0.00 ATOM 253 C PRO A 30 4.119 8.726 37.482 1.00 0.00 ATOM 254 N LYS A 31 5.321 8.519 36.970 1.00 0.00 ATOM 255 CA LYS A 31 5.999 7.256 37.206 1.00 0.00 ATOM 256 CB LYS A 31 7.236 7.137 36.315 1.00 0.00 ATOM 257 CG LYS A 31 7.984 5.822 36.460 1.00 0.00 ATOM 258 CD LYS A 31 9.148 5.737 35.488 1.00 0.00 ATOM 259 CE LYS A 31 9.915 4.435 35.658 1.00 0.00 ATOM 260 NZ LYS A 31 11.092 4.362 34.749 1.00 0.00 ATOM 261 O LYS A 31 6.296 6.039 39.252 1.00 0.00 ATOM 262 C LYS A 31 6.449 7.107 38.656 1.00 0.00 ATOM 263 N LEU A 32 7.031 8.172 39.228 1.00 0.00 ATOM 264 CA LEU A 32 7.518 8.131 40.605 1.00 0.00 ATOM 265 CB LEU A 32 8.287 9.419 40.967 1.00 0.00 ATOM 266 CG LEU A 32 9.569 9.720 40.174 1.00 0.00 ATOM 267 CD1 LEU A 32 10.103 11.089 40.562 1.00 0.00 ATOM 268 CD2 LEU A 32 10.603 8.660 40.476 1.00 0.00 ATOM 269 O LEU A 32 6.354 7.318 42.521 1.00 0.00 ATOM 270 C LEU A 32 6.326 8.058 41.547 1.00 0.00 ATOM 271 N VAL A 33 5.266 8.810 41.268 1.00 0.00 ATOM 272 CA VAL A 33 4.087 8.755 42.137 1.00 0.00 ATOM 273 CB VAL A 33 3.000 9.745 41.678 1.00 0.00 ATOM 274 CG1 VAL A 33 1.723 9.547 42.482 1.00 0.00 ATOM 275 CG2 VAL A 33 3.470 11.179 41.867 1.00 0.00 ATOM 276 O VAL A 33 3.115 6.835 43.186 1.00 0.00 ATOM 277 C VAL A 33 3.482 7.349 42.141 1.00 0.00 ATOM 278 N GLY A 34 3.535 6.613 40.967 1.00 0.00 ATOM 279 CA GLY A 34 3.014 5.233 40.867 1.00 0.00 ATOM 280 O GLY A 34 3.238 3.382 42.387 1.00 0.00 ATOM 281 C GLY A 34 3.818 4.267 41.727 1.00 0.00 ATOM 282 N GLU A 35 5.133 4.418 41.715 1.00 0.00 ATOM 283 CA GLU A 35 6.023 3.550 42.509 1.00 0.00 ATOM 284 CB GLU A 35 7.487 3.811 42.141 1.00 0.00 ATOM 285 CG GLU A 35 7.864 3.404 40.717 1.00 0.00 ATOM 286 CD GLU A 35 7.383 2.007 40.369 1.00 0.00 ATOM 287 OE1 GLU A 35 7.563 1.097 41.203 1.00 0.00 ATOM 288 OE2 GLU A 35 6.825 1.819 39.267 1.00 0.00 ATOM 289 O GLU A 35 5.851 2.877 44.816 1.00 0.00 ATOM 290 C GLU A 35 5.811 3.812 44.008 1.00 0.00 ATOM 291 N MET A 36 5.603 5.067 44.401 1.00 0.00 ATOM 292 CA MET A 36 5.340 5.375 45.804 1.00 0.00 ATOM 293 CB MET A 36 5.164 6.882 46.007 1.00 0.00 ATOM 294 CG MET A 36 6.452 7.680 45.877 1.00 0.00 ATOM 295 SD MET A 36 7.674 7.237 47.125 1.00 0.00 ATOM 296 CE MET A 36 6.889 7.866 48.606 1.00 0.00 ATOM 297 O MET A 36 4.006 3.997 47.250 1.00 0.00 ATOM 298 C MET A 36 4.050 4.665 46.233 1.00 0.00 ATOM 299 N LEU A 37 3.017 4.771 45.413 1.00 0.00 ATOM 300 CA LEU A 37 1.749 4.126 45.691 1.00 0.00 ATOM 301 CB LEU A 37 0.724 4.473 44.610 1.00 0.00 ATOM 302 CG LEU A 37 -0.663 3.844 44.766 1.00 0.00 ATOM 303 CD1 LEU A 37 -1.322 4.305 46.057 1.00 0.00 ATOM 304 CD2 LEU A 37 -1.564 4.238 43.605 1.00 0.00 ATOM 305 O LEU A 37 1.505 1.889 46.608 1.00 0.00 ATOM 306 C LEU A 37 1.943 2.590 45.677 1.00 0.00 ATOM 307 N PRO A 38 2.593 2.069 44.655 1.00 0.00 ATOM 308 CA PRO A 38 2.799 0.601 44.672 1.00 0.00 ATOM 309 CB PRO A 38 3.427 0.286 43.301 1.00 0.00 ATOM 310 CG PRO A 38 3.324 1.499 42.503 1.00 0.00 ATOM 311 CD PRO A 38 3.051 2.659 43.389 1.00 0.00 ATOM 312 O PRO A 38 3.313 -1.157 46.234 1.00 0.00 ATOM 313 C PRO A 38 3.564 -0.006 45.867 1.00 0.00 ATOM 314 N PHE A 39 4.489 0.748 46.459 1.00 0.00 ATOM 315 CA PHE A 39 5.263 0.258 47.600 1.00 0.00 ATOM 316 CB PHE A 39 6.724 0.702 47.495 1.00 0.00 ATOM 317 CG PHE A 39 7.451 0.118 46.317 1.00 0.00 ATOM 318 CD1 PHE A 39 7.671 0.871 45.178 1.00 0.00 ATOM 319 CD2 PHE A 39 7.915 -1.187 46.351 1.00 0.00 ATOM 320 CE1 PHE A 39 8.340 0.333 44.095 1.00 0.00 ATOM 321 CE2 PHE A 39 8.584 -1.724 45.267 1.00 0.00 ATOM 322 CZ PHE A 39 8.798 -0.970 44.143 1.00 0.00 ATOM 323 O PHE A 39 5.377 0.716 49.950 1.00 0.00 ATOM 324 C PHE A 39 4.714 0.795 48.923 1.00 0.00 ATOM 325 N TYR A 40 3.512 1.359 48.886 1.00 0.00 ATOM 326 CA TYR A 40 2.769 1.719 50.088 1.00 0.00 ATOM 327 CB TYR A 40 2.905 0.622 51.147 1.00 0.00 ATOM 328 CG TYR A 40 2.484 -0.748 50.666 1.00 0.00 ATOM 329 CD1 TYR A 40 3.423 -1.751 50.465 1.00 0.00 ATOM 330 CD2 TYR A 40 1.147 -1.035 50.415 1.00 0.00 ATOM 331 CE1 TYR A 40 3.047 -3.007 50.027 1.00 0.00 ATOM 332 CE2 TYR A 40 0.754 -2.285 49.976 1.00 0.00 ATOM 333 CZ TYR A 40 1.718 -3.274 49.784 1.00 0.00 ATOM 334 OH TYR A 40 1.342 -4.522 49.347 1.00 0.00 ATOM 335 O TYR A 40 2.875 3.104 51.998 1.00 0.00 ATOM 336 C TYR A 40 3.148 2.990 50.818 1.00 0.00 ATOM 337 N ARG A 41 3.675 4.022 50.035 1.00 0.00 ATOM 338 CA ARG A 41 3.994 5.306 50.675 1.00 0.00 ATOM 339 CB ARG A 41 5.269 5.935 50.044 1.00 0.00 ATOM 340 CG ARG A 41 6.449 4.990 50.133 1.00 0.00 ATOM 341 CD ARG A 41 7.776 5.677 49.836 1.00 0.00 ATOM 342 NE ARG A 41 8.666 4.639 49.328 1.00 0.00 ATOM 343 CZ ARG A 41 9.928 4.486 49.728 1.00 0.00 ATOM 344 NH1 ARG A 41 10.439 5.309 50.631 1.00 0.00 ATOM 345 NH2 ARG A 41 10.626 3.514 49.156 1.00 0.00 ATOM 346 O ARG A 41 2.183 6.429 49.624 1.00 0.00 ATOM 347 C ARG A 41 2.724 6.143 50.685 1.00 0.00 ATOM 348 N CYS A 42 2.243 6.553 51.853 1.00 0.00 ATOM 349 CA CYS A 42 1.045 7.394 51.917 1.00 0.00 ATOM 350 CB CYS A 42 0.716 7.746 53.369 1.00 0.00 ATOM 351 SG CYS A 42 -0.759 8.772 53.573 1.00 0.00 ATOM 352 O CYS A 42 2.225 9.434 51.278 1.00 0.00 ATOM 353 C CYS A 42 1.203 8.727 51.144 1.00 0.00 ATOM 354 N ARG A 43 0.209 9.017 50.309 1.00 0.00 ATOM 355 CA ARG A 43 0.125 10.250 49.558 1.00 0.00 ATOM 356 CB ARG A 43 0.317 9.935 48.023 1.00 0.00 ATOM 357 CG ARG A 43 -0.587 8.823 47.549 1.00 0.00 ATOM 358 CD ARG A 43 -0.416 8.427 46.083 1.00 0.00 ATOM 359 NE ARG A 43 -1.637 7.791 45.599 1.00 0.00 ATOM 360 CZ ARG A 43 -1.829 7.337 44.354 1.00 0.00 ATOM 361 NH1 ARG A 43 -0.881 7.442 43.426 1.00 0.00 ATOM 362 NH2 ARG A 43 -2.997 6.781 44.040 1.00 0.00 ATOM 363 O ARG A 43 -2.079 10.776 50.283 1.00 0.00 ATOM 364 C ARG A 43 -0.907 11.130 50.219 1.00 0.00 ATOM 365 N MET A 44 -0.463 12.269 50.731 1.00 0.00 ATOM 366 CA MET A 44 -1.338 13.219 51.401 1.00 0.00 ATOM 367 CB MET A 44 -0.525 14.157 52.296 1.00 0.00 ATOM 368 CG MET A 44 -1.370 15.126 53.107 1.00 0.00 ATOM 369 SD MET A 44 -2.497 14.289 54.240 1.00 0.00 ATOM 370 CE MET A 44 -1.349 13.690 55.477 1.00 0.00 ATOM 371 O MET A 44 -3.300 14.360 50.608 1.00 0.00 ATOM 372 C MET A 44 -2.120 14.089 50.402 1.00 0.00 ATOM 373 N LEU A 45 -1.464 14.513 49.322 1.00 0.00 ATOM 374 CA LEU A 45 -2.082 15.375 48.322 1.00 0.00 ATOM 375 CB LEU A 45 -1.805 16.846 48.638 1.00 0.00 ATOM 376 CG LEU A 45 -2.349 17.869 47.637 1.00 0.00 ATOM 377 CD1 LEU A 45 -3.868 17.920 47.694 1.00 0.00 ATOM 378 CD2 LEU A 45 -1.815 19.261 47.947 1.00 0.00 ATOM 379 O LEU A 45 -0.355 14.756 46.809 1.00 0.00 ATOM 380 C LEU A 45 -1.527 15.079 46.949 1.00 0.00 ATOM 381 N VAL A 46 -2.358 15.276 45.941 1.00 0.00 ATOM 382 CA VAL A 46 -1.966 15.134 44.552 1.00 0.00 ATOM 383 CB VAL A 46 -2.729 13.982 43.871 1.00 0.00 ATOM 384 CG1 VAL A 46 -2.324 13.863 42.411 1.00 0.00 ATOM 385 CG2 VAL A 46 -2.426 12.661 44.563 1.00 0.00 ATOM 386 O VAL A 46 -3.450 16.860 43.808 1.00 0.00 ATOM 387 C VAL A 46 -2.291 16.431 43.810 1.00 0.00 ATOM 388 N GLY A 47 -1.260 17.073 43.203 1.00 0.00 ATOM 389 CA GLY A 47 -1.435 18.300 42.497 1.00 0.00 ATOM 390 O GLY A 47 -0.449 17.259 40.621 1.00 0.00 ATOM 391 C GLY A 47 -1.357 17.956 41.020 1.00 0.00 ATOM 392 N THR A 48 -2.438 18.331 40.332 1.00 0.00 ATOM 393 CA THR A 48 -2.406 18.046 38.900 1.00 0.00 ATOM 394 CB THR A 48 -3.721 17.325 38.551 1.00 0.00 ATOM 395 CG2 THR A 48 -3.793 16.916 37.057 1.00 0.00 ATOM 396 OG1 THR A 48 -3.789 16.130 39.352 1.00 0.00 ATOM 397 O THR A 48 -3.346 20.227 38.536 1.00 0.00 ATOM 398 C THR A 48 -2.641 19.307 38.097 1.00 0.00 ATOM 399 N ALA A 49 -1.818 19.254 37.139 1.00 0.00 ATOM 400 CA ALA A 49 -2.031 20.336 36.193 1.00 0.00 ATOM 401 CB ALA A 49 -1.233 20.148 34.912 1.00 0.00 ATOM 402 O ALA A 49 -4.189 19.596 35.435 1.00 0.00 ATOM 403 C ALA A 49 -3.520 20.519 35.902 1.00 0.00 ATOM 404 N ALA A 50 -4.009 21.717 36.111 1.00 0.00 ATOM 405 CA ALA A 50 -5.423 22.007 35.872 1.00 0.00 ATOM 406 CB ALA A 50 -5.726 23.437 36.294 1.00 0.00 ATOM 407 O ALA A 50 -6.972 21.466 34.110 1.00 0.00 ATOM 408 C ALA A 50 -5.839 21.831 34.414 1.00 0.00 ATOM 409 N MET A 51 -4.899 22.095 33.509 1.00 0.00 ATOM 410 CA MET A 51 -5.193 21.943 32.083 1.00 0.00 ATOM 411 CB MET A 51 -4.017 22.435 31.237 1.00 0.00 ATOM 412 CG MET A 51 -3.805 23.940 31.285 1.00 0.00 ATOM 413 SD MET A 51 -5.228 24.862 30.669 1.00 0.00 ATOM 414 CE MET A 51 -5.178 24.441 28.928 1.00 0.00 ATOM 415 O MET A 51 -6.336 20.144 30.962 1.00 0.00 ATOM 416 C MET A 51 -5.442 20.474 31.743 1.00 0.00 ATOM 417 N LEU A 52 -4.643 19.579 32.314 1.00 0.00 ATOM 418 CA LEU A 52 -4.806 18.160 32.066 1.00 0.00 ATOM 419 CB LEU A 52 -3.471 17.519 31.677 1.00 0.00 ATOM 420 CG LEU A 52 -2.803 18.063 30.413 1.00 0.00 ATOM 421 CD1 LEU A 52 -1.450 17.401 30.193 1.00 0.00 ATOM 422 CD2 LEU A 52 -3.666 17.796 29.190 1.00 0.00 ATOM 423 O LEU A 52 -4.794 17.916 34.439 1.00 0.00 ATOM 424 C LEU A 52 -5.312 17.585 33.377 1.00 0.00 ATOM 425 N ARG A 53 -6.338 16.751 33.293 1.00 0.00 ATOM 426 CA ARG A 53 -6.910 16.108 34.464 1.00 0.00 ATOM 427 CB ARG A 53 -8.427 16.303 34.481 1.00 0.00 ATOM 428 CG ARG A 53 -8.867 17.753 34.591 1.00 0.00 ATOM 429 CD ARG A 53 -10.381 17.878 34.523 1.00 0.00 ATOM 430 NE ARG A 53 -10.821 19.265 34.649 1.00 0.00 ATOM 431 CZ ARG A 53 -12.093 19.640 34.738 1.00 0.00 ATOM 432 NH1 ARG A 53 -12.399 20.926 34.850 1.00 0.00 ATOM 433 NH2 ARG A 53 -13.056 18.728 34.716 1.00 0.00 ATOM 434 O ARG A 53 -7.055 13.933 33.479 1.00 0.00 ATOM 435 C ARG A 53 -6.549 14.634 34.350 1.00 0.00 ATOM 436 N ALA A 54 -5.639 14.176 35.202 1.00 0.00 ATOM 437 CA ALA A 54 -5.226 12.782 35.169 1.00 0.00 ATOM 438 CB ALA A 54 -3.875 12.612 35.846 1.00 0.00 ATOM 439 O ALA A 54 -6.719 12.308 36.984 1.00 0.00 ATOM 440 C ALA A 54 -6.273 11.947 35.896 1.00 0.00 ATOM 441 N VAL A 55 -6.653 10.828 35.309 1.00 0.00 ATOM 442 CA VAL A 55 -7.643 9.944 35.905 1.00 0.00 ATOM 443 CB VAL A 55 -8.028 8.801 34.949 1.00 0.00 ATOM 444 CG1 VAL A 55 -8.907 7.783 35.662 1.00 0.00 ATOM 445 CG2 VAL A 55 -8.795 9.341 33.753 1.00 0.00 ATOM 446 O VAL A 55 -7.845 9.215 38.185 1.00 0.00 ATOM 447 C VAL A 55 -7.122 9.296 37.196 1.00 0.00 ATOM 448 N SER A 56 -5.776 8.791 37.184 1.00 0.00 ATOM 449 CA SER A 56 -5.188 8.248 38.407 1.00 0.00 ATOM 450 CB SER A 56 -3.741 7.820 38.161 1.00 0.00 ATOM 451 OG SER A 56 -3.677 6.731 37.257 1.00 0.00 ATOM 452 O SER A 56 -5.515 8.993 40.643 1.00 0.00 ATOM 453 C SER A 56 -5.205 9.306 39.509 1.00 0.00 ATOM 454 N THR A 57 -4.892 10.545 39.153 1.00 0.00 ATOM 455 CA THR A 57 -4.658 11.605 40.141 1.00 0.00 ATOM 456 CB THR A 57 -4.500 12.980 39.466 1.00 0.00 ATOM 457 CG2 THR A 57 -4.280 14.064 40.511 1.00 0.00 ATOM 458 OG1 THR A 57 -3.373 12.954 38.581 1.00 0.00 ATOM 459 O THR A 57 -5.480 11.613 42.370 1.00 0.00 ATOM 460 C THR A 57 -5.745 11.810 41.174 1.00 0.00 ATOM 461 N PRO A 58 -6.991 12.020 40.806 1.00 0.00 ATOM 462 CA PRO A 58 -8.047 12.267 41.797 1.00 0.00 ATOM 463 CB PRO A 58 -9.215 12.781 40.956 1.00 0.00 ATOM 464 CG PRO A 58 -8.932 12.312 39.556 1.00 0.00 ATOM 465 CD PRO A 58 -7.424 12.386 39.447 1.00 0.00 ATOM 466 O PRO A 58 -8.506 11.038 43.838 1.00 0.00 ATOM 467 C PRO A 58 -8.411 11.015 42.601 1.00 0.00 ATOM 468 N HIS A 59 -8.609 9.921 41.881 1.00 0.00 ATOM 469 CA HIS A 59 -9.095 8.694 42.484 1.00 0.00 ATOM 470 CB HIS A 59 -9.383 7.663 41.363 1.00 0.00 ATOM 471 CG HIS A 59 -10.619 7.967 40.578 1.00 0.00 ATOM 472 CD2 HIS A 59 -10.797 8.274 39.272 1.00 0.00 ATOM 473 ND1 HIS A 59 -11.873 7.997 41.151 1.00 0.00 ATOM 474 CE1 HIS A 59 -12.769 8.313 40.233 1.00 0.00 ATOM 475 NE2 HIS A 59 -12.141 8.487 39.083 1.00 0.00 ATOM 476 O HIS A 59 -8.478 7.511 44.465 1.00 0.00 ATOM 477 C HIS A 59 -8.083 8.126 43.466 1.00 0.00 ATOM 478 N ASP A 60 -6.800 8.365 43.206 1.00 0.00 ATOM 479 CA ASP A 60 -5.736 7.801 44.022 1.00 0.00 ATOM 480 CB ASP A 60 -4.654 7.211 43.117 1.00 0.00 ATOM 481 CG ASP A 60 -5.189 6.095 42.235 1.00 0.00 ATOM 482 OD1 ASP A 60 -5.651 5.073 42.788 1.00 0.00 ATOM 483 OD2 ASP A 60 -5.160 6.240 40.994 1.00 0.00 ATOM 484 O ASP A 60 -4.066 9.398 44.717 1.00 0.00 ATOM 485 C ASP A 60 -5.209 8.958 44.859 1.00 0.00 ATOM 486 N ALA A 61 -6.076 9.459 45.732 1.00 0.00 ATOM 487 CA ALA A 61 -5.730 10.592 46.576 1.00 0.00 ATOM 488 CB ALA A 61 -5.364 11.802 45.677 1.00 0.00 ATOM 489 O ALA A 61 -7.921 11.037 47.456 1.00 0.00 ATOM 490 C ALA A 61 -6.706 10.991 47.677 1.00 0.00 ATOM 491 N GLU A 62 -6.169 11.271 48.860 1.00 0.00 ATOM 492 CA GLU A 62 -6.979 11.685 50.001 1.00 0.00 ATOM 493 CB GLU A 62 -6.324 10.738 51.061 1.00 0.00 ATOM 494 CG GLU A 62 -6.102 9.300 50.643 1.00 0.00 ATOM 495 CD GLU A 62 -5.356 8.525 51.708 1.00 0.00 ATOM 496 OE1 GLU A 62 -5.940 8.267 52.783 1.00 0.00 ATOM 497 OE2 GLU A 62 -4.178 8.189 51.480 1.00 0.00 ATOM 498 O GLU A 62 -8.536 13.514 50.034 1.00 0.00 ATOM 499 C GLU A 62 -7.452 13.083 49.636 1.00 0.00 ATOM 500 N VAL A 63 -6.583 13.860 48.835 1.00 0.00 ATOM 501 CA VAL A 63 -6.870 15.210 48.387 1.00 0.00 ATOM 502 CB VAL A 63 -6.361 16.263 49.389 1.00 0.00 ATOM 503 CG1 VAL A 63 -6.642 17.666 48.877 1.00 0.00 ATOM 504 CG2 VAL A 63 -7.052 16.095 50.735 1.00 0.00 ATOM 505 O VAL A 63 -5.061 15.209 46.836 1.00 0.00 ATOM 506 C VAL A 63 -6.241 15.482 47.028 1.00 0.00 ATOM 507 N VAL A 64 -7.039 16.000 46.094 1.00 0.00 ATOM 508 CA VAL A 64 -6.609 16.246 44.720 1.00 0.00 ATOM 509 CB VAL A 64 -7.352 15.336 43.724 1.00 0.00 ATOM 510 CG1 VAL A 64 -8.854 15.557 43.820 1.00 0.00 ATOM 511 CG2 VAL A 64 -6.912 15.636 42.299 1.00 0.00 ATOM 512 O VAL A 64 -8.004 18.144 44.497 1.00 0.00 ATOM 513 C VAL A 64 -6.887 17.681 44.334 1.00 0.00 ATOM 514 N GLU A 65 -5.859 18.386 43.854 1.00 0.00 ATOM 515 CA GLU A 65 -5.948 19.828 43.575 1.00 0.00 ATOM 516 CB GLU A 65 -5.419 20.610 44.839 1.00 0.00 ATOM 517 CG GLU A 65 -5.995 20.227 46.203 1.00 0.00 ATOM 518 CD GLU A 65 -7.450 20.645 46.394 1.00 0.00 ATOM 519 OE1 GLU A 65 -7.951 21.519 45.651 1.00 0.00 ATOM 520 OE2 GLU A 65 -8.101 20.090 47.308 1.00 0.00 ATOM 521 O GLU A 65 -4.420 19.693 41.732 1.00 0.00 ATOM 522 C GLU A 65 -5.485 20.150 42.160 1.00 0.00 ATOM 523 N LEU A 66 -6.293 20.968 41.359 1.00 0.00 ATOM 524 CA LEU A 66 -5.893 21.367 40.011 1.00 0.00 ATOM 525 CB LEU A 66 -7.129 21.719 39.179 1.00 0.00 ATOM 526 CG LEU A 66 -8.002 20.544 38.731 1.00 0.00 ATOM 527 CD1 LEU A 66 -9.205 21.038 37.942 1.00 0.00 ATOM 528 CD2 LEU A 66 -7.210 19.594 37.845 1.00 0.00 ATOM 529 O LEU A 66 -5.622 23.756 40.118 1.00 0.00 ATOM 530 C LEU A 66 -5.077 22.656 40.003 1.00 0.00 ATOM 531 N PRO A 67 -3.785 22.528 39.819 1.00 0.00 ATOM 532 CA PRO A 67 -2.921 23.710 39.803 1.00 0.00 ATOM 533 CB PRO A 67 -1.605 23.215 40.406 1.00 0.00 ATOM 534 CG PRO A 67 -1.513 21.788 39.983 1.00 0.00 ATOM 535 CD PRO A 67 -2.918 21.255 40.003 1.00 0.00 ATOM 536 O PRO A 67 -2.474 23.674 37.480 1.00 0.00 ATOM 537 C PRO A 67 -2.608 24.364 38.478 1.00 0.00 ATOM 538 N GLU A 68 -2.440 25.679 38.473 1.00 0.00 ATOM 539 CA GLU A 68 -1.990 26.368 37.272 1.00 0.00 ATOM 540 CB GLU A 68 -1.908 27.875 37.519 1.00 0.00 ATOM 541 CG GLU A 68 -1.503 28.683 36.296 1.00 0.00 ATOM 542 CD GLU A 68 -1.483 30.174 36.564 1.00 0.00 ATOM 543 OE1 GLU A 68 -1.785 30.578 37.707 1.00 0.00 ATOM 544 OE2 GLU A 68 -1.165 30.942 35.630 1.00 0.00 ATOM 545 O GLU A 68 0.162 25.416 37.743 1.00 0.00 ATOM 546 C GLU A 68 -0.647 25.756 36.875 1.00 0.00 ATOM 547 N SER A 69 -0.375 25.592 35.610 1.00 0.00 ATOM 548 CA SER A 69 0.897 24.957 35.173 1.00 0.00 ATOM 549 CB SER A 69 0.939 24.849 33.647 1.00 0.00 ATOM 550 OG SER A 69 1.016 26.130 33.047 1.00 0.00 ATOM 551 O SER A 69 3.157 25.051 35.858 1.00 0.00 ATOM 552 C SER A 69 2.145 25.674 35.622 1.00 0.00 ATOM 553 N PHE A 70 2.117 26.993 35.725 1.00 0.00 ATOM 554 CA PHE A 70 3.278 27.787 36.133 1.00 0.00 ATOM 555 CB PHE A 70 2.975 29.285 35.993 1.00 0.00 ATOM 556 CG PHE A 70 3.149 29.821 34.592 1.00 0.00 ATOM 557 CD1 PHE A 70 2.911 29.017 33.480 1.00 0.00 ATOM 558 CD2 PHE A 70 3.534 31.142 34.385 1.00 0.00 ATOM 559 CE1 PHE A 70 3.055 29.524 32.187 1.00 0.00 ATOM 560 CE2 PHE A 70 3.679 31.657 33.097 1.00 0.00 ATOM 561 CZ PHE A 70 3.438 30.848 31.996 1.00 0.00 ATOM 562 O PHE A 70 4.899 27.422 37.863 1.00 0.00 ATOM 563 C PHE A 70 3.706 27.464 37.564 1.00 0.00 ATOM 564 N ASP A 71 2.738 27.240 38.451 1.00 0.00 ATOM 565 CA ASP A 71 3.061 26.904 39.838 1.00 0.00 ATOM 566 CB ASP A 71 1.793 26.801 40.696 1.00 0.00 ATOM 567 CG ASP A 71 1.137 28.147 40.946 1.00 0.00 ATOM 568 OD1 ASP A 71 1.826 29.182 40.822 1.00 0.00 ATOM 569 OD2 ASP A 71 -0.065 28.165 41.283 1.00 0.00 ATOM 570 O ASP A 71 4.851 25.496 40.582 1.00 0.00 ATOM 571 C ASP A 71 3.841 25.589 39.884 1.00 0.00 ATOM 572 N PHE A 72 3.351 24.601 39.150 1.00 0.00 ATOM 573 CA PHE A 72 4.001 23.305 39.071 1.00 0.00 ATOM 574 CB PHE A 72 3.254 22.333 38.159 1.00 0.00 ATOM 575 CG PHE A 72 3.991 21.045 37.945 1.00 0.00 ATOM 576 CD1 PHE A 72 4.065 20.093 38.956 1.00 0.00 ATOM 577 CD2 PHE A 72 4.677 20.810 36.754 1.00 0.00 ATOM 578 CE1 PHE A 72 4.816 18.933 38.794 1.00 0.00 ATOM 579 CE2 PHE A 72 5.433 19.647 36.583 1.00 0.00 ATOM 580 CZ PHE A 72 5.500 18.711 37.604 1.00 0.00 ATOM 581 O PHE A 72 6.371 22.945 39.149 1.00 0.00 ATOM 582 C PHE A 72 5.429 23.462 38.555 1.00 0.00 ATOM 583 N LYS A 73 5.621 24.022 37.151 1.00 0.00 ATOM 584 CA LYS A 73 7.028 24.177 36.748 1.00 0.00 ATOM 585 CB LYS A 73 7.148 25.165 35.585 1.00 0.00 ATOM 586 CG LYS A 73 6.595 24.643 34.269 1.00 0.00 ATOM 587 CD LYS A 73 6.750 25.671 33.159 1.00 0.00 ATOM 588 CE LYS A 73 6.167 25.162 31.851 1.00 0.00 ATOM 589 NZ LYS A 73 6.290 26.167 30.761 1.00 0.00 ATOM 590 O LYS A 73 8.948 24.216 38.144 1.00 0.00 ATOM 591 C LYS A 73 7.834 24.698 37.922 1.00 0.00 ATOM 592 N ARG A 74 7.327 25.668 38.686 1.00 0.00 ATOM 593 CA ARG A 74 8.001 26.218 39.860 1.00 0.00 ATOM 594 CB ARG A 74 7.122 27.273 40.536 1.00 0.00 ATOM 595 CG ARG A 74 6.921 28.534 39.712 1.00 0.00 ATOM 596 CD ARG A 74 6.020 29.526 40.429 1.00 0.00 ATOM 597 NE ARG A 74 5.793 30.733 39.638 1.00 0.00 ATOM 598 CZ ARG A 74 4.994 31.728 40.006 1.00 0.00 ATOM 599 NH1 ARG A 74 4.848 32.787 39.222 1.00 0.00 ATOM 600 NH2 ARG A 74 4.340 31.663 41.158 1.00 0.00 ATOM 601 O ARG A 74 9.387 25.021 41.462 1.00 0.00 ATOM 602 C ARG A 74 8.292 25.098 40.874 1.00 0.00 ATOM 603 N ILE A 75 8.597 22.848 40.476 1.00 0.00 ATOM 604 CA ILE A 75 9.796 22.041 40.410 1.00 0.00 ATOM 605 CB ILE A 75 9.820 20.909 41.485 1.00 0.00 ATOM 606 CG1 ILE A 75 9.475 21.474 42.869 1.00 0.00 ATOM 607 CG2 ILE A 75 11.181 20.195 41.501 1.00 0.00 ATOM 608 CD1 ILE A 75 9.379 20.430 43.957 1.00 0.00 ATOM 609 O ILE A 75 9.160 20.650 38.557 1.00 0.00 ATOM 610 C ILE A 75 10.050 21.309 39.098 1.00 0.00 ATOM 611 N SER A 76 11.252 21.490 38.555 1.00 0.00 ATOM 612 CA SER A 76 11.612 20.862 37.293 1.00 0.00 ATOM 613 CB SER A 76 12.961 21.391 36.800 1.00 0.00 ATOM 614 OG SER A 76 13.415 20.659 35.675 1.00 0.00 ATOM 615 O SER A 76 12.232 18.961 38.608 1.00 0.00 ATOM 616 C SER A 76 11.755 19.369 37.552 1.00 0.00 ATOM 617 N THR A 77 11.321 18.539 36.583 1.00 0.00 ATOM 618 CA THR A 77 11.423 17.097 36.729 1.00 0.00 ATOM 619 CB THR A 77 10.327 16.371 35.928 1.00 0.00 ATOM 620 CG2 THR A 77 8.947 16.812 36.393 1.00 0.00 ATOM 621 OG1 THR A 77 10.466 16.677 34.534 1.00 0.00 ATOM 622 O THR A 77 13.119 15.408 36.254 1.00 0.00 ATOM 623 C THR A 77 12.762 16.587 36.222 1.00 0.00 ATOM 624 N GLN A 78 13.525 17.488 35.613 1.00 0.00 ATOM 625 CA GLN A 78 14.814 17.224 35.009 1.00 0.00 ATOM 626 CB GLN A 78 15.633 18.422 34.645 1.00 0.00 ATOM 627 CG GLN A 78 15.050 19.245 33.558 1.00 0.00 ATOM 628 CD GLN A 78 15.793 20.605 33.421 1.00 0.00 ATOM 629 OE1 GLN A 78 15.661 21.482 34.306 1.00 0.00 ATOM 630 NE2 GLN A 78 16.621 20.770 32.358 1.00 0.00 ATOM 631 O GLN A 78 16.360 15.504 35.656 1.00 0.00 ATOM 632 C GLN A 78 15.760 16.524 35.984 1.00 0.00 ATOM 633 N THR A 79 15.865 16.996 37.334 1.00 0.00 ATOM 634 CA THR A 79 16.702 16.369 38.358 1.00 0.00 ATOM 635 CB THR A 79 16.505 17.148 39.672 1.00 0.00 ATOM 636 CG2 THR A 79 16.892 18.607 39.491 1.00 0.00 ATOM 637 OG1 THR A 79 15.130 17.078 40.070 1.00 0.00 ATOM 638 O THR A 79 17.261 14.041 38.831 1.00 0.00 ATOM 639 C THR A 79 16.361 14.904 38.631 1.00 0.00 ATOM 640 N THR A 80 15.057 14.666 38.662 1.00 0.00 ATOM 641 CA THR A 80 14.519 13.331 38.906 1.00 0.00 ATOM 642 CB THR A 80 13.159 13.394 39.603 1.00 0.00 ATOM 643 CG2 THR A 80 13.242 14.255 40.860 1.00 0.00 ATOM 644 OG1 THR A 80 12.193 13.958 38.710 1.00 0.00 ATOM 645 O THR A 80 14.318 13.368 36.522 1.00 0.00 ATOM 646 C THR A 80 14.274 12.691 37.549 1.00 0.00 ATOM 647 N PRO A 81 14.013 11.375 37.522 1.00 0.00 ATOM 648 CA PRO A 81 13.760 10.683 36.255 1.00 0.00 ATOM 649 CB PRO A 81 13.805 9.200 36.628 1.00 0.00 ATOM 650 CG PRO A 81 13.457 9.170 38.080 1.00 0.00 ATOM 651 CD PRO A 81 14.047 10.418 38.674 1.00 0.00 ATOM 652 O PRO A 81 12.190 10.831 34.443 1.00 0.00 ATOM 653 C PRO A 81 12.405 11.042 35.635 1.00 0.00 ATOM 654 N GLN A 82 11.509 11.588 36.472 1.00 0.00 ATOM 655 CA GLN A 82 10.178 11.938 35.968 1.00 0.00 ATOM 656 CB GLN A 82 9.201 10.880 35.684 1.00 0.00 ATOM 657 CG GLN A 82 7.943 11.245 34.894 1.00 0.00 ATOM 658 CD GLN A 82 8.194 11.942 33.587 1.00 0.00 ATOM 659 OE1 GLN A 82 8.738 13.042 33.557 1.00 0.00 ATOM 660 NE2 GLN A 82 7.783 11.310 32.504 1.00 0.00 ATOM 661 O GLN A 82 8.431 13.227 36.967 1.00 0.00 ATOM 662 C GLN A 82 9.632 13.191 36.661 1.00 0.00 ATOM 663 N PRO A 83 3.582 17.226 35.438 1.00 0.00 ATOM 664 CA PRO A 83 2.155 17.260 35.205 1.00 0.00 ATOM 665 CB PRO A 83 1.936 16.228 34.098 1.00 0.00 ATOM 666 CG PRO A 83 3.237 16.181 33.368 1.00 0.00 ATOM 667 CD PRO A 83 4.307 16.345 34.412 1.00 0.00 ATOM 668 O PRO A 83 0.285 17.282 36.703 1.00 0.00 ATOM 669 C PRO A 83 1.418 16.888 36.495 1.00 0.00 ATOM 670 N LEU A 84 2.077 16.129 37.359 1.00 0.00 ATOM 671 CA LEU A 84 1.539 15.786 38.674 1.00 0.00 ATOM 672 CB LEU A 84 0.957 14.383 38.666 1.00 0.00 ATOM 673 CG LEU A 84 -0.188 14.240 37.665 1.00 0.00 ATOM 674 CD1 LEU A 84 -0.645 12.797 37.609 1.00 0.00 ATOM 675 CD2 LEU A 84 -1.332 15.178 38.033 1.00 0.00 ATOM 676 O LEU A 84 3.746 15.305 39.441 1.00 0.00 ATOM 677 C LEU A 84 2.647 15.759 39.722 1.00 0.00 ATOM 678 N MET A 85 2.319 16.208 40.935 1.00 0.00 ATOM 679 CA MET A 85 3.219 16.229 42.072 1.00 0.00 ATOM 680 CB MET A 85 3.760 17.642 42.301 1.00 0.00 ATOM 681 CG MET A 85 4.697 17.763 43.491 1.00 0.00 ATOM 682 SD MET A 85 5.404 19.414 43.655 1.00 0.00 ATOM 683 CE MET A 85 3.989 20.331 44.257 1.00 0.00 ATOM 684 O MET A 85 1.361 16.270 43.595 1.00 0.00 ATOM 685 C MET A 85 2.460 15.773 43.317 1.00 0.00 ATOM 686 N ALA A 86 3.052 14.859 44.085 1.00 0.00 ATOM 687 CA ALA A 86 2.440 14.367 45.306 1.00 0.00 ATOM 688 CB ALA A 86 2.471 12.848 45.341 1.00 0.00 ATOM 689 O ALA A 86 4.383 15.016 46.566 1.00 0.00 ATOM 690 C ALA A 86 3.158 14.871 46.544 1.00 0.00 ATOM 691 N VAL A 87 2.379 15.170 47.577 1.00 0.00 ATOM 692 CA VAL A 87 2.889 15.468 48.901 1.00 0.00 ATOM 693 CB VAL A 87 2.039 16.543 49.605 1.00 0.00 ATOM 694 CG1 VAL A 87 2.574 16.815 51.002 1.00 0.00 ATOM 695 CG2 VAL A 87 2.069 17.844 48.817 1.00 0.00 ATOM 696 O VAL A 87 1.721 13.654 49.883 1.00 0.00 ATOM 697 C VAL A 87 2.806 14.133 49.621 1.00 0.00 ATOM 698 N PHE A 88 3.958 13.522 49.905 1.00 0.00 ATOM 699 CA PHE A 88 4.039 12.173 50.480 1.00 0.00 ATOM 700 CB PHE A 88 5.093 11.314 49.819 1.00 0.00 ATOM 701 CG PHE A 88 4.764 10.905 48.416 1.00 0.00 ATOM 702 CD1 PHE A 88 3.980 9.788 48.177 1.00 0.00 ATOM 703 CD2 PHE A 88 5.314 11.581 47.355 1.00 0.00 ATOM 704 CE1 PHE A 88 3.761 9.354 46.894 1.00 0.00 ATOM 705 CE2 PHE A 88 5.106 11.154 46.059 1.00 0.00 ATOM 706 CZ PHE A 88 4.319 10.021 45.829 1.00 0.00 ATOM 707 O PHE A 88 5.499 12.948 52.214 1.00 0.00 ATOM 708 C PHE A 88 4.557 12.221 51.922 1.00 0.00 ATOM 709 N ASP A 89 3.985 11.398 52.799 1.00 0.00 ATOM 710 CA ASP A 89 4.390 11.343 54.203 1.00 0.00 ATOM 711 CB ASP A 89 3.389 10.524 55.021 1.00 0.00 ATOM 712 CG ASP A 89 2.083 11.260 55.249 1.00 0.00 ATOM 713 OD1 ASP A 89 2.023 12.470 54.946 1.00 0.00 ATOM 714 OD2 ASP A 89 1.120 10.626 55.732 1.00 0.00 ATOM 715 O ASP A 89 6.048 9.696 53.680 1.00 0.00 ATOM 716 C ASP A 89 5.762 10.694 54.339 1.00 0.00 ATOM 717 N LEU A 90 6.588 11.308 55.197 1.00 0.00 ATOM 718 CA LEU A 90 7.922 10.804 55.496 1.00 0.00 ATOM 719 CB LEU A 90 8.701 11.666 56.386 1.00 0.00 ATOM 720 CG LEU A 90 9.060 13.006 55.727 1.00 0.00 ATOM 721 CD1 LEU A 90 9.796 13.879 56.725 1.00 0.00 ATOM 722 CD2 LEU A 90 9.912 12.761 54.489 1.00 0.00 ATOM 723 O LEU A 90 8.538 8.507 55.855 1.00 0.00 ATOM 724 C LEU A 90 7.779 9.427 56.142 1.00 0.00 ATOM 725 N PRO A 91 6.791 9.296 57.019 1.00 0.00 ATOM 726 CA PRO A 91 6.548 8.037 57.702 1.00 0.00 ATOM 727 CB PRO A 91 5.368 8.339 58.628 1.00 0.00 ATOM 728 CG PRO A 91 5.501 9.792 58.939 1.00 0.00 ATOM 729 CD PRO A 91 5.938 10.453 57.661 1.00 0.00 ATOM 730 O PRO A 91 6.736 5.825 56.782 1.00 0.00 ATOM 731 C PRO A 91 6.208 6.931 56.703 1.00 0.00 ATOM 732 N ALA A 92 5.320 7.235 55.764 1.00 0.00 ATOM 733 CA ALA A 92 4.928 6.266 54.744 1.00 0.00 ATOM 734 CB ALA A 92 3.820 6.868 53.881 1.00 0.00 ATOM 735 O ALA A 92 6.326 4.683 53.585 1.00 0.00 ATOM 736 C ALA A 92 6.157 5.852 53.939 1.00 0.00 ATOM 737 N GLU A 93 7.006 6.823 53.637 1.00 0.00 ATOM 738 CA GLU A 93 8.224 6.553 52.887 1.00 0.00 ATOM 739 CB GLU A 93 9.251 7.852 53.123 1.00 0.00 ATOM 740 CG GLU A 93 10.391 8.116 52.164 1.00 0.00 ATOM 741 CD GLU A 93 11.615 8.820 52.702 1.00 0.00 ATOM 742 OE1 GLU A 93 11.703 9.091 53.914 1.00 0.00 ATOM 743 OE2 GLU A 93 12.540 9.107 51.899 1.00 0.00 ATOM 744 O GLU A 93 9.718 4.706 53.193 1.00 0.00 ATOM 745 C GLU A 93 9.151 5.667 53.709 1.00 0.00 ATOM 746 N PRO A 94 9.333 5.996 54.987 1.00 0.00 ATOM 747 CA PRO A 94 10.205 5.200 55.839 1.00 0.00 ATOM 748 CB PRO A 94 10.235 6.015 57.141 1.00 0.00 ATOM 749 CG PRO A 94 10.069 7.395 56.694 1.00 0.00 ATOM 750 CD PRO A 94 9.203 7.371 55.482 1.00 0.00 ATOM 751 O PRO A 94 10.542 2.833 56.083 1.00 0.00 ATOM 752 C PRO A 94 9.732 3.748 55.938 1.00 0.00 ATOM 753 N GLU A 95 8.424 3.531 55.835 1.00 0.00 ATOM 754 CA GLU A 95 7.891 2.174 55.912 1.00 0.00 ATOM 755 CB GLU A 95 6.366 2.205 56.038 1.00 0.00 ATOM 756 CG GLU A 95 5.862 2.763 57.359 1.00 0.00 ATOM 757 CD GLU A 95 4.351 2.878 57.404 1.00 0.00 ATOM 758 OE1 GLU A 95 3.700 2.544 56.392 1.00 0.00 ATOM 759 OE2 GLU A 95 3.820 3.303 58.451 1.00 0.00 ATOM 760 O GLU A 95 8.106 0.103 54.717 1.00 0.00 ATOM 761 C GLU A 95 8.240 1.325 54.690 1.00 0.00 ATOM 762 N PRO A 96 9.171 1.948 53.314 1.00 0.00 ATOM 763 CA PRO A 96 9.571 1.265 52.083 1.00 0.00 ATOM 764 CB PRO A 96 8.339 1.546 51.170 1.00 0.00 ATOM 765 CG PRO A 96 7.787 2.821 51.724 1.00 0.00 ATOM 766 CD PRO A 96 7.901 2.605 53.207 1.00 0.00 ATOM 767 O PRO A 96 11.608 0.666 50.965 1.00 0.00 ATOM 768 C PRO A 96 11.084 1.309 51.869 1.00 0.00 ATOM 769 N VAL A 97 11.787 2.078 52.697 1.00 0.00 ATOM 770 CA VAL A 97 13.235 2.189 52.573 1.00 0.00 ATOM 771 CB VAL A 97 13.826 3.117 53.652 1.00 0.00 ATOM 772 CG1 VAL A 97 15.345 3.087 53.606 1.00 0.00 ATOM 773 CG2 VAL A 97 13.365 4.549 53.433 1.00 0.00 ATOM 774 O VAL A 97 13.595 0.014 53.551 1.00 0.00 ATOM 775 C VAL A 97 13.949 0.842 52.711 1.00 0.00 ATOM 776 N VAL A 98 14.957 0.635 51.868 1.00 0.00 ATOM 777 CA VAL A 98 15.763 -0.581 51.871 1.00 0.00 ATOM 778 CB VAL A 98 16.110 -1.032 50.440 1.00 0.00 ATOM 779 CG1 VAL A 98 16.919 -2.320 50.468 1.00 0.00 ATOM 780 CG2 VAL A 98 14.842 -1.279 49.638 1.00 0.00 ATOM 781 O VAL A 98 18.038 0.164 52.049 1.00 0.00 ATOM 782 C VAL A 98 17.046 -0.264 52.640 1.00 0.00 ATOM 783 N GLU A 99 17.032 -0.481 53.951 1.00 0.00 ATOM 784 CA GLU A 99 18.190 -0.161 54.782 1.00 0.00 ATOM 785 CB GLU A 99 17.898 -0.476 56.250 1.00 0.00 ATOM 786 CG GLU A 99 17.768 -1.960 56.553 1.00 0.00 ATOM 787 CD GLU A 99 16.381 -2.495 56.262 1.00 0.00 ATOM 788 OE1 GLU A 99 15.568 -1.750 55.675 1.00 0.00 ATOM 789 OE2 GLU A 99 16.105 -3.659 56.619 1.00 0.00 ATOM 790 O GLU A 99 20.538 -0.700 54.573 1.00 0.00 ATOM 791 C GLU A 99 19.386 -1.016 54.300 1.00 0.00 ATOM 792 N GLY A 100 19.079 -2.040 53.563 1.00 0.00 ATOM 793 CA GLY A 100 20.096 -2.957 53.077 1.00 0.00 ATOM 794 O GLY A 100 21.808 -3.229 51.394 1.00 0.00 ATOM 795 C GLY A 100 20.775 -2.641 51.732 1.00 0.00 ATOM 796 N LEU A 101 20.182 -1.737 50.962 1.00 0.00 ATOM 797 CA LEU A 101 20.715 -1.369 49.650 1.00 0.00 ATOM 798 CB LEU A 101 19.575 -1.164 48.652 1.00 0.00 ATOM 799 CG LEU A 101 19.977 -0.731 47.240 1.00 0.00 ATOM 800 CD1 LEU A 101 20.787 -1.821 46.555 1.00 0.00 ATOM 801 CD2 LEU A 101 18.747 -0.449 46.392 1.00 0.00 ATOM 802 O LEU A 101 20.897 0.916 50.356 1.00 0.00 ATOM 803 C LEU A 101 21.478 -0.072 49.915 1.00 0.00 ATOM 804 N THR A 102 22.796 -0.096 49.693 1.00 0.00 ATOM 805 CA THR A 102 23.635 1.077 49.931 1.00 0.00 ATOM 806 CB THR A 102 24.761 0.766 50.935 1.00 0.00 ATOM 807 CG2 THR A 102 25.582 2.016 51.217 1.00 0.00 ATOM 808 OG1 THR A 102 24.195 0.296 52.163 1.00 0.00 ATOM 809 O THR A 102 24.552 0.694 47.761 1.00 0.00 ATOM 810 C THR A 102 24.260 1.519 48.619 1.00 0.00 ATOM 811 N LEU A 103 24.440 2.824 48.456 1.00 0.00 ATOM 812 CA LEU A 103 25.075 3.343 47.249 1.00 0.00 ATOM 813 CB LEU A 103 24.105 4.240 46.476 1.00 0.00 ATOM 814 CG LEU A 103 24.647 4.878 45.195 1.00 0.00 ATOM 815 CD1 LEU A 103 24.891 3.821 44.130 1.00 0.00 ATOM 816 CD2 LEU A 103 23.659 5.893 44.642 1.00 0.00 ATOM 817 O LEU A 103 26.267 4.924 48.617 1.00 0.00 ATOM 818 C LEU A 103 26.304 4.157 47.652 1.00 0.00 ATOM 819 N LEU A 104 27.390 3.975 46.912 1.00 0.00 ATOM 820 CA LEU A 104 28.630 4.697 47.167 1.00 0.00 ATOM 821 CB LEU A 104 29.735 3.730 47.595 1.00 0.00 ATOM 822 CG LEU A 104 31.116 4.344 47.837 1.00 0.00 ATOM 823 CD1 LEU A 104 31.074 5.317 49.006 1.00 0.00 ATOM 824 CD2 LEU A 104 32.136 3.261 48.158 1.00 0.00 ATOM 825 O LEU A 104 29.222 4.727 44.848 1.00 0.00 ATOM 826 C LEU A 104 29.010 5.393 45.862 1.00 0.00 ATOM 827 N LEU A 105 29.076 6.723 45.893 1.00 0.00 ATOM 828 CA LEU A 105 29.432 7.516 44.722 1.00 0.00 ATOM 829 CB LEU A 105 28.651 8.832 44.709 1.00 0.00 ATOM 830 CG LEU A 105 27.127 8.715 44.666 1.00 0.00 ATOM 831 CD1 LEU A 105 26.480 10.091 44.705 1.00 0.00 ATOM 832 CD2 LEU A 105 26.677 8.014 43.394 1.00 0.00 ATOM 833 O LEU A 105 31.394 8.562 45.645 1.00 0.00 ATOM 834 C LEU A 105 30.926 7.805 44.790 1.00 0.00 ATOM 835 N ASP A 106 31.670 7.203 43.875 1.00 0.00 ATOM 836 CA ASP A 106 33.111 7.359 43.856 1.00 0.00 ATOM 837 CB ASP A 106 33.783 6.057 43.416 1.00 0.00 ATOM 838 CG ASP A 106 35.296 6.155 43.411 1.00 0.00 ATOM 839 OD1 ASP A 106 35.821 7.263 43.650 1.00 0.00 ATOM 840 OD2 ASP A 106 35.957 5.122 43.170 1.00 0.00 ATOM 841 O ASP A 106 33.675 8.230 41.704 1.00 0.00 ATOM 842 C ASP A 106 33.576 8.444 42.909 1.00 0.00 ATOM 843 N GLY A 107 33.845 9.615 43.478 1.00 0.00 ATOM 844 CA GLY A 107 34.335 10.761 42.730 1.00 0.00 ATOM 845 O GLY A 107 33.940 11.292 40.418 1.00 0.00 ATOM 846 C GLY A 107 33.459 11.177 41.552 1.00 0.00 ATOM 847 N VAL A 108 32.175 11.413 41.814 1.00 0.00 ATOM 848 CA VAL A 108 31.271 11.856 40.754 1.00 0.00 ATOM 849 CB VAL A 108 29.798 11.757 41.190 1.00 0.00 ATOM 850 CG1 VAL A 108 28.882 12.296 40.101 1.00 0.00 ATOM 851 CG2 VAL A 108 29.419 10.309 41.462 1.00 0.00 ATOM 852 O VAL A 108 32.062 14.062 41.315 1.00 0.00 ATOM 853 C VAL A 108 31.790 13.256 40.418 1.00 0.00 ATOM 854 N GLN A 109 31.823 13.519 39.022 1.00 0.00 ATOM 855 CA GLN A 109 32.376 14.813 38.639 1.00 0.00 ATOM 856 CB GLN A 109 32.407 14.881 37.110 1.00 0.00 ATOM 857 CG GLN A 109 33.435 13.962 36.470 1.00 0.00 ATOM 858 CD GLN A 109 33.491 14.114 34.961 1.00 0.00 ATOM 859 OE1 GLN A 109 32.766 14.921 34.382 1.00 0.00 ATOM 860 NE2 GLN A 109 34.355 13.333 34.322 1.00 0.00 ATOM 861 O GLN A 109 31.846 16.701 40.020 1.00 0.00 ATOM 862 C GLN A 109 31.529 16.018 39.044 1.00 0.00 ATOM 863 N ASP A 110 30.449 16.278 38.314 1.00 0.00 ATOM 864 CA ASP A 110 29.629 17.450 38.604 1.00 0.00 ATOM 865 CB ASP A 110 29.055 18.036 37.312 1.00 0.00 ATOM 866 CG ASP A 110 30.103 18.747 36.479 1.00 0.00 ATOM 867 OD1 ASP A 110 31.220 18.970 36.992 1.00 0.00 ATOM 868 OD2 ASP A 110 29.808 19.080 35.312 1.00 0.00 ATOM 869 O ASP A 110 27.883 16.135 39.620 1.00 0.00 ATOM 870 C ASP A 110 28.425 17.240 39.510 1.00 0.00 ATOM 871 N PRO A 111 28.012 18.328 40.153 1.00 0.00 ATOM 872 CA PRO A 111 26.896 18.291 41.081 1.00 0.00 ATOM 873 CB PRO A 111 26.866 19.699 41.681 1.00 0.00 ATOM 874 CG PRO A 111 27.559 20.550 40.670 1.00 0.00 ATOM 875 CD PRO A 111 28.616 19.681 40.047 1.00 0.00 ATOM 876 O PRO A 111 24.675 17.398 41.122 1.00 0.00 ATOM 877 C PRO A 111 25.551 17.945 40.458 1.00 0.00 ATOM 878 N GLY A 112 25.359 18.292 39.190 1.00 0.00 ATOM 879 CA GLY A 112 24.112 17.999 38.506 1.00 0.00 ATOM 880 O GLY A 112 22.861 15.976 38.857 1.00 0.00 ATOM 881 C GLY A 112 23.927 16.482 38.503 1.00 0.00 ATOM 882 N ASN A 113 24.963 15.750 38.061 1.00 0.00 ATOM 883 CA ASN A 113 24.907 14.303 38.049 1.00 0.00 ATOM 884 CB ASN A 113 26.175 13.709 37.433 1.00 0.00 ATOM 885 CG ASN A 113 26.253 13.928 35.935 1.00 0.00 ATOM 886 ND2 ASN A 113 27.462 13.849 35.389 1.00 0.00 ATOM 887 OD1 ASN A 113 25.239 14.169 35.280 1.00 0.00 ATOM 888 O ASN A 113 23.976 12.843 39.699 1.00 0.00 ATOM 889 C ASN A 113 24.746 13.767 39.465 1.00 0.00 ATOM 890 N VAL A 114 25.475 14.342 40.415 1.00 0.00 ATOM 891 CA VAL A 114 25.367 13.872 41.790 1.00 0.00 ATOM 892 CB VAL A 114 26.317 14.640 42.727 1.00 0.00 ATOM 893 CG1 VAL A 114 26.047 14.276 44.178 1.00 0.00 ATOM 894 CG2 VAL A 114 27.766 14.302 42.408 1.00 0.00 ATOM 895 O VAL A 114 23.388 13.149 42.959 1.00 0.00 ATOM 896 C VAL A 114 23.942 14.055 42.332 1.00 0.00 ATOM 897 N GLY A 115 23.348 15.221 42.088 1.00 0.00 ATOM 898 CA GLY A 115 21.992 15.485 42.567 1.00 0.00 ATOM 899 O GLY A 115 20.027 14.095 42.574 1.00 0.00 ATOM 900 C GLY A 115 20.985 14.536 41.930 1.00 0.00 ATOM 901 N THR A 116 21.199 14.221 40.656 1.00 0.00 ATOM 902 CA THR A 116 20.310 13.315 39.947 1.00 0.00 ATOM 903 CB THR A 116 20.684 13.207 38.457 1.00 0.00 ATOM 904 CG2 THR A 116 19.769 12.220 37.748 1.00 0.00 ATOM 905 OG1 THR A 116 20.553 14.491 37.835 1.00 0.00 ATOM 906 O THR A 116 19.411 11.227 40.715 1.00 0.00 ATOM 907 C THR A 116 20.410 11.929 40.580 1.00 0.00 ATOM 908 N ILE A 117 21.620 11.541 40.971 1.00 0.00 ATOM 909 CA ILE A 117 21.838 10.247 41.603 1.00 0.00 ATOM 910 CB ILE A 117 23.336 9.981 41.841 1.00 0.00 ATOM 911 CG1 ILE A 117 24.066 9.813 40.507 1.00 0.00 ATOM 912 CG2 ILE A 117 23.528 8.713 42.659 1.00 0.00 ATOM 913 CD1 ILE A 117 25.574 9.809 40.632 1.00 0.00 ATOM 914 O ILE A 117 20.559 9.170 43.325 1.00 0.00 ATOM 915 C ILE A 117 21.123 10.198 42.954 1.00 0.00 ATOM 916 N LEU A 118 21.140 11.308 43.683 1.00 0.00 ATOM 917 CA LEU A 118 20.464 11.354 44.975 1.00 0.00 ATOM 918 CB LEU A 118 20.681 12.711 45.646 1.00 0.00 ATOM 919 CG LEU A 118 22.101 13.005 46.136 1.00 0.00 ATOM 920 CD1 LEU A 118 22.216 14.446 46.613 1.00 0.00 ATOM 921 CD2 LEU A 118 22.471 12.091 47.294 1.00 0.00 ATOM 922 O LEU A 118 18.345 10.322 45.436 1.00 0.00 ATOM 923 C LEU A 118 18.974 11.122 44.737 1.00 0.00 ATOM 924 N ARG A 119 18.418 11.811 43.744 1.00 0.00 ATOM 925 CA ARG A 119 17.001 11.668 43.412 1.00 0.00 ATOM 926 CB ARG A 119 16.637 12.548 42.216 1.00 0.00 ATOM 927 CG ARG A 119 15.179 12.461 41.799 1.00 0.00 ATOM 928 CD ARG A 119 14.258 12.959 42.902 1.00 0.00 ATOM 929 NE ARG A 119 12.855 12.934 42.497 1.00 0.00 ATOM 930 CZ ARG A 119 11.835 13.129 43.326 1.00 0.00 ATOM 931 NH1 ARG A 119 10.591 13.087 42.867 1.00 0.00 ATOM 932 NH2 ARG A 119 12.060 13.366 44.611 1.00 0.00 ATOM 933 O ARG A 119 15.619 9.694 43.469 1.00 0.00 ATOM 934 C ARG A 119 16.661 10.220 43.062 1.00 0.00 ATOM 935 N THR A 120 17.538 9.580 42.295 1.00 0.00 ATOM 936 CA THR A 120 17.335 8.195 41.890 1.00 0.00 ATOM 937 CB THR A 120 18.406 7.740 40.880 1.00 0.00 ATOM 938 CG2 THR A 120 18.196 6.281 40.503 1.00 0.00 ATOM 939 OG1 THR A 120 18.322 8.542 39.696 1.00 0.00 ATOM 940 O THR A 120 16.653 6.266 43.149 1.00 0.00 ATOM 941 C THR A 120 17.401 7.242 43.084 1.00 0.00 ATOM 942 N ALA A 121 18.300 7.518 44.025 1.00 0.00 ATOM 943 CA ALA A 121 18.410 6.678 45.217 1.00 0.00 ATOM 944 CB ALA A 121 19.525 7.183 46.121 1.00 0.00 ATOM 945 O ALA A 121 16.539 5.697 46.372 1.00 0.00 ATOM 946 C ALA A 121 17.088 6.729 45.968 1.00 0.00 ATOM 947 N ASP A 122 16.578 7.942 46.140 1.00 0.00 ATOM 948 CA ASP A 122 15.311 8.168 46.833 1.00 0.00 ATOM 949 CB ASP A 122 14.965 9.659 46.847 1.00 0.00 ATOM 950 CG ASP A 122 13.723 9.962 47.661 1.00 0.00 ATOM 951 OD1 ASP A 122 13.736 9.700 48.881 1.00 0.00 ATOM 952 OD2 ASP A 122 12.739 10.463 47.078 1.00 0.00 ATOM 953 O ASP A 122 13.295 6.840 46.816 1.00 0.00 ATOM 954 C ASP A 122 14.163 7.422 46.152 1.00 0.00 ATOM 955 N TRP A 123 14.133 7.496 44.858 1.00 0.00 ATOM 956 CA TRP A 123 13.111 6.816 44.064 1.00 0.00 ATOM 957 CB TRP A 123 13.305 7.126 42.567 1.00 0.00 ATOM 958 CG TRP A 123 12.175 6.746 41.669 1.00 0.00 ATOM 959 CD1 TRP A 123 11.110 7.559 41.326 1.00 0.00 ATOM 960 CD2 TRP A 123 11.923 5.485 41.030 1.00 0.00 ATOM 961 CE2 TRP A 123 10.725 5.621 40.291 1.00 0.00 ATOM 962 CE3 TRP A 123 12.609 4.269 40.970 1.00 0.00 ATOM 963 NE1 TRP A 123 10.261 6.890 40.480 1.00 0.00 ATOM 964 CZ2 TRP A 123 10.198 4.577 39.550 1.00 0.00 ATOM 965 CZ3 TRP A 123 12.102 3.228 40.219 1.00 0.00 ATOM 966 CH2 TRP A 123 10.905 3.394 39.499 1.00 0.00 ATOM 967 O TRP A 123 11.937 4.750 44.308 1.00 0.00 ATOM 968 C TRP A 123 13.033 5.309 44.274 1.00 0.00 ATOM 969 N PHE A 124 14.180 4.646 44.397 1.00 0.00 ATOM 970 CA PHE A 124 14.183 3.199 44.574 1.00 0.00 ATOM 971 CB PHE A 124 15.428 2.583 43.936 1.00 0.00 ATOM 972 CG PHE A 124 15.460 2.694 42.438 1.00 0.00 ATOM 973 CD1 PHE A 124 16.218 3.671 41.817 1.00 0.00 ATOM 974 CD2 PHE A 124 14.731 1.821 41.650 1.00 0.00 ATOM 975 CE1 PHE A 124 16.246 3.773 40.439 1.00 0.00 ATOM 976 CE2 PHE A 124 14.759 1.923 40.271 1.00 0.00 ATOM 977 CZ PHE A 124 15.514 2.894 39.666 1.00 0.00 ATOM 978 O PHE A 124 14.154 1.515 46.245 1.00 0.00 ATOM 979 C PHE A 124 14.175 2.717 46.004 1.00 0.00 ATOM 980 N GLY A 125 14.200 3.642 46.958 1.00 0.00 ATOM 981 CA GLY A 125 14.175 3.233 48.346 1.00 0.00 ATOM 982 O GLY A 125 15.603 2.672 50.160 1.00 0.00 ATOM 983 C GLY A 125 15.515 3.192 49.035 1.00 0.00 ATOM 984 N ILE A 126 16.561 3.716 48.393 1.00 0.00 ATOM 985 CA ILE A 126 17.859 3.759 49.048 1.00 0.00 ATOM 986 CB ILE A 126 18.960 4.154 48.047 1.00 0.00 ATOM 987 CG1 ILE A 126 19.030 3.140 46.903 1.00 0.00 ATOM 988 CG2 ILE A 126 20.315 4.198 48.734 1.00 0.00 ATOM 989 CD1 ILE A 126 19.920 3.570 45.758 1.00 0.00 ATOM 990 O ILE A 126 17.420 5.913 50.025 1.00 0.00 ATOM 991 C ILE A 126 17.839 4.761 50.196 1.00 0.00 ATOM 992 N ARG A 127 18.339 4.334 51.347 1.00 0.00 ATOM 993 CA ARG A 127 18.370 5.187 52.533 1.00 0.00 ATOM 994 CB ARG A 127 17.950 4.397 53.774 1.00 0.00 ATOM 995 CG ARG A 127 17.982 5.201 55.063 1.00 0.00 ATOM 996 CD ARG A 127 17.423 4.402 56.228 1.00 0.00 ATOM 997 NE ARG A 127 17.583 5.103 57.499 1.00 0.00 ATOM 998 CZ ARG A 127 17.245 4.594 58.680 1.00 0.00 ATOM 999 NH1 ARG A 127 17.427 5.304 59.785 1.00 0.00 ATOM 1000 NH2 ARG A 127 16.725 3.376 58.753 1.00 0.00 ATOM 1001 O ARG A 127 19.869 6.839 53.408 1.00 0.00 ATOM 1002 C ARG A 127 19.754 5.762 52.822 1.00 0.00 ATOM 1003 N HIS A 128 20.801 5.047 52.421 1.00 0.00 ATOM 1004 CA HIS A 128 22.164 5.514 52.667 1.00 0.00 ATOM 1005 CB HIS A 128 22.922 4.523 53.552 1.00 0.00 ATOM 1006 CG HIS A 128 22.304 4.321 54.901 1.00 0.00 ATOM 1007 CD2 HIS A 128 21.390 3.353 55.489 1.00 0.00 ATOM 1008 ND1 HIS A 128 22.549 5.161 55.965 1.00 0.00 ATOM 1009 CE1 HIS A 128 21.857 4.726 57.034 1.00 0.00 ATOM 1010 NE2 HIS A 128 21.159 3.642 56.755 1.00 0.00 ATOM 1011 O HIS A 128 23.137 4.753 50.606 1.00 0.00 ATOM 1012 C HIS A 128 22.982 5.693 51.394 1.00 0.00 ATOM 1013 N VAL A 129 23.512 6.900 51.214 1.00 0.00 ATOM 1014 CA VAL A 129 24.348 7.236 50.062 1.00 0.00 ATOM 1015 CB VAL A 129 23.682 8.290 49.160 1.00 0.00 ATOM 1016 CG1 VAL A 129 24.591 8.647 47.994 1.00 0.00 ATOM 1017 CG2 VAL A 129 22.369 7.759 48.599 1.00 0.00 ATOM 1018 O VAL A 129 25.659 8.813 51.297 1.00 0.00 ATOM 1019 C VAL A 129 25.658 7.786 50.617 1.00 0.00 ATOM 1020 N TRP A 130 26.764 7.116 50.322 1.00 0.00 ATOM 1021 CA TRP A 130 28.079 7.563 50.766 1.00 0.00 ATOM 1022 CB TRP A 130 28.962 6.402 51.189 1.00 0.00 ATOM 1023 CG TRP A 130 28.817 6.026 52.608 1.00 0.00 ATOM 1024 CD1 TRP A 130 29.561 6.479 53.661 1.00 0.00 ATOM 1025 CD2 TRP A 130 27.821 5.165 53.154 1.00 0.00 ATOM 1026 CE2 TRP A 130 28.010 5.145 54.552 1.00 0.00 ATOM 1027 CE3 TRP A 130 26.782 4.410 52.597 1.00 0.00 ATOM 1028 NE1 TRP A 130 29.080 5.953 54.835 1.00 0.00 ATOM 1029 CZ2 TRP A 130 27.193 4.395 55.405 1.00 0.00 ATOM 1030 CZ3 TRP A 130 25.970 3.666 53.443 1.00 0.00 ATOM 1031 CH2 TRP A 130 26.182 3.665 54.832 1.00 0.00 ATOM 1032 O TRP A 130 28.484 7.679 48.419 1.00 0.00 ATOM 1033 C TRP A 130 28.791 8.093 49.538 1.00 0.00 ATOM 1034 N LEU A 131 29.730 9.012 49.732 1.00 0.00 ATOM 1035 CA LEU A 131 30.453 9.555 48.593 1.00 0.00 ATOM 1036 CB LEU A 131 29.741 10.794 48.048 1.00 0.00 ATOM 1037 CG LEU A 131 29.557 11.955 49.027 1.00 0.00 ATOM 1038 CD1 LEU A 131 30.792 12.843 49.047 1.00 0.00 ATOM 1039 CD2 LEU A 131 28.363 12.810 48.630 1.00 0.00 ATOM 1040 O LEU A 131 32.179 10.379 50.072 1.00 0.00 ATOM 1041 C LEU A 131 31.900 9.911 48.964 1.00 0.00 ATOM 1042 N GLY A 132 32.812 9.662 48.032 1.00 0.00 ATOM 1043 CA GLY A 132 34.195 10.090 48.166 1.00 0.00 ATOM 1044 O GLY A 132 34.246 10.723 45.875 1.00 0.00 ATOM 1045 C GLY A 132 34.479 11.050 47.039 1.00 0.00 ATOM 1046 N THR A 133 34.987 12.240 47.362 1.00 0.00 ATOM 1047 CA THR A 133 35.152 13.286 46.347 1.00 0.00 ATOM 1048 CB THR A 133 34.364 14.477 46.719 1.00 0.00 ATOM 1049 CG2 THR A 133 32.841 14.054 46.849 1.00 0.00 ATOM 1050 OG1 THR A 133 34.786 14.933 48.014 1.00 0.00 ATOM 1051 O THR A 133 37.344 13.644 47.254 1.00 0.00 ATOM 1052 C THR A 133 36.553 13.889 46.350 1.00 0.00 ATOM 1053 N GLY A 134 36.872 14.678 45.306 1.00 0.00 ATOM 1054 CA GLY A 134 38.176 15.306 45.221 1.00 0.00 ATOM 1055 O GLY A 134 37.225 17.013 46.622 1.00 0.00 ATOM 1056 C GLY A 134 38.248 16.435 46.245 1.00 0.00 ATOM 1057 N SER A 135 39.474 16.748 46.679 1.00 0.00 ATOM 1058 CA SER A 135 39.680 17.790 47.655 1.00 0.00 ATOM 1059 CB SER A 135 41.131 17.929 48.044 1.00 0.00 ATOM 1060 OG SER A 135 41.608 16.848 48.820 1.00 0.00 ATOM 1061 O SER A 135 38.585 19.933 47.797 1.00 0.00 ATOM 1062 C SER A 135 39.175 19.118 47.093 1.00 0.00 ATOM 1063 N ALA A 136 39.458 19.386 45.830 1.00 0.00 ATOM 1064 CA ALA A 136 39.000 20.635 45.212 1.00 0.00 ATOM 1065 CB ALA A 136 39.609 20.801 43.834 1.00 0.00 ATOM 1066 O ALA A 136 36.883 21.753 45.297 1.00 0.00 ATOM 1067 C ALA A 136 37.486 20.684 45.125 1.00 0.00 ATOM 1068 N ASP A 137 36.828 19.563 44.869 1.00 0.00 ATOM 1069 CA ASP A 137 35.370 19.493 44.844 1.00 0.00 ATOM 1070 CB ASP A 137 34.908 18.084 44.465 1.00 0.00 ATOM 1071 CG ASP A 137 35.140 17.768 43.002 1.00 0.00 ATOM 1072 OD1 ASP A 137 35.434 18.707 42.230 1.00 0.00 ATOM 1073 OD2 ASP A 137 35.030 16.582 42.624 1.00 0.00 ATOM 1074 O ASP A 137 33.989 20.747 46.369 1.00 0.00 ATOM 1075 C ASP A 137 34.812 19.841 46.229 1.00 0.00 ATOM 1076 N VAL A 138 35.271 19.135 47.255 1.00 0.00 ATOM 1077 CA VAL A 138 34.789 19.390 48.608 1.00 0.00 ATOM 1078 CB VAL A 138 35.365 18.256 49.570 1.00 0.00 ATOM 1079 CG1 VAL A 138 35.023 18.568 51.020 1.00 0.00 ATOM 1080 CG2 VAL A 138 34.813 16.893 49.188 1.00 0.00 ATOM 1081 O VAL A 138 34.331 21.460 49.737 1.00 0.00 ATOM 1082 C VAL A 138 35.150 20.799 49.082 1.00 0.00 ATOM 1083 N PHE A 139 33.642 19.353 51.132 1.00 0.00 ATOM 1084 CA PHE A 139 32.464 20.166 51.413 1.00 0.00 ATOM 1085 CB PHE A 139 32.730 21.448 51.922 1.00 0.00 ATOM 1086 CG PHE A 139 32.546 21.321 53.410 1.00 0.00 ATOM 1087 CD1 PHE A 139 31.278 21.135 53.951 1.00 0.00 ATOM 1088 CD2 PHE A 139 33.646 21.337 54.266 1.00 0.00 ATOM 1089 CE1 PHE A 139 31.104 20.966 55.322 1.00 0.00 ATOM 1090 CE2 PHE A 139 33.483 21.168 55.644 1.00 0.00 ATOM 1091 CZ PHE A 139 32.210 20.982 56.172 1.00 0.00 ATOM 1092 O PHE A 139 31.589 21.022 49.346 1.00 0.00 ATOM 1093 C PHE A 139 31.531 20.141 50.204 1.00 0.00 ATOM 1094 N SER A 140 30.651 19.145 50.162 1.00 0.00 ATOM 1095 CA SER A 140 29.711 18.993 49.055 1.00 0.00 ATOM 1096 CB SER A 140 29.258 17.537 48.934 1.00 0.00 ATOM 1097 OG SER A 140 28.263 17.392 47.935 1.00 0.00 ATOM 1098 O SER A 140 27.507 19.423 49.901 1.00 0.00 ATOM 1099 C SER A 140 28.376 19.737 49.085 1.00 0.00 ATOM 1100 N PRO A 141 28.217 20.727 48.230 1.00 0.00 ATOM 1101 CA PRO A 141 26.953 21.471 48.202 1.00 0.00 ATOM 1102 CB PRO A 141 27.332 22.759 47.481 1.00 0.00 ATOM 1103 CG PRO A 141 28.359 22.286 46.498 1.00 0.00 ATOM 1104 CD PRO A 141 29.203 21.325 47.313 1.00 0.00 ATOM 1105 O PRO A 141 25.915 20.951 46.128 1.00 0.00 ATOM 1106 C PRO A 141 25.868 20.868 47.343 1.00 0.00 ATOM 1107 N LYS A 142 24.695 20.197 47.913 1.00 0.00 ATOM 1108 CA LYS A 142 23.625 19.620 47.133 1.00 0.00 ATOM 1109 CB LYS A 142 22.788 18.638 47.955 1.00 0.00 ATOM 1110 CG LYS A 142 23.571 17.444 48.480 1.00 0.00 ATOM 1111 CD LYS A 142 24.069 16.567 47.343 1.00 0.00 ATOM 1112 CE LYS A 142 24.801 15.344 47.871 1.00 0.00 ATOM 1113 NZ LYS A 142 25.299 14.477 46.765 1.00 0.00 ATOM 1114 O LYS A 142 22.457 21.703 47.364 1.00 0.00 ATOM 1115 C LYS A 142 22.707 20.735 46.645 1.00 0.00 ATOM 1116 N VAL A 143 22.209 20.597 45.421 1.00 0.00 ATOM 1117 CA VAL A 143 21.312 21.590 44.844 1.00 0.00 ATOM 1118 CB VAL A 143 21.511 21.716 43.322 1.00 0.00 ATOM 1119 CG1 VAL A 143 20.528 22.716 42.736 1.00 0.00 ATOM 1120 CG2 VAL A 143 22.923 22.185 43.006 1.00 0.00 ATOM 1121 O VAL A 143 19.387 20.182 44.574 1.00 0.00 ATOM 1122 C VAL A 143 19.866 21.182 45.110 1.00 0.00 ATOM 1123 N VAL A 144 19.184 21.965 45.947 1.00 0.00 ATOM 1124 CA VAL A 144 17.796 21.673 46.282 1.00 0.00 ATOM 1125 CB VAL A 144 17.267 22.628 47.370 1.00 0.00 ATOM 1126 CG1 VAL A 144 15.772 22.432 47.568 1.00 0.00 ATOM 1127 CG2 VAL A 144 17.966 22.365 48.695 1.00 0.00 ATOM 1128 O VAL A 144 15.980 21.018 44.872 1.00 0.00 ATOM 1129 C VAL A 144 16.890 21.820 45.058 1.00 0.00 ATOM 1130 N GLN A 145 17.160 22.796 44.194 1.00 0.00 ATOM 1131 CA GLN A 145 16.345 22.921 42.994 1.00 0.00 ATOM 1132 CB GLN A 145 16.745 24.167 42.202 1.00 0.00 ATOM 1133 CG GLN A 145 16.354 25.477 42.866 1.00 0.00 ATOM 1134 CD GLN A 145 16.865 26.689 42.113 1.00 0.00 ATOM 1135 OE1 GLN A 145 17.595 26.557 41.130 1.00 0.00 ATOM 1136 NE2 GLN A 145 16.481 27.875 42.570 1.00 0.00 ATOM 1137 O GLN A 145 15.639 21.137 41.539 1.00 0.00 ATOM 1138 C GLN A 145 16.575 21.667 42.143 1.00 0.00 ATOM 1139 N ALA A 146 17.827 21.212 42.072 1.00 0.00 ATOM 1140 CA ALA A 146 18.152 20.021 41.293 1.00 0.00 ATOM 1141 CB ALA A 146 19.659 19.890 41.128 1.00 0.00 ATOM 1142 O ALA A 146 17.107 17.877 41.190 1.00 0.00 ATOM 1143 C ALA A 146 17.624 18.736 41.903 1.00 0.00 ATOM 1144 N SER A 147 17.749 18.538 43.222 1.00 0.00 ATOM 1145 CA SER A 147 17.310 17.332 43.869 1.00 0.00 ATOM 1146 CB SER A 147 18.089 17.194 45.178 1.00 0.00 ATOM 1147 OG SER A 147 17.695 18.184 46.112 1.00 0.00 ATOM 1148 O SER A 147 15.307 16.250 44.643 1.00 0.00 ATOM 1149 C SER A 147 15.819 17.277 44.195 1.00 0.00 ATOM 1150 N MET A 148 15.090 18.499 43.918 1.00 0.00 ATOM 1151 CA MET A 148 13.683 18.699 44.251 1.00 0.00 ATOM 1152 CB MET A 148 12.804 17.724 43.463 1.00 0.00 ATOM 1153 CG MET A 148 12.896 17.887 41.955 1.00 0.00 ATOM 1154 SD MET A 148 11.794 16.768 41.067 1.00 0.00 ATOM 1155 CE MET A 148 12.332 17.032 39.380 1.00 0.00 ATOM 1156 O MET A 148 12.290 18.188 46.139 1.00 0.00 ATOM 1157 C MET A 148 13.420 18.471 45.737 1.00 0.00 ATOM 1158 N GLY A 149 14.476 18.615 46.543 1.00 0.00 ATOM 1159 CA GLY A 149 14.333 18.426 47.976 1.00 0.00 ATOM 1160 O GLY A 149 14.488 16.696 49.616 1.00 0.00 ATOM 1161 C GLY A 149 14.526 16.989 48.421 1.00 0.00 ATOM 1162 N ALA A 150 14.735 16.093 47.461 1.00 0.00 ATOM 1163 CA ALA A 150 14.930 14.678 47.765 1.00 0.00 ATOM 1164 CB ALA A 150 15.100 13.878 46.482 1.00 0.00 ATOM 1165 O ALA A 150 16.237 13.504 49.399 1.00 0.00 ATOM 1166 C ALA A 150 16.170 14.459 48.626 1.00 0.00 ATOM 1167 N LEU A 151 17.186 15.427 48.697 1.00 0.00 ATOM 1168 CA LEU A 151 18.428 15.321 49.454 1.00 0.00 ATOM 1169 CB LEU A 151 19.333 16.521 49.167 1.00 0.00 ATOM 1170 CG LEU A 151 19.893 16.625 47.746 1.00 0.00 ATOM 1171 CD1 LEU A 151 20.669 17.921 47.567 1.00 0.00 ATOM 1172 CD2 LEU A 151 20.829 15.464 47.451 1.00 0.00 ATOM 1173 O LEU A 151 19.042 15.027 51.758 1.00 0.00 ATOM 1174 C LEU A 151 18.148 15.291 50.954 1.00 0.00 ATOM 1175 N ALA A 152 16.901 15.562 51.324 1.00 0.00 ATOM 1176 CA ALA A 152 16.517 15.597 52.725 1.00 0.00 ATOM 1177 CB ALA A 152 15.308 16.496 52.926 1.00 0.00 ATOM 1178 O ALA A 152 16.283 14.050 54.536 1.00 0.00 ATOM 1179 C ALA A 152 16.138 14.247 53.325 1.00 0.00 ATOM 1180 N ARG A 153 15.667 13.311 52.501 1.00 0.00 ATOM 1181 CA ARG A 153 15.265 12.013 53.039 1.00 0.00 ATOM 1182 CB ARG A 153 13.896 11.607 52.490 1.00 0.00 ATOM 1183 CG ARG A 153 12.785 12.597 52.796 1.00 0.00 ATOM 1184 CD ARG A 153 12.503 12.667 54.289 1.00 0.00 ATOM 1185 NE ARG A 153 12.073 11.379 54.825 1.00 0.00 ATOM 1186 CZ ARG A 153 12.061 11.074 56.118 1.00 0.00 ATOM 1187 NH1 ARG A 153 11.654 9.876 56.514 1.00 0.00 ATOM 1188 NH2 ARG A 153 12.459 11.968 57.014 1.00 0.00 ATOM 1189 O ARG A 153 15.775 9.678 52.778 1.00 0.00 ATOM 1190 C ARG A 153 16.189 10.837 52.731 1.00 0.00 ATOM 1191 N VAL A 154 17.443 11.148 52.426 1.00 0.00 ATOM 1192 CA VAL A 154 18.467 10.143 52.176 1.00 0.00 ATOM 1193 CB VAL A 154 18.833 10.070 50.682 1.00 0.00 ATOM 1194 CG1 VAL A 154 19.927 9.038 50.451 1.00 0.00 ATOM 1195 CG2 VAL A 154 17.619 9.675 49.856 1.00 0.00 ATOM 1196 O VAL A 154 19.977 11.792 53.012 1.00 0.00 ATOM 1197 C VAL A 154 19.658 10.604 53.012 1.00 0.00 ATOM 1198 N GLN A 155 20.286 9.690 53.753 1.00 0.00 ATOM 1199 CA GLN A 155 21.453 10.054 54.557 1.00 0.00 ATOM 1200 CB GLN A 155 21.680 9.024 55.666 1.00 0.00 ATOM 1201 CG GLN A 155 22.848 9.347 56.583 1.00 0.00 ATOM 1202 CD GLN A 155 22.995 8.349 57.715 1.00 0.00 ATOM 1203 OE1 GLN A 155 22.232 7.388 57.808 1.00 0.00 ATOM 1204 NE2 GLN A 155 23.978 8.575 58.578 1.00 0.00 ATOM 1205 O GLN A 155 23.345 9.026 53.505 1.00 0.00 ATOM 1206 C GLN A 155 22.762 10.077 53.782 1.00 0.00 ATOM 1207 N PRO A 156 23.185 11.270 53.384 1.00 0.00 ATOM 1208 CA PRO A 156 24.414 11.434 52.621 1.00 0.00 ATOM 1209 CB PRO A 156 24.061 12.670 51.793 1.00 0.00 ATOM 1210 CG PRO A 156 23.210 13.496 52.696 1.00 0.00 ATOM 1211 CD PRO A 156 22.463 12.526 53.568 1.00 0.00 ATOM 1212 O PRO A 156 25.717 12.598 54.270 1.00 0.00 ATOM 1213 C PRO A 156 25.646 11.641 53.498 1.00 0.00 ATOM 1214 N THR A 157 26.607 10.730 53.384 1.00 0.00 ATOM 1215 CA THR A 157 27.821 10.783 54.192 1.00 0.00 ATOM 1216 CB THR A 157 27.917 9.579 55.148 1.00 0.00 ATOM 1217 CG2 THR A 157 29.182 9.664 55.987 1.00 0.00 ATOM 1218 OG1 THR A 157 26.780 9.568 56.021 1.00 0.00 ATOM 1219 O THR A 157 29.352 9.882 52.573 1.00 0.00 ATOM 1220 C THR A 157 29.114 10.777 53.384 1.00 0.00 ATOM 1221 N PRO A 158 29.954 11.775 53.635 1.00 0.00 ATOM 1222 CA PRO A 158 31.239 11.902 52.963 1.00 0.00 ATOM 1223 CB PRO A 158 31.640 13.359 53.200 1.00 0.00 ATOM 1224 CG PRO A 158 30.979 13.721 54.488 1.00 0.00 ATOM 1225 CD PRO A 158 29.684 12.960 54.520 1.00 0.00 ATOM 1226 O PRO A 158 32.242 10.747 54.812 1.00 0.00 ATOM 1227 C PRO A 158 32.219 10.912 53.596 1.00 0.00 ATOM 1228 N LEU A 159 33.009 10.246 52.759 1.00 0.00 ATOM 1229 CA LEU A 159 33.994 9.264 53.208 1.00 0.00 ATOM 1230 CB LEU A 159 33.678 7.885 52.628 1.00 0.00 ATOM 1231 CG LEU A 159 32.319 7.287 53.001 1.00 0.00 ATOM 1232 CD1 LEU A 159 32.084 5.981 52.256 1.00 0.00 ATOM 1233 CD2 LEU A 159 32.250 7.002 54.493 1.00 0.00 ATOM 1234 O LEU A 159 35.478 10.257 51.623 1.00 0.00 ATOM 1235 C LEU A 159 35.367 9.729 52.725 1.00 0.00 ATOM 1236 N LYS A 160 36.400 9.538 53.542 1.00 0.00 ATOM 1237 CA LYS A 160 37.754 9.955 53.167 1.00 0.00 ATOM 1238 CB LYS A 160 38.500 10.511 54.383 1.00 0.00 ATOM 1239 CG LYS A 160 37.877 11.765 54.973 1.00 0.00 ATOM 1240 CD LYS A 160 38.705 12.302 56.129 1.00 0.00 ATOM 1241 CE LYS A 160 38.109 13.583 56.687 1.00 0.00 ATOM 1242 NZ LYS A 160 38.889 14.100 57.846 1.00 0.00 ATOM 1243 O LYS A 160 39.603 9.029 51.935 1.00 0.00 ATOM 1244 C LYS A 160 38.600 8.806 52.609 1.00 0.00 ATOM 1245 N ASN A 161 38.160 7.574 52.919 1.00 0.00 ATOM 1246 CA ASN A 161 38.848 6.399 52.404 1.00 0.00 ATOM 1247 CB ASN A 161 39.688 5.803 53.534 1.00 0.00 ATOM 1248 CG ASN A 161 40.594 4.685 53.057 1.00 0.00 ATOM 1249 ND2 ASN A 161 41.890 4.824 53.312 1.00 0.00 ATOM 1250 OD1 ASN A 161 40.132 3.707 52.468 1.00 0.00 ATOM 1251 O ASN A 161 37.205 4.653 52.710 1.00 0.00 ATOM 1252 C ASN A 161 37.811 5.372 51.934 1.00 0.00 ATOM 1253 N THR A 162 37.585 5.263 50.553 1.00 0.00 ATOM 1254 CA THR A 162 36.607 4.361 50.023 1.00 0.00 ATOM 1255 CB THR A 162 36.654 4.409 48.484 1.00 0.00 ATOM 1256 CG2 THR A 162 35.666 3.415 47.891 1.00 0.00 ATOM 1257 OG1 THR A 162 36.314 5.726 48.033 1.00 0.00 ATOM 1258 O THR A 162 35.842 2.247 50.843 1.00 0.00 ATOM 1259 C THR A 162 36.780 2.892 50.377 1.00 0.00 ATOM 1260 N VAL A 163 37.977 2.364 50.141 1.00 0.00 ATOM 1261 CA VAL A 163 38.253 0.962 50.424 1.00 0.00 ATOM 1262 CB VAL A 163 39.717 0.602 50.111 1.00 0.00 ATOM 1263 CG1 VAL A 163 40.036 -0.803 50.598 1.00 0.00 ATOM 1264 CG2 VAL A 163 39.973 0.661 48.613 1.00 0.00 ATOM 1265 O VAL A 163 37.395 -0.411 52.173 1.00 0.00 ATOM 1266 C VAL A 163 37.997 0.622 51.882 1.00 0.00 ATOM 1267 N ASP A 164 38.423 1.493 52.787 1.00 0.00 ATOM 1268 CA ASP A 164 38.245 1.224 54.217 1.00 0.00 ATOM 1269 CB ASP A 164 38.893 2.336 55.044 1.00 0.00 ATOM 1270 CG ASP A 164 40.408 2.260 55.036 1.00 0.00 ATOM 1271 OD1 ASP A 164 40.948 1.224 54.595 1.00 0.00 ATOM 1272 OD2 ASP A 164 41.054 3.236 55.472 1.00 0.00 ATOM 1273 O ASP A 164 36.319 0.283 55.335 1.00 0.00 ATOM 1274 C ASP A 164 36.757 1.161 54.569 1.00 0.00 ATOM 1275 N THR A 165 35.978 2.071 54.006 1.00 0.00 ATOM 1276 CA THR A 165 34.547 2.100 54.291 1.00 0.00 ATOM 1277 CB THR A 165 33.921 3.403 53.760 1.00 0.00 ATOM 1278 CG2 THR A 165 32.451 3.481 54.101 1.00 0.00 ATOM 1279 OG1 THR A 165 34.540 4.538 54.369 1.00 0.00 ATOM 1280 O THR A 165 33.024 0.242 54.299 1.00 0.00 ATOM 1281 C THR A 165 33.862 0.887 53.667 1.00 0.00 ATOM 1282 N LEU A 166 34.221 0.582 52.424 1.00 0.00 ATOM 1283 CA LEU A 166 33.626 -0.551 51.735 1.00 0.00 ATOM 1284 CB LEU A 166 34.126 -0.621 50.291 1.00 0.00 ATOM 1285 CG LEU A 166 33.656 0.495 49.355 1.00 0.00 ATOM 1286 CD1 LEU A 166 34.355 0.399 48.007 1.00 0.00 ATOM 1287 CD2 LEU A 166 32.156 0.405 49.121 1.00 0.00 ATOM 1288 O LEU A 166 33.185 -2.802 52.414 1.00 0.00 ATOM 1289 C LEU A 166 33.979 -1.867 52.420 1.00 0.00 ATOM 1290 N ALA A 167 35.162 -1.925 53.019 1.00 0.00 ATOM 1291 CA ALA A 167 35.586 -3.132 53.722 1.00 0.00 ATOM 1292 CB ALA A 167 37.038 -3.010 54.156 1.00 0.00 ATOM 1293 O ALA A 167 34.439 -4.468 55.348 1.00 0.00 ATOM 1294 C ALA A 167 34.719 -3.335 54.956 1.00 0.00 ATOM 1295 N TYR A 168 34.300 -2.230 55.565 1.00 0.00 ATOM 1296 CA TYR A 168 33.440 -2.288 56.739 1.00 0.00 ATOM 1297 CB TYR A 168 33.142 -0.879 57.255 1.00 0.00 ATOM 1298 CG TYR A 168 32.229 -0.849 58.460 1.00 0.00 ATOM 1299 CD1 TYR A 168 32.717 -1.139 59.728 1.00 0.00 ATOM 1300 CD2 TYR A 168 30.884 -0.530 58.326 1.00 0.00 ATOM 1301 CE1 TYR A 168 31.891 -1.113 60.836 1.00 0.00 ATOM 1302 CE2 TYR A 168 30.044 -0.500 59.423 1.00 0.00 ATOM 1303 CZ TYR A 168 30.559 -0.795 60.684 1.00 0.00 ATOM 1304 OH TYR A 168 29.734 -0.769 61.785 1.00 0.00 ATOM 1305 O TYR A 168 31.664 -3.858 57.100 1.00 0.00 ATOM 1306 C TYR A 168 32.145 -2.989 56.365 1.00 0.00 ATOM 1307 N PHE A 169 31.578 -2.613 55.222 1.00 0.00 ATOM 1308 CA PHE A 169 30.339 -3.236 54.771 1.00 0.00 ATOM 1309 CB PHE A 169 29.768 -2.476 53.572 1.00 0.00 ATOM 1310 CG PHE A 169 29.290 -1.090 53.904 1.00 0.00 ATOM 1311 CD1 PHE A 169 29.050 -0.721 55.216 1.00 0.00 ATOM 1312 CD2 PHE A 169 29.083 -0.157 52.905 1.00 0.00 ATOM 1313 CE1 PHE A 169 28.611 0.553 55.521 1.00 0.00 ATOM 1314 CE2 PHE A 169 28.644 1.118 53.210 1.00 0.00 ATOM 1315 CZ PHE A 169 28.408 1.474 54.511 1.00 0.00 ATOM 1316 O PHE A 169 29.764 -5.557 54.659 1.00 0.00 ATOM 1317 C PHE A 169 30.572 -4.679 54.360 1.00 0.00 ATOM 1318 N ARG A 170 31.677 -4.924 53.667 1.00 0.00 ATOM 1319 CA ARG A 170 31.989 -6.269 53.208 1.00 0.00 ATOM 1320 CB ARG A 170 33.317 -6.283 52.449 1.00 0.00 ATOM 1321 CG ARG A 170 33.688 -7.639 51.873 1.00 0.00 ATOM 1322 CD ARG A 170 35.058 -7.603 51.214 1.00 0.00 ATOM 1323 NE ARG A 170 36.125 -7.367 52.185 1.00 0.00 ATOM 1324 CZ ARG A 170 36.616 -8.299 52.997 1.00 0.00 ATOM 1325 NH1 ARG A 170 37.586 -7.992 53.846 1.00 0.00 ATOM 1326 NH2 ARG A 170 36.134 -9.533 52.957 1.00 0.00 ATOM 1327 O ARG A 170 31.498 -8.301 54.391 1.00 0.00 ATOM 1328 C ARG A 170 32.100 -7.226 54.393 1.00 0.00 ATOM 1329 N ARG A 171 32.853 -6.825 55.413 1.00 0.00 ATOM 1330 CA ARG A 171 33.025 -7.664 56.592 1.00 0.00 ATOM 1331 CB ARG A 171 34.014 -7.023 57.567 1.00 0.00 ATOM 1332 CG ARG A 171 35.453 -7.014 57.075 1.00 0.00 ATOM 1333 CD ARG A 171 36.369 -6.308 58.061 1.00 0.00 ATOM 1334 NE ARG A 171 37.742 -6.223 57.567 1.00 0.00 ATOM 1335 CZ ARG A 171 38.683 -5.454 58.106 1.00 0.00 ATOM 1336 NH1 ARG A 171 39.904 -5.442 57.590 1.00 0.00 ATOM 1337 NH2 ARG A 171 38.400 -4.701 59.159 1.00 0.00 ATOM 1338 O ARG A 171 31.580 -8.789 58.142 1.00 0.00 ATOM 1339 C ARG A 171 31.706 -7.869 57.331 1.00 0.00 ATOM 1340 N GLN A 172 30.726 -7.012 57.048 1.00 0.00 ATOM 1341 CA GLN A 172 29.408 -7.115 57.672 1.00 0.00 ATOM 1342 CB GLN A 172 28.773 -5.730 57.810 1.00 0.00 ATOM 1343 CG GLN A 172 29.566 -4.764 58.674 1.00 0.00 ATOM 1344 CD GLN A 172 29.737 -5.262 60.097 1.00 0.00 ATOM 1345 OE1 GLN A 172 28.778 -5.702 60.730 1.00 0.00 ATOM 1346 NE2 GLN A 172 30.964 -5.195 60.602 1.00 0.00 ATOM 1347 O GLN A 172 27.279 -8.096 57.171 1.00 0.00 ATOM 1348 C GLN A 172 28.461 -7.983 56.850 1.00 0.00 ATOM 1349 N GLY A 173 28.975 -8.583 55.782 1.00 0.00 ATOM 1350 CA GLY A 173 28.147 -9.443 54.955 1.00 0.00 ATOM 1351 O GLY A 173 26.754 -9.440 53.011 1.00 0.00 ATOM 1352 C GLY A 173 27.560 -8.815 53.702 1.00 0.00 ATOM 1353 N ILE A 174 27.947 -7.580 53.402 1.00 0.00 ATOM 1354 CA ILE A 174 27.436 -6.905 52.208 1.00 0.00 ATOM 1355 CB ILE A 174 27.455 -5.374 52.374 1.00 0.00 ATOM 1356 CG1 ILE A 174 26.528 -4.949 53.515 1.00 0.00 ATOM 1357 CG2 ILE A 174 26.988 -4.695 51.095 1.00 0.00 ATOM 1358 CD1 ILE A 174 26.688 -3.501 53.924 1.00 0.00 ATOM 1359 O ILE A 174 29.364 -6.617 50.853 1.00 0.00 ATOM 1360 C ILE A 174 28.214 -7.069 50.912 1.00 0.00 ATOM 1361 N PRO A 175 27.656 -7.699 49.916 1.00 0.00 ATOM 1362 CA PRO A 175 28.384 -7.831 48.646 1.00 0.00 ATOM 1363 CB PRO A 175 27.483 -8.686 47.783 1.00 0.00 ATOM 1364 CG PRO A 175 26.549 -9.375 48.722 1.00 0.00 ATOM 1365 CD PRO A 175 26.360 -8.400 49.868 1.00 0.00 ATOM 1366 O PRO A 175 27.786 -5.603 47.976 1.00 0.00 ATOM 1367 C PRO A 175 28.666 -6.470 48.019 1.00 0.00 ATOM 1368 N VAL A 176 29.895 -6.276 47.559 1.00 0.00 ATOM 1369 CA VAL A 176 30.285 -5.019 46.934 1.00 0.00 ATOM 1370 CB VAL A 176 31.725 -4.623 47.310 1.00 0.00 ATOM 1371 CG1 VAL A 176 32.118 -3.326 46.621 1.00 0.00 ATOM 1372 CG2 VAL A 176 31.847 -4.426 48.813 1.00 0.00 ATOM 1373 O VAL A 176 30.874 -6.038 44.836 1.00 0.00 ATOM 1374 C VAL A 176 30.171 -5.218 45.430 1.00 0.00 ATOM 1375 N TYR A 177 29.210 -4.472 44.820 1.00 0.00 ATOM 1376 CA TYR A 177 29.017 -4.493 43.377 1.00 0.00 ATOM 1377 CB TYR A 177 27.522 -4.662 43.101 1.00 0.00 ATOM 1378 CG TYR A 177 26.964 -5.995 43.545 1.00 0.00 ATOM 1379 CD1 TYR A 177 26.439 -6.156 44.820 1.00 0.00 ATOM 1380 CD2 TYR A 177 26.963 -7.088 42.687 1.00 0.00 ATOM 1381 CE1 TYR A 177 25.925 -7.370 45.236 1.00 0.00 ATOM 1382 CE2 TYR A 177 26.454 -8.310 43.084 1.00 0.00 ATOM 1383 CZ TYR A 177 25.933 -8.443 44.371 1.00 0.00 ATOM 1384 OH TYR A 177 25.424 -9.653 44.782 1.00 0.00 ATOM 1385 O TYR A 177 28.971 -2.112 43.042 1.00 0.00 ATOM 1386 C TYR A 177 29.505 -3.184 42.755 1.00 0.00 ATOM 1387 N GLY A 178 30.511 -3.272 41.892 1.00 0.00 ATOM 1388 CA GLY A 178 31.070 -2.071 41.288 1.00 0.00 ATOM 1389 O GLY A 178 31.298 -3.006 39.092 1.00 0.00 ATOM 1390 C GLY A 178 31.026 -2.018 39.772 1.00 0.00 ATOM 1391 N ALA A 179 30.697 -0.845 39.239 1.00 0.00 ATOM 1392 CA ALA A 179 30.660 -0.657 37.794 1.00 0.00 ATOM 1393 CB ALA A 179 29.901 0.615 37.445 1.00 0.00 ATOM 1394 O ALA A 179 32.851 0.318 37.816 1.00 0.00 ATOM 1395 C ALA A 179 32.121 -0.569 37.372 1.00 0.00 ATOM 1396 N PHE A 180 32.541 -1.495 36.518 1.00 0.00 ATOM 1397 CA PHE A 180 33.921 -1.539 36.040 1.00 0.00 ATOM 1398 CB PHE A 180 34.701 -2.663 36.728 1.00 0.00 ATOM 1399 CG PHE A 180 36.149 -2.725 36.332 1.00 0.00 ATOM 1400 CD1 PHE A 180 37.057 -1.805 36.828 1.00 0.00 ATOM 1401 CD2 PHE A 180 36.603 -3.703 35.465 1.00 0.00 ATOM 1402 CE1 PHE A 180 38.389 -1.863 36.464 1.00 0.00 ATOM 1403 CE2 PHE A 180 37.935 -3.760 35.101 1.00 0.00 ATOM 1404 CZ PHE A 180 38.827 -2.846 35.597 1.00 0.00 ATOM 1405 O PHE A 180 33.370 -2.816 34.082 1.00 0.00 ATOM 1406 C PHE A 180 33.865 -1.783 34.536 1.00 0.00 ATOM 1407 N LEU A 181 34.359 -0.816 33.769 1.00 0.00 ATOM 1408 CA LEU A 181 34.337 -0.901 32.311 1.00 0.00 ATOM 1409 CB LEU A 181 34.547 0.482 31.689 1.00 0.00 ATOM 1410 CG LEU A 181 33.465 1.526 31.978 1.00 0.00 ATOM 1411 CD1 LEU A 181 33.834 2.866 31.359 1.00 0.00 ATOM 1412 CD2 LEU A 181 32.127 1.088 31.403 1.00 0.00 ATOM 1413 O LEU A 181 36.590 -1.407 31.646 1.00 0.00 ATOM 1414 C LEU A 181 35.449 -1.825 31.837 1.00 0.00 ATOM 1415 N ASP A 182 35.098 -3.092 31.652 1.00 0.00 ATOM 1416 CA ASP A 182 36.061 -4.092 31.226 1.00 0.00 ATOM 1417 CB ASP A 182 36.892 -4.568 32.421 1.00 0.00 ATOM 1418 CG ASP A 182 38.188 -5.232 32.000 1.00 0.00 ATOM 1419 OD1 ASP A 182 38.469 -5.270 30.784 1.00 0.00 ATOM 1420 OD2 ASP A 182 38.925 -5.713 32.886 1.00 0.00 ATOM 1421 O ASP A 182 34.220 -5.617 31.028 1.00 0.00 ATOM 1422 C ASP A 182 35.344 -5.298 30.636 1.00 0.00 ATOM 1423 N GLY A 183 35.993 -5.970 29.690 1.00 0.00 ATOM 1424 CA GLY A 183 35.396 -7.141 29.062 1.00 0.00 ATOM 1425 O GLY A 183 34.438 -9.181 29.848 1.00 0.00 ATOM 1426 C GLY A 183 35.240 -8.271 30.064 1.00 0.00 ATOM 1427 N GLN A 184 36.014 -8.176 31.161 1.00 0.00 ATOM 1428 CA GLN A 184 35.941 -9.222 32.193 1.00 0.00 ATOM 1429 CB GLN A 184 36.713 -8.830 33.418 1.00 0.00 ATOM 1430 CG GLN A 184 38.215 -9.060 33.355 1.00 0.00 ATOM 1431 CD GLN A 184 38.861 -9.066 34.744 1.00 0.00 ATOM 1432 OE1 GLN A 184 39.621 -9.975 35.080 1.00 0.00 ATOM 1433 NE2 GLN A 184 38.543 -8.060 35.555 1.00 0.00 ATOM 1434 O GLN A 184 34.025 -10.475 32.905 1.00 0.00 ATOM 1435 C GLN A 184 34.544 -9.336 32.830 1.00 0.00 ATOM 1436 N SER A 185 34.016 -8.230 33.292 1.00 0.00 ATOM 1437 CA SER A 185 32.700 -8.277 33.961 1.00 0.00 ATOM 1438 CB SER A 185 32.336 -6.660 34.197 1.00 0.00 ATOM 1439 OG SER A 185 33.509 -5.896 34.393 1.00 0.00 ATOM 1440 O SER A 185 30.674 -9.329 33.216 1.00 0.00 ATOM 1441 C SER A 185 31.640 -8.597 32.924 1.00 0.00 ATOM 1442 N LEU A 186 31.796 -8.077 31.711 1.00 0.00 ATOM 1443 CA LEU A 186 30.767 -8.348 30.663 1.00 0.00 ATOM 1444 CB LEU A 186 30.995 -7.457 29.470 1.00 0.00 ATOM 1445 CG LEU A 186 30.057 -7.614 28.279 1.00 0.00 ATOM 1446 CD1 LEU A 186 28.584 -7.493 28.690 1.00 0.00 ATOM 1447 CD2 LEU A 186 30.466 -6.736 27.180 1.00 0.00 ATOM 1448 O LEU A 186 29.623 -10.442 30.123 1.00 0.00 ATOM 1449 C LEU A 186 30.722 -9.828 30.318 1.00 0.00 ATOM 1450 N TYR A 187 30.603 -8.535 34.176 1.00 0.00 ATOM 1451 CA TYR A 187 29.388 -9.239 33.802 1.00 0.00 ATOM 1452 CB TYR A 187 28.920 -10.146 34.962 1.00 0.00 ATOM 1453 CG TYR A 187 29.929 -11.170 35.418 1.00 0.00 ATOM 1454 CD1 TYR A 187 30.785 -10.938 36.492 1.00 0.00 ATOM 1455 CD2 TYR A 187 30.049 -12.374 34.765 1.00 0.00 ATOM 1456 CE1 TYR A 187 31.727 -11.868 36.867 1.00 0.00 ATOM 1457 CE2 TYR A 187 30.992 -13.311 35.146 1.00 0.00 ATOM 1458 CZ TYR A 187 31.821 -13.066 36.206 1.00 0.00 ATOM 1459 OH TYR A 187 32.772 -14.024 36.546 1.00 0.00 ATOM 1460 O TYR A 187 28.228 -7.165 34.124 1.00 0.00 ATOM 1461 C TYR A 187 28.213 -8.290 33.622 1.00 0.00 ATOM 1462 N GLU A 188 27.203 -8.756 32.892 1.00 0.00 ATOM 1463 CA GLU A 188 25.988 -7.989 32.643 1.00 0.00 ATOM 1464 CB GLU A 188 25.004 -8.804 31.799 1.00 0.00 ATOM 1465 CG GLU A 188 25.412 -8.953 30.343 1.00 0.00 ATOM 1466 CD GLU A 188 24.414 -9.764 29.539 1.00 0.00 ATOM 1467 OE1 GLU A 188 23.420 -10.236 30.129 1.00 0.00 ATOM 1468 OE2 GLU A 188 24.627 -9.927 28.319 1.00 0.00 ATOM 1469 O GLU A 188 25.266 -8.575 34.863 1.00 0.00 ATOM 1470 C GLU A 188 25.391 -7.680 34.021 1.00 0.00 ATOM 1471 N ALA A 189 25.044 -6.415 34.256 1.00 0.00 ATOM 1472 CA ALA A 189 24.505 -5.995 35.552 1.00 0.00 ATOM 1473 CB ALA A 189 24.095 -4.531 35.506 1.00 0.00 ATOM 1474 O ALA A 189 22.955 -6.735 37.226 1.00 0.00 ATOM 1475 C ALA A 189 23.269 -6.756 36.035 1.00 0.00 ATOM 1476 N PRO A 190 22.560 -7.419 35.132 1.00 0.00 ATOM 1477 CA PRO A 190 21.370 -8.163 35.543 1.00 0.00 ATOM 1478 CB PRO A 190 20.553 -8.295 34.255 1.00 0.00 ATOM 1479 CG PRO A 190 21.575 -8.334 33.168 1.00 0.00 ATOM 1480 CD PRO A 190 22.677 -7.409 33.599 1.00 0.00 ATOM 1481 O PRO A 190 20.910 -10.114 36.872 1.00 0.00 ATOM 1482 C PRO A 190 21.736 -9.498 36.199 1.00 0.00 ATOM 1483 N LEU A 191 22.950 -9.969 36.033 1.00 0.00 ATOM 1484 CA LEU A 191 23.364 -11.228 36.633 1.00 0.00 ATOM 1485 CB LEU A 191 24.664 -11.691 35.973 1.00 0.00 ATOM 1486 CG LEU A 191 24.613 -11.921 34.461 1.00 0.00 ATOM 1487 CD1 LEU A 191 25.991 -12.279 33.924 1.00 0.00 ATOM 1488 CD2 LEU A 191 23.660 -13.057 34.122 1.00 0.00 ATOM 1489 O LEU A 191 23.320 -12.225 38.812 1.00 0.00 ATOM 1490 C LEU A 191 23.513 -11.202 38.150 1.00 0.00 ATOM 1491 N PRO A 192 23.651 -9.941 38.700 1.00 0.00 ATOM 1492 CA PRO A 192 23.828 -9.865 40.152 1.00 0.00 ATOM 1493 CB PRO A 192 24.514 -8.483 40.330 1.00 0.00 ATOM 1494 CG PRO A 192 23.937 -7.692 39.149 1.00 0.00 ATOM 1495 CD PRO A 192 24.005 -8.701 38.039 1.00 0.00 ATOM 1496 O PRO A 192 21.447 -9.645 40.416 1.00 0.00 ATOM 1497 C PRO A 192 22.516 -10.005 40.918 1.00 0.00 ATOM 1498 N ASN A 193 22.598 -10.541 42.132 1.00 0.00 ATOM 1499 CA ASN A 193 21.425 -10.695 42.990 1.00 0.00 ATOM 1500 CB ASN A 193 21.502 -12.006 43.775 1.00 0.00 ATOM 1501 CG ASN A 193 20.308 -12.212 44.686 1.00 0.00 ATOM 1502 ND2 ASN A 193 20.448 -13.120 45.646 1.00 0.00 ATOM 1503 OD1 ASN A 193 19.276 -11.561 44.528 1.00 0.00 ATOM 1504 O ASN A 193 22.171 -9.484 44.924 1.00 0.00 ATOM 1505 C ASN A 193 21.430 -9.497 43.942 1.00 0.00 ATOM 1506 N PHE A 194 20.631 -8.490 43.645 1.00 0.00 ATOM 1507 CA PHE A 194 20.574 -7.282 44.466 1.00 0.00 ATOM 1508 CB PHE A 194 20.056 -6.101 43.644 1.00 0.00 ATOM 1509 CG PHE A 194 20.990 -5.666 42.551 1.00 0.00 ATOM 1510 CD1 PHE A 194 22.309 -6.085 42.541 1.00 0.00 ATOM 1511 CD2 PHE A 194 20.549 -4.837 41.534 1.00 0.00 ATOM 1512 CE1 PHE A 194 23.167 -5.684 41.535 1.00 0.00 ATOM 1513 CE2 PHE A 194 21.408 -4.437 40.528 1.00 0.00 ATOM 1514 CZ PHE A 194 22.713 -4.857 40.525 1.00 0.00 ATOM 1515 O PHE A 194 19.524 -6.417 46.429 1.00 0.00 ATOM 1516 C PHE A 194 19.664 -7.387 45.688 1.00 0.00 ATOM 1517 N THR A 195 19.045 -8.547 45.902 1.00 0.00 ATOM 1518 CA THR A 195 18.146 -8.714 47.049 1.00 0.00 ATOM 1519 CB THR A 195 17.178 -9.893 46.839 1.00 0.00 ATOM 1520 CG2 THR A 195 16.331 -9.672 45.595 1.00 0.00 ATOM 1521 OG1 THR A 195 17.924 -11.106 46.683 1.00 0.00 ATOM 1522 O THR A 195 18.273 -8.896 49.436 1.00 0.00 ATOM 1523 C THR A 195 18.870 -8.987 48.365 1.00 0.00 ATOM 1524 N GLU A 196 20.150 -9.332 48.286 1.00 0.00 ATOM 1525 CA GLU A 196 20.942 -9.584 49.490 1.00 0.00 ATOM 1526 CB GLU A 196 21.992 -10.665 49.223 1.00 0.00 ATOM 1527 CG GLU A 196 21.410 -12.028 48.888 1.00 0.00 ATOM 1528 CD GLU A 196 22.480 -13.072 48.634 1.00 0.00 ATOM 1529 OE1 GLU A 196 23.675 -12.710 48.634 1.00 0.00 ATOM 1530 OE2 GLU A 196 22.123 -14.252 48.434 1.00 0.00 ATOM 1531 O GLU A 196 21.709 -7.376 48.967 1.00 0.00 ATOM 1532 C GLU A 196 21.636 -8.261 49.813 1.00 0.00 ATOM 1533 N PRO A 197 22.153 -8.171 51.126 1.00 0.00 ATOM 1534 CA PRO A 197 22.838 -6.936 51.525 1.00 0.00 ATOM 1535 CB PRO A 197 23.465 -7.299 52.863 1.00 0.00 ATOM 1536 CG PRO A 197 22.463 -8.284 53.445 1.00 0.00 ATOM 1537 CD PRO A 197 22.046 -9.121 52.252 1.00 0.00 ATOM 1538 O PRO A 197 24.352 -7.475 49.735 1.00 0.00 ATOM 1539 C PRO A 197 23.733 -6.592 50.339 1.00 0.00 ATOM 1540 N ALA A 198 23.764 -5.333 49.959 1.00 0.00 ATOM 1541 CA ALA A 198 24.555 -4.907 48.815 1.00 0.00 ATOM 1542 CB ALA A 198 23.853 -5.090 47.478 1.00 0.00 ATOM 1543 O ALA A 198 24.186 -2.575 49.242 1.00 0.00 ATOM 1544 C ALA A 198 24.969 -3.441 48.865 1.00 0.00 ATOM 1545 N ILE A 199 26.208 -3.177 48.471 1.00 0.00 ATOM 1546 CA ILE A 199 26.692 -1.808 48.371 1.00 0.00 ATOM 1547 CB ILE A 199 27.951 -1.589 49.232 1.00 0.00 ATOM 1548 CG1 ILE A 199 27.676 -1.979 50.686 1.00 0.00 ATOM 1549 CG2 ILE A 199 28.375 -0.130 49.195 1.00 0.00 ATOM 1550 CD1 ILE A 199 26.581 -1.165 51.339 1.00 0.00 ATOM 1551 O ILE A 199 27.891 -2.303 46.361 1.00 0.00 ATOM 1552 C ILE A 199 26.998 -1.641 46.882 1.00 0.00 ATOM 1553 N LEU A 200 26.232 -0.795 46.198 1.00 0.00 ATOM 1554 CA LEU A 200 26.462 -0.538 44.777 1.00 0.00 ATOM 1555 CB LEU A 200 25.145 -0.208 44.073 1.00 0.00 ATOM 1556 CG LEU A 200 24.071 -1.298 44.099 1.00 0.00 ATOM 1557 CD1 LEU A 200 22.782 -0.797 43.463 1.00 0.00 ATOM 1558 CD2 LEU A 200 24.533 -2.527 43.333 1.00 0.00 ATOM 1559 O LEU A 200 27.111 1.737 45.136 1.00 0.00 ATOM 1560 C LEU A 200 27.419 0.646 44.658 1.00 0.00 ATOM 1561 N VAL A 201 28.564 0.446 44.018 1.00 0.00 ATOM 1562 CA VAL A 201 29.536 1.524 43.855 1.00 0.00 ATOM 1563 CB VAL A 201 30.956 1.066 44.232 1.00 0.00 ATOM 1564 CG1 VAL A 201 31.955 2.194 44.020 1.00 0.00 ATOM 1565 CG2 VAL A 201 31.011 0.646 45.693 1.00 0.00 ATOM 1566 O VAL A 201 29.747 1.196 41.503 1.00 0.00 ATOM 1567 C VAL A 201 29.551 2.002 42.407 1.00 0.00 ATOM 1568 N LEU A 202 29.315 3.296 42.211 1.00 0.00 ATOM 1569 CA LEU A 202 29.317 3.887 40.873 1.00 0.00 ATOM 1570 CB LEU A 202 27.921 4.405 40.522 1.00 0.00 ATOM 1571 CG LEU A 202 26.800 3.363 40.488 1.00 0.00 ATOM 1572 CD1 LEU A 202 25.446 4.036 40.327 1.00 0.00 ATOM 1573 CD2 LEU A 202 26.995 2.402 39.326 1.00 0.00 ATOM 1574 O LEU A 202 30.665 5.502 41.985 1.00 0.00 ATOM 1575 C LEU A 202 30.286 5.063 40.888 1.00 0.00 ATOM 1576 N GLY A 203 30.704 5.514 39.721 1.00 0.00 ATOM 1577 CA GLY A 203 31.643 6.653 39.766 1.00 0.00 ATOM 1578 O GLY A 203 31.456 6.777 37.369 1.00 0.00 ATOM 1579 C GLY A 203 31.954 7.231 38.393 1.00 0.00 ATOM 1580 N SER A 204 33.030 8.112 38.621 1.00 0.00 ATOM 1581 CA SER A 204 33.443 8.801 37.400 1.00 0.00 ATOM 1582 CB SER A 204 33.153 10.303 37.434 1.00 0.00 ATOM 1583 OG SER A 204 31.760 10.552 37.475 1.00 0.00 ATOM 1584 O SER A 204 35.568 9.524 36.593 1.00 0.00 ATOM 1585 C SER A 204 34.944 8.652 37.199 1.00 0.00 ATOM 1586 N GLU A 205 35.526 7.561 37.687 1.00 0.00 ATOM 1587 CA GLU A 205 36.954 7.349 37.465 1.00 0.00 ATOM 1588 CB GLU A 205 37.522 6.395 38.517 1.00 0.00 ATOM 1589 CG GLU A 205 37.519 6.954 39.930 1.00 0.00 ATOM 1590 CD GLU A 205 38.495 8.102 40.105 1.00 0.00 ATOM 1591 OE1 GLU A 205 39.332 8.312 39.203 1.00 0.00 ATOM 1592 OE2 GLU A 205 38.421 8.791 41.145 1.00 0.00 ATOM 1593 O GLU A 205 35.991 6.420 35.479 1.00 0.00 ATOM 1594 C GLU A 205 37.023 6.752 36.063 1.00 0.00 ATOM 1595 N GLY A 206 38.228 6.629 35.520 1.00 0.00 ATOM 1596 CA GLY A 206 38.418 6.114 34.167 1.00 0.00 ATOM 1597 O GLY A 206 36.907 4.920 32.729 1.00 0.00 ATOM 1598 C GLY A 206 37.551 4.914 33.782 1.00 0.00 ATOM 1599 N ARG A 207 37.532 3.888 34.626 1.00 0.00 ATOM 1600 CA ARG A 207 36.738 2.698 34.330 1.00 0.00 ATOM 1601 CB ARG A 207 37.583 1.434 34.500 1.00 0.00 ATOM 1602 CG ARG A 207 38.741 1.325 33.521 1.00 0.00 ATOM 1603 CD ARG A 207 39.490 0.015 33.695 1.00 0.00 ATOM 1604 NE ARG A 207 40.523 -0.164 32.677 1.00 0.00 ATOM 1605 CZ ARG A 207 41.406 -1.158 32.676 1.00 0.00 ATOM 1606 NH1 ARG A 207 42.309 -1.241 31.710 1.00 0.00 ATOM 1607 NH2 ARG A 207 41.382 -2.067 33.641 1.00 0.00 ATOM 1608 O ARG A 207 34.950 1.481 35.351 1.00 0.00 ATOM 1609 C ARG A 207 35.464 2.575 35.174 1.00 0.00 ATOM 1610 N GLY A 208 34.854 3.717 35.797 1.00 0.00 ATOM 1611 CA GLY A 208 33.621 3.667 36.568 1.00 0.00 ATOM 1612 O GLY A 208 34.131 5.147 38.383 1.00 0.00 ATOM 1613 C GLY A 208 34.092 3.983 37.972 1.00 0.00 ATOM 1614 N ILE A 209 34.447 2.943 38.716 1.00 0.00 ATOM 1615 CA ILE A 209 34.965 3.124 40.061 1.00 0.00 ATOM 1616 CB ILE A 209 34.517 1.985 40.996 1.00 0.00 ATOM 1617 CG1 ILE A 209 35.087 0.649 40.520 1.00 0.00 ATOM 1618 CG2 ILE A 209 32.999 1.882 41.020 1.00 0.00 ATOM 1619 CD1 ILE A 209 34.914 -0.479 41.514 1.00 0.00 ATOM 1620 O ILE A 209 37.028 2.803 38.869 1.00 0.00 ATOM 1621 C ILE A 209 36.488 3.130 39.925 1.00 0.00 ATOM 1622 N SER A 210 37.177 3.506 40.992 1.00 0.00 ATOM 1623 CA SER A 210 38.633 3.534 40.964 1.00 0.00 ATOM 1624 CB SER A 210 39.177 4.333 42.150 1.00 0.00 ATOM 1625 OG SER A 210 38.923 3.667 43.374 1.00 0.00 ATOM 1626 O SER A 210 38.475 1.173 41.382 1.00 0.00 ATOM 1627 C SER A 210 39.188 2.117 41.038 1.00 0.00 ATOM 1628 N PRO A 211 40.474 1.945 40.695 1.00 0.00 ATOM 1629 CA PRO A 211 41.072 0.611 40.754 1.00 0.00 ATOM 1630 CB PRO A 211 42.456 0.797 40.133 1.00 0.00 ATOM 1631 CG PRO A 211 42.749 2.251 40.300 1.00 0.00 ATOM 1632 CD PRO A 211 41.427 2.957 40.182 1.00 0.00 ATOM 1633 O PRO A 211 41.077 -1.042 42.506 1.00 0.00 ATOM 1634 C PRO A 211 41.149 0.154 42.214 1.00 0.00 ATOM 1635 N GLU A 212 41.299 1.114 43.122 1.00 0.00 ATOM 1636 CA GLU A 212 41.381 0.815 44.549 1.00 0.00 ATOM 1637 CB GLU A 212 41.586 2.099 45.354 1.00 0.00 ATOM 1638 CG GLU A 212 42.962 2.725 45.188 1.00 0.00 ATOM 1639 CD GLU A 212 43.087 4.057 45.900 1.00 0.00 ATOM 1640 OE1 GLU A 212 42.076 4.527 46.463 1.00 0.00 ATOM 1641 OE2 GLU A 212 44.196 4.630 45.895 1.00 0.00 ATOM 1642 O GLU A 212 40.102 -0.838 45.743 1.00 0.00 ATOM 1643 C GLU A 212 40.086 0.146 45.001 1.00 0.00 ATOM 1644 N VAL A 213 38.962 0.677 44.538 1.00 0.00 ATOM 1645 CA VAL A 213 37.665 0.124 44.897 1.00 0.00 ATOM 1646 CB VAL A 213 36.517 1.064 44.490 1.00 0.00 ATOM 1647 CG1 VAL A 213 35.172 0.386 44.703 1.00 0.00 ATOM 1648 CG2 VAL A 213 36.550 2.338 45.320 1.00 0.00 ATOM 1649 O VAL A 213 36.945 -2.164 44.893 1.00 0.00 ATOM 1650 C VAL A 213 37.377 -1.223 44.232 1.00 0.00 ATOM 1651 N ALA A 214 37.627 -1.324 42.930 1.00 0.00 ATOM 1652 CA ALA A 214 37.339 -2.564 42.231 1.00 0.00 ATOM 1653 CB ALA A 214 37.696 -2.436 40.758 1.00 0.00 ATOM 1654 O ALA A 214 37.693 -4.892 42.697 1.00 0.00 ATOM 1655 C ALA A 214 38.129 -3.747 42.796 1.00 0.00 ATOM 1656 N ALA A 215 39.274 -3.462 43.409 1.00 0.00 ATOM 1657 CA ALA A 215 40.110 -4.506 43.993 1.00 0.00 ATOM 1658 CB ALA A 215 41.377 -3.905 44.583 1.00 0.00 ATOM 1659 O ALA A 215 39.734 -6.436 45.362 1.00 0.00 ATOM 1660 C ALA A 215 39.414 -5.275 45.115 1.00 0.00 ATOM 1661 N GLU A 216 38.464 -4.628 45.784 1.00 0.00 ATOM 1662 CA GLU A 216 37.747 -5.266 46.883 1.00 0.00 ATOM 1663 CB GLU A 216 37.645 -4.317 48.079 1.00 0.00 ATOM 1664 CG GLU A 216 38.987 -3.858 48.623 1.00 0.00 ATOM 1665 CD GLU A 216 39.835 -5.009 49.127 1.00 0.00 ATOM 1666 OE1 GLU A 216 39.307 -5.851 49.881 1.00 0.00 ATOM 1667 OE2 GLU A 216 41.030 -5.067 48.767 1.00 0.00 ATOM 1668 O GLU A 216 35.602 -6.230 47.367 1.00 0.00 ATOM 1669 C GLU A 216 36.318 -5.684 46.530 1.00 0.00 ATOM 1670 N ILE A 217 35.908 -5.442 45.291 1.00 0.00 ATOM 1671 CA ILE A 217 34.554 -5.783 44.857 1.00 0.00 ATOM 1672 CB ILE A 217 34.237 -5.185 43.474 1.00 0.00 ATOM 1673 CG1 ILE A 217 35.190 -5.749 42.418 1.00 0.00 ATOM 1674 CG2 ILE A 217 34.389 -3.671 43.501 1.00 0.00 ATOM 1675 CD1 ILE A 217 34.824 -5.369 41.001 1.00 0.00 ATOM 1676 O ILE A 217 35.200 -8.052 44.411 1.00 0.00 ATOM 1677 C ILE A 217 34.299 -7.283 44.734 1.00 0.00 ATOM 1678 N THR A 218 33.060 -7.685 44.997 1.00 0.00 ATOM 1679 CA THR A 218 32.647 -9.080 44.893 1.00 0.00 ATOM 1680 CB THR A 218 31.508 -9.407 45.878 1.00 0.00 ATOM 1681 CG2 THR A 218 31.951 -9.142 47.309 1.00 0.00 ATOM 1682 OG1 THR A 218 30.370 -8.586 45.586 1.00 0.00 ATOM 1683 O THR A 218 32.302 -10.413 42.922 1.00 0.00 ATOM 1684 C THR A 218 32.163 -9.318 43.467 1.00 0.00 ATOM 1685 N ASP A 219 31.588 -8.278 42.875 1.00 0.00 ATOM 1686 CA ASP A 219 31.087 -8.348 41.508 1.00 0.00 ATOM 1687 CB ASP A 219 29.932 -8.650 41.096 1.00 0.00 ATOM 1688 CG ASP A 219 30.061 -10.116 40.710 1.00 0.00 ATOM 1689 OD1 ASP A 219 31.142 -10.523 40.233 1.00 0.00 ATOM 1690 OD2 ASP A 219 29.041 -10.838 40.866 1.00 0.00 ATOM 1691 O ASP A 219 31.481 -5.993 41.256 1.00 0.00 ATOM 1692 C ASP A 219 31.522 -7.107 40.731 1.00 0.00 ATOM 1693 N ARG A 220 31.953 -7.315 39.489 1.00 0.00 ATOM 1694 CA ARG A 220 32.360 -6.223 38.608 1.00 0.00 ATOM 1695 CB ARG A 220 33.783 -6.454 38.091 1.00 0.00 ATOM 1696 CG ARG A 220 34.846 -6.443 39.176 1.00 0.00 ATOM 1697 CD ARG A 220 36.201 -6.855 38.625 1.00 0.00 ATOM 1698 NE ARG A 220 37.266 -6.695 39.613 1.00 0.00 ATOM 1699 CZ ARG A 220 37.585 -7.611 40.522 1.00 0.00 ATOM 1700 NH1 ARG A 220 38.568 -7.379 41.380 1.00 0.00 ATOM 1701 NH2 ARG A 220 36.920 -8.758 40.569 1.00 0.00 ATOM 1702 O ARG A 220 31.271 -7.231 36.738 1.00 0.00 ATOM 1703 C ARG A 220 31.342 -6.254 37.476 1.00 0.00 ATOM 1704 N LEU A 221 30.577 -5.179 37.319 1.00 0.00 ATOM 1705 CA LEU A 221 29.526 -5.155 36.307 1.00 0.00 ATOM 1706 CB LEU A 221 28.159 -4.936 36.959 1.00 0.00 ATOM 1707 CG LEU A 221 27.726 -5.979 37.991 1.00 0.00 ATOM 1708 CD1 LEU A 221 26.416 -5.573 38.648 1.00 0.00 ATOM 1709 CD2 LEU A 221 27.526 -7.335 37.333 1.00 0.00 ATOM 1710 O LEU A 221 30.238 -3.057 35.367 1.00 0.00 ATOM 1711 C LEU A 221 29.606 -4.100 35.216 1.00 0.00 ATOM 1712 N THR A 222 28.939 -4.394 34.106 1.00 0.00 ATOM 1713 CA THR A 222 28.860 -3.471 32.983 1.00 0.00 ATOM 1714 CB THR A 222 29.857 -3.839 31.869 1.00 0.00 ATOM 1715 CG2 THR A 222 29.465 -5.154 31.215 1.00 0.00 ATOM 1716 OG1 THR A 222 29.864 -2.809 30.872 1.00 0.00 ATOM 1717 O THR A 222 26.749 -4.549 32.677 1.00 0.00 ATOM 1718 C THR A 222 27.446 -3.553 32.452 1.00 0.00 ATOM 1719 N ILE A 223 27.035 -2.511 31.743 1.00 0.00 ATOM 1720 CA ILE A 223 25.722 -2.461 31.120 1.00 0.00 ATOM 1721 CB ILE A 223 25.024 -1.112 31.382 1.00 0.00 ATOM 1722 CG1 ILE A 223 24.816 -0.903 32.883 1.00 0.00 ATOM 1723 CG2 ILE A 223 23.667 -1.074 30.698 1.00 0.00 ATOM 1724 CD1 ILE A 223 24.349 0.489 33.247 1.00 0.00 ATOM 1725 O ILE A 223 26.875 -1.994 29.069 1.00 0.00 ATOM 1726 C ILE A 223 26.002 -2.655 29.628 1.00 0.00 ATOM 1727 N PRO A 224 25.281 -3.576 28.966 1.00 0.00 ATOM 1728 CA PRO A 224 25.516 -3.807 27.536 1.00 0.00 ATOM 1729 CB PRO A 224 24.479 -4.867 27.157 1.00 0.00 ATOM 1730 CG PRO A 224 24.186 -5.578 28.436 1.00 0.00 ATOM 1731 CD PRO A 224 24.225 -4.529 29.513 1.00 0.00 ATOM 1732 O PRO A 224 24.421 -1.772 26.853 1.00 0.00 ATOM 1733 C PRO A 224 25.345 -2.560 26.677 1.00 0.00 ATOM 1734 N ALA A 225 26.364 -2.453 25.678 1.00 0.00 ATOM 1735 CA ALA A 225 26.370 -1.268 24.822 1.00 0.00 ATOM 1736 CB ALA A 225 27.370 -1.470 23.695 1.00 0.00 ATOM 1737 O ALA A 225 24.663 0.233 23.963 1.00 0.00 ATOM 1738 C ALA A 225 25.051 -0.934 24.117 1.00 0.00 ATOM 1739 N SER A 226 24.310 -1.965 23.730 1.00 0.00 ATOM 1740 CA SER A 226 23.091 -1.774 22.940 1.00 0.00 ATOM 1741 CB SER A 226 22.483 -3.125 22.559 1.00 0.00 ATOM 1742 OG SER A 226 22.029 -3.822 23.707 1.00 0.00 ATOM 1743 O SER A 226 21.186 -0.360 22.988 1.00 0.00 ATOM 1744 C SER A 226 21.996 -1.008 23.649 1.00 0.00 ATOM 1745 N GLY A 227 21.945 -1.106 24.974 1.00 0.00 ATOM 1746 CA GLY A 227 20.911 -0.419 25.749 1.00 0.00 ATOM 1747 O GLY A 227 20.746 0.847 27.787 1.00 0.00 ATOM 1748 C GLY A 227 21.481 0.514 26.836 1.00 0.00 ATOM 1749 N LEU A 228 22.745 0.858 26.786 1.00 0.00 ATOM 1750 CA LEU A 228 23.381 1.757 27.718 1.00 0.00 ATOM 1751 CB LEU A 228 24.864 1.933 27.383 1.00 0.00 ATOM 1752 CG LEU A 228 25.676 2.806 28.342 1.00 0.00 ATOM 1753 CD1 LEU A 228 25.746 2.169 29.721 1.00 0.00 ATOM 1754 CD2 LEU A 228 27.096 2.988 27.829 1.00 0.00 ATOM 1755 O LEU A 228 22.617 3.704 26.552 1.00 0.00 ATOM 1756 C LEU A 228 22.696 3.126 27.629 1.00 0.00 ATOM 1757 N SER A 229 22.191 3.619 28.755 1.00 0.00 ATOM 1758 CA SER A 229 21.545 4.922 28.807 1.00 0.00 ATOM 1759 CB SER A 229 22.411 5.978 28.118 1.00 0.00 ATOM 1760 OG SER A 229 23.661 6.117 28.770 1.00 0.00 ATOM 1761 O SER A 229 19.619 6.122 28.045 1.00 0.00 ATOM 1762 C SER A 229 20.181 5.022 28.142 1.00 0.00 ATOM 1763 N VAL A 230 19.622 3.886 27.725 1.00 0.00 ATOM 1764 CA VAL A 230 18.382 3.862 26.939 1.00 0.00 ATOM 1765 CB VAL A 230 18.574 3.109 25.609 1.00 0.00 ATOM 1766 CG1 VAL A 230 19.603 3.816 24.740 1.00 0.00 ATOM 1767 CG2 VAL A 230 19.055 1.688 25.864 1.00 0.00 ATOM 1768 O VAL A 230 16.130 3.086 27.123 1.00 0.00 ATOM 1769 C VAL A 230 17.229 3.176 27.660 1.00 0.00 ATOM 1770 N LYS A 231 17.502 2.684 28.866 1.00 0.00 ATOM 1771 CA LYS A 231 16.546 1.854 29.589 1.00 0.00 ATOM 1772 CB LYS A 231 17.066 0.419 29.710 1.00 0.00 ATOM 1773 CG LYS A 231 17.219 -0.300 28.379 1.00 0.00 ATOM 1774 CD LYS A 231 17.760 -1.707 28.572 1.00 0.00 ATOM 1775 CE LYS A 231 18.114 -2.350 27.241 1.00 0.00 ATOM 1776 NZ LYS A 231 18.629 -3.736 27.412 1.00 0.00 ATOM 1777 O LYS A 231 15.570 1.647 31.766 1.00 0.00 ATOM 1778 C LYS A 231 16.257 2.336 31.010 1.00 0.00 ATOM 1779 N GLY A 232 16.761 3.516 31.369 1.00 0.00 ATOM 1780 CA GLY A 232 16.556 4.031 32.714 1.00 0.00 ATOM 1781 O GLY A 232 15.487 5.874 31.601 1.00 0.00 ATOM 1782 C GLY A 232 15.891 5.397 32.668 1.00 0.00 ATOM 1783 N HIS A 233 15.905 6.047 33.905 1.00 0.00 ATOM 1784 CA HIS A 233 15.282 7.360 34.020 1.00 0.00 ATOM 1785 CB HIS A 233 15.301 7.816 35.481 1.00 0.00 ATOM 1786 CG HIS A 233 14.488 6.951 36.395 1.00 0.00 ATOM 1787 CD2 HIS A 233 14.780 6.032 37.485 1.00 0.00 ATOM 1788 ND1 HIS A 233 13.114 6.883 36.329 1.00 0.00 ATOM 1789 CE1 HIS A 233 12.672 6.029 37.268 1.00 0.00 ATOM 1790 NE2 HIS A 233 13.667 5.514 37.966 1.00 0.00 ATOM 1791 O HIS A 233 15.197 9.315 32.645 1.00 0.00 ATOM 1792 C HIS A 233 15.907 8.467 33.184 1.00 0.00 ATOM 1793 N THR A 234 17.228 8.439 33.045 1.00 0.00 ATOM 1794 CA THR A 234 17.922 9.459 32.268 1.00 0.00 ATOM 1795 CB THR A 234 19.447 9.243 32.287 1.00 0.00 ATOM 1796 CG2 THR A 234 20.150 10.337 31.498 1.00 0.00 ATOM 1797 OG1 THR A 234 19.919 9.271 33.641 1.00 0.00 ATOM 1798 O THR A 234 17.260 8.355 30.246 1.00 0.00 ATOM 1799 C THR A 234 17.460 9.424 30.818 1.00 0.00 ATOM 1800 N GLU A 235 17.259 10.604 30.240 1.00 0.00 ATOM 1801 CA GLU A 235 16.821 10.714 28.855 1.00 0.00 ATOM 1802 CB GLU A 235 16.067 12.028 28.633 1.00 0.00 ATOM 1803 CG GLU A 235 14.764 12.134 29.410 1.00 0.00 ATOM 1804 CD GLU A 235 14.052 13.450 29.173 1.00 0.00 ATOM 1805 OE1 GLU A 235 14.563 14.270 28.381 1.00 0.00 ATOM 1806 OE2 GLU A 235 12.980 13.663 29.779 1.00 0.00 ATOM 1807 O GLU A 235 17.848 10.407 26.700 1.00 0.00 ATOM 1808 C GLU A 235 18.008 10.682 27.891 1.00 0.00 ATOM 1809 N SER A 236 19.194 10.993 28.401 1.00 0.00 ATOM 1810 CA SER A 236 20.386 11.000 27.563 1.00 0.00 ATOM 1811 CB SER A 236 21.203 12.270 27.803 1.00 0.00 ATOM 1812 OG SER A 236 21.672 12.331 29.138 1.00 0.00 ATOM 1813 O SER A 236 20.636 9.046 28.941 1.00 0.00 ATOM 1814 C SER A 236 21.097 9.732 28.030 1.00 0.00 ATOM 1815 N LEU A 237 22.433 9.345 27.479 1.00 0.00 ATOM 1816 CA LEU A 237 23.170 8.142 27.811 1.00 0.00 ATOM 1817 CB LEU A 237 24.089 7.800 26.562 1.00 0.00 ATOM 1818 CG LEU A 237 23.421 7.572 25.192 1.00 0.00 ATOM 1819 CD1 LEU A 237 24.493 7.194 24.179 1.00 0.00 ATOM 1820 CD2 LEU A 237 22.314 6.504 25.228 1.00 0.00 ATOM 1821 O LEU A 237 23.996 7.177 29.838 1.00 0.00 ATOM 1822 C LEU A 237 23.912 8.184 29.149 1.00 0.00 ATOM 1823 N ASN A 238 24.379 9.359 29.539 1.00 0.00 ATOM 1824 CA ASN A 238 25.119 9.487 30.788 1.00 0.00 ATOM 1825 CB ASN A 238 25.794 10.858 30.872 1.00 0.00 ATOM 1826 CG ASN A 238 26.776 10.954 32.022 1.00 0.00 ATOM 1827 ND2 ASN A 238 27.028 12.174 32.483 1.00 0.00 ATOM 1828 OD1 ASN A 238 27.300 9.943 32.490 1.00 0.00 ATOM 1829 O ASN A 238 24.780 9.012 33.117 1.00 0.00 ATOM 1830 C ASN A 238 24.267 9.352 32.047 1.00 0.00 ATOM 1831 N VAL A 239 26.947 8.637 34.155 1.00 0.00 ATOM 1832 CA VAL A 239 26.898 7.947 35.450 1.00 0.00 ATOM 1833 CB VAL A 239 27.839 8.606 36.476 1.00 0.00 ATOM 1834 CG1 VAL A 239 27.627 8.005 37.856 1.00 0.00 ATOM 1835 CG2 VAL A 239 29.291 8.394 36.078 1.00 0.00 ATOM 1836 O VAL A 239 25.144 6.916 36.736 1.00 0.00 ATOM 1837 C VAL A 239 25.519 7.919 36.123 1.00 0.00 ATOM 1838 N ALA A 240 24.758 9.003 36.009 1.00 0.00 ATOM 1839 CA ALA A 240 23.435 9.053 36.629 1.00 0.00 ATOM 1840 CB ALA A 240 22.872 10.464 36.562 1.00 0.00 ATOM 1841 O ALA A 240 21.681 7.419 36.552 1.00 0.00 ATOM 1842 C ALA A 240 22.475 8.106 35.917 1.00 0.00 ATOM 1843 N ILE A 241 22.536 8.092 34.591 1.00 0.00 ATOM 1844 CA ILE A 241 21.674 7.204 33.822 1.00 0.00 ATOM 1845 CB ILE A 241 21.772 7.364 32.330 1.00 0.00 ATOM 1846 CG1 ILE A 241 20.722 6.479 31.646 1.00 0.00 ATOM 1847 CG2 ILE A 241 23.151 6.967 31.814 1.00 0.00 ATOM 1848 CD1 ILE A 241 19.292 6.751 32.096 1.00 0.00 ATOM 1849 O ILE A 241 21.079 4.945 34.363 1.00 0.00 ATOM 1850 C ILE A 241 21.989 5.742 34.138 1.00 0.00 ATOM 1851 N ALA A 242 23.274 5.395 34.170 1.00 0.00 ATOM 1852 CA ALA A 242 23.676 4.018 34.467 1.00 0.00 ATOM 1853 CB ALA A 242 25.191 3.886 34.418 1.00 0.00 ATOM 1854 O ALA A 242 22.732 2.499 36.066 1.00 0.00 ATOM 1855 C ALA A 242 23.199 3.618 35.857 1.00 0.00 ATOM 1856 N THR A 243 23.290 4.546 36.754 1.00 0.00 ATOM 1857 CA THR A 243 22.854 4.284 38.120 1.00 0.00 ATOM 1858 CB THR A 243 23.097 5.501 39.032 1.00 0.00 ATOM 1859 CG2 THR A 243 22.598 5.219 40.440 1.00 0.00 ATOM 1860 OG1 THR A 243 24.501 5.788 39.085 1.00 0.00 ATOM 1861 O THR A 243 20.934 3.045 38.851 1.00 0.00 ATOM 1862 C THR A 243 21.364 3.964 38.153 1.00 0.00 ATOM 1863 N ALA A 244 20.577 4.715 37.390 1.00 0.00 ATOM 1864 CA ALA A 244 19.148 4.461 37.351 1.00 0.00 ATOM 1865 CB ALA A 244 18.441 5.535 36.539 1.00 0.00 ATOM 1866 O ALA A 244 17.922 2.407 37.170 1.00 0.00 ATOM 1867 C ALA A 244 18.822 3.115 36.721 1.00 0.00 ATOM 1868 N ILE A 245 19.534 2.770 35.654 1.00 0.00 ATOM 1869 CA ILE A 245 19.301 1.499 34.968 1.00 0.00 ATOM 1870 CB ILE A 245 20.218 1.344 33.739 1.00 0.00 ATOM 1871 CG1 ILE A 245 19.837 2.359 32.660 1.00 0.00 ATOM 1872 CG2 ILE A 245 20.091 -0.053 33.153 1.00 0.00 ATOM 1873 CD1 ILE A 245 20.846 2.463 31.537 1.00 0.00 ATOM 1874 O ILE A 245 18.776 -0.610 36.009 1.00 0.00 ATOM 1875 C ILE A 245 19.574 0.328 35.907 1.00 0.00 ATOM 1876 N LEU A 246 20.704 0.388 36.603 1.00 0.00 ATOM 1877 CA LEU A 246 21.067 -0.683 37.519 1.00 0.00 ATOM 1878 CB LEU A 246 22.487 -0.476 38.048 1.00 0.00 ATOM 1879 CG LEU A 246 23.002 -1.523 39.039 1.00 0.00 ATOM 1880 CD1 LEU A 246 23.033 -2.901 38.394 1.00 0.00 ATOM 1881 CD2 LEU A 246 24.410 -1.182 39.500 1.00 0.00 ATOM 1882 O LEU A 246 19.705 -1.821 39.126 1.00 0.00 ATOM 1883 C LEU A 246 20.128 -0.742 38.719 1.00 0.00 ATOM 1884 N CYS A 247 19.807 0.400 39.293 1.00 0.00 ATOM 1885 CA CYS A 247 18.916 0.438 40.446 1.00 0.00 ATOM 1886 CB CYS A 247 18.782 1.858 41.002 1.00 0.00 ATOM 1887 SG CYS A 247 20.275 2.490 41.801 1.00 0.00 ATOM 1888 O CYS A 247 16.869 -0.718 40.935 1.00 0.00 ATOM 1889 C CYS A 247 17.519 -0.076 40.105 1.00 0.00 ATOM 1890 N SER A 248 17.008 0.185 38.858 1.00 0.00 ATOM 1891 CA SER A 248 15.689 -0.285 38.445 1.00 0.00 ATOM 1892 CB SER A 248 15.253 0.449 37.176 1.00 0.00 ATOM 1893 OG SER A 248 16.131 0.173 36.100 1.00 0.00 ATOM 1894 O SER A 248 14.779 -2.497 38.607 1.00 0.00 ATOM 1895 C SER A 248 15.766 -1.809 38.324 1.00 0.00 ATOM 1896 N GLU A 249 16.917 -2.298 37.917 1.00 0.00 ATOM 1897 CA GLU A 249 17.081 -3.747 37.797 1.00 0.00 ATOM 1898 CB GLU A 249 18.464 -4.098 37.242 1.00 0.00 ATOM 1899 CG GLU A 249 18.708 -3.599 35.828 1.00 0.00 ATOM 1900 CD GLU A 249 20.109 -3.910 35.335 1.00 0.00 ATOM 1901 OE1 GLU A 249 20.907 -4.462 36.122 1.00 0.00 ATOM 1902 OE2 GLU A 249 20.408 -3.602 34.162 1.00 0.00 ATOM 1903 O GLU A 249 16.181 -5.312 39.405 1.00 0.00 ATOM 1904 C GLU A 249 16.860 -4.300 39.211 1.00 0.00 ATOM 1905 N TRP A 250 17.403 -3.594 40.206 1.00 0.00 ATOM 1906 CA TRP A 250 17.264 -4.018 41.597 1.00 0.00 ATOM 1907 CB TRP A 250 18.040 -3.078 42.523 1.00 0.00 ATOM 1908 CG TRP A 250 17.958 -3.461 43.969 1.00 0.00 ATOM 1909 CD1 TRP A 250 18.752 -4.356 44.627 1.00 0.00 ATOM 1910 CD2 TRP A 250 17.033 -2.957 44.939 1.00 0.00 ATOM 1911 CE2 TRP A 250 17.323 -3.592 46.162 1.00 0.00 ATOM 1912 CE3 TRP A 250 15.986 -2.031 44.892 1.00 0.00 ATOM 1913 NE1 TRP A 250 18.377 -4.443 45.945 1.00 0.00 ATOM 1914 CZ2 TRP A 250 16.605 -3.331 47.329 1.00 0.00 ATOM 1915 CZ3 TRP A 250 15.276 -1.775 46.052 1.00 0.00 ATOM 1916 CH2 TRP A 250 15.587 -2.421 47.253 1.00 0.00 ATOM 1917 O TRP A 250 15.288 -4.881 42.688 1.00 0.00 ATOM 1918 C TRP A 250 15.783 -3.992 41.983 1.00 0.00 ATOM 1919 N ARG A 251 15.078 -2.963 41.520 1.00 0.00 ATOM 1920 CA ARG A 251 13.651 -2.814 41.796 1.00 0.00 ATOM 1921 CB ARG A 251 13.121 -1.517 41.184 1.00 0.00 ATOM 1922 CG ARG A 251 11.654 -1.244 41.480 1.00 0.00 ATOM 1923 CD ARG A 251 11.170 0.007 40.767 1.00 0.00 ATOM 1924 NE ARG A 251 11.174 -0.154 39.315 1.00 0.00 ATOM 1925 CZ ARG A 251 10.247 -0.818 38.633 1.00 0.00 ATOM 1926 NH1 ARG A 251 10.333 -0.912 37.314 1.00 0.00 ATOM 1927 NH2 ARG A 251 9.235 -1.387 39.274 1.00 0.00 ATOM 1928 O ARG A 251 12.013 -4.609 41.818 1.00 0.00 ATOM 1929 C ARG A 251 12.887 -4.016 41.182 1.00 0.00 ATOM 1930 N ARG A 252 13.200 -4.311 39.943 1.00 0.00 ATOM 1931 CA ARG A 252 12.524 -5.419 39.273 1.00 0.00 ATOM 1932 CB ARG A 252 13.089 -5.619 37.865 1.00 0.00 ATOM 1933 CG ARG A 252 12.719 -4.517 36.886 1.00 0.00 ATOM 1934 CD ARG A 252 13.351 -4.755 35.523 1.00 0.00 ATOM 1935 NE ARG A 252 13.046 -3.679 34.584 1.00 0.00 ATOM 1936 CZ ARG A 252 13.520 -3.612 33.343 1.00 0.00 ATOM 1937 NH1 ARG A 252 13.187 -2.596 32.560 1.00 0.00 ATOM 1938 NH2 ARG A 252 14.325 -4.564 32.890 1.00 0.00 ATOM 1939 O ARG A 252 11.730 -7.457 40.261 1.00 0.00 ATOM 1940 C ARG A 252 12.695 -6.732 40.032 1.00 0.00 ATOM 1941 N ARG A 253 13.968 -6.973 40.508 1.00 0.00 ATOM 1942 CA ARG A 253 14.243 -8.219 41.213 1.00 0.00 ATOM 1943 CB ARG A 253 15.743 -8.370 41.469 1.00 0.00 ATOM 1944 CG ARG A 253 16.135 -9.697 42.100 1.00 0.00 ATOM 1945 CD ARG A 253 17.632 -9.774 42.339 1.00 0.00 ATOM 1946 NE ARG A 253 18.390 -9.728 41.091 1.00 0.00 ATOM 1947 CZ ARG A 253 18.599 -10.779 40.304 1.00 0.00 ATOM 1948 NH1 ARG A 253 19.299 -10.643 39.187 1.00 0.00 ATOM 1949 NH2 ARG A 253 18.106 -11.965 40.638 1.00 0.00 ATOM 1950 O ARG A 253 12.877 -9.266 42.884 1.00 0.00 ATOM 1951 C ARG A 253 13.533 -8.275 42.562 1.00 0.00 ATOM 1952 N SER A 254 13.642 -7.213 43.350 1.00 0.00 ATOM 1953 CA SER A 254 13.005 -7.155 44.662 1.00 0.00 ATOM 1954 CB SER A 254 14.043 -6.792 45.727 1.00 0.00 ATOM 1955 OG SER A 254 13.434 -6.607 46.991 1.00 0.00 ATOM 1956 O SER A 254 12.038 -5.013 45.156 1.00 0.00 ATOM 1957 C SER A 254 11.880 -6.127 44.651 1.00 0.00 ENDMDL EXPDTA 2i6dA MODEL 2 REMARK 44 REMARK 44 model 2 is called 2i6dA ATOM 1 N MET 1 -3.220 34.931 51.119 1.00 0.00 ATOM 2 CA MET 1 -1.936 35.574 50.810 1.00 0.00 ATOM 3 CB MET 1 -1.962 37.090 51.117 1.00 0.00 ATOM 4 CG MET 1 -2.966 37.942 50.306 1.00 0.00 ATOM 5 SD MET 1 -2.937 39.885 50.726 1.00 0.00 ATOM 6 CE MET 1 -4.728 40.426 50.112 1.00 0.00 ATOM 7 O MET 1 -1.019 34.679 52.821 1.00 0.00 ATOM 8 C MET 1 -0.843 34.898 51.632 1.00 0.00 ATOM 9 N LEU 2 0.272 34.551 50.997 1.00 0.00 ATOM 10 CA LEU 2 1.491 34.178 51.718 1.00 0.00 ATOM 11 CB LEU 2 2.519 33.569 50.760 1.00 0.00 ATOM 12 CG LEU 2 2.192 32.207 50.169 1.00 0.00 ATOM 13 CD1 LEU 2 3.212 31.866 49.094 1.00 0.00 ATOM 14 CD2 LEU 2 2.196 31.158 51.270 1.00 0.00 ATOM 15 O LEU 2 2.224 36.441 51.733 1.00 0.00 ATOM 16 C LEU 2 2.129 35.400 52.363 1.00 0.00 ATOM 17 N SER 3 2.601 35.264 53.594 1.00 0.00 ATOM 18 CA SER 3 3.293 36.372 54.253 1.00 0.00 ATOM 19 CB SER 3 3.407 36.117 55.756 1.00 0.00 ATOM 20 OG SER 3 4.378 35.119 56.015 1.00 0.00 ATOM 21 O SER 3 5.163 35.631 52.957 1.00 0.00 ATOM 22 C SER 3 4.678 36.527 53.644 1.00 0.00 ATOM 23 N ALA 4 5.315 37.661 53.905 1.00 0.00 ATOM 24 CA ALA 4 6.679 37.888 53.440 1.00 0.00 ATOM 25 CB ALA 4 7.152 39.273 53.819 1.00 0.00 ATOM 26 O ALA 4 8.506 36.354 53.303 1.00 0.00 ATOM 27 C ALA 4 7.622 36.829 54.003 1.00 0.00 ATOM 28 N ASN 5 7.423 36.461 55.270 1.00 0.00 ATOM 29 CA ASN 5 8.225 35.407 55.884 1.00 0.00 ATOM 30 CB ASN 5 7.930 35.301 57.383 1.00 0.00 ATOM 31 CG ASN 5 8.406 36.518 58.153 1.00 0.00 ATOM 32 ND2 ASN 5 7.935 36.653 59.390 1.00 0.00 ATOM 33 OD1 ASN 5 9.175 37.344 57.638 1.00 0.00 ATOM 34 O ASN 5 9.038 33.344 54.958 1.00 0.00 ATOM 35 C ASN 5 8.067 34.058 55.184 1.00 0.00 ATOM 36 N GLN 6 6.842 33.717 54.813 1.00 0.00 ATOM 37 CA GLN 6 6.593 32.440 54.160 1.00 0.00 ATOM 38 CB GLN 6 5.095 32.183 54.054 1.00 0.00 ATOM 39 CG GLN 6 4.467 31.842 55.401 1.00 0.00 ATOM 40 CD GLN 6 2.969 31.728 55.321 1.00 0.00 ATOM 41 OE1 GLN 6 2.314 32.471 54.586 1.00 0.00 ATOM 42 NE2 GLN 6 2.409 30.805 56.088 1.00 0.00 ATOM 43 O GLN 6 7.875 31.359 52.441 1.00 0.00 ATOM 44 C GLN 6 7.268 32.366 52.794 1.00 0.00 ATOM 45 N ILE 7 7.175 33.455 52.037 1.00 0.00 ATOM 46 CA ILE 7 7.819 33.556 50.735 1.00 0.00 ATOM 47 CB ILE 7 7.382 34.869 50.018 1.00 0.00 ATOM 48 CG1 ILE 7 5.904 34.751 49.594 1.00 0.00 ATOM 49 CG2 ILE 7 8.295 35.178 48.820 1.00 0.00 ATOM 50 CD1 ILE 7 5.301 36.035 49.061 1.00 0.00 ATOM 51 O ILE 7 9.989 32.694 50.155 1.00 0.00 ATOM 52 C ILE 7 9.348 33.442 50.876 1.00 0.00 ATOM 53 N LYS 8 9.918 34.156 51.836 1.00 0.00 ATOM 54 CA LYS 8 11.352 34.074 52.103 1.00 0.00 ATOM 55 CB LYS 8 11.724 35.043 53.228 1.00 0.00 ATOM 56 CG LYS 8 13.182 35.062 53.612 1.00 0.00 ATOM 57 CD LYS 8 13.394 36.147 54.672 1.00 0.00 ATOM 58 CE LYS 8 14.858 36.289 55.064 1.00 0.00 ATOM 59 NZ LYS 8 15.288 35.129 55.906 1.00 0.00 ATOM 60 O LYS 8 12.723 32.086 51.870 1.00 0.00 ATOM 61 C LYS 8 11.771 32.634 52.445 1.00 0.00 ATOM 62 N PHE 9 11.021 32.004 53.343 1.00 0.00 ATOM 63 CA PHE 9 11.262 30.611 53.704 1.00 0.00 ATOM 64 CB PHE 9 10.244 30.165 54.766 1.00 0.00 ATOM 65 CG PHE 9 10.281 28.705 55.057 1.00 0.00 ATOM 66 CD1 PHE 9 11.284 28.178 55.871 1.00 0.00 ATOM 67 CD2 PHE 9 9.312 27.846 54.519 1.00 0.00 ATOM 68 CE1 PHE 9 11.329 26.811 56.141 1.00 0.00 ATOM 69 CE2 PHE 9 9.347 26.484 54.790 1.00 0.00 ATOM 70 CZ PHE 9 10.361 25.969 55.606 1.00 0.00 ATOM 71 O PHE 9 12.167 28.913 52.273 1.00 0.00 ATOM 72 C PHE 9 11.220 29.668 52.497 1.00 0.00 ATOM 73 N LEU 10 10.119 29.708 51.739 1.00 0.00 ATOM 74 CA LEU 10 9.973 28.895 50.528 1.00 0.00 ATOM 75 CB LEU 10 8.622 29.191 49.849 1.00 0.00 ATOM 76 CG LEU 10 7.434 28.533 50.564 1.00 0.00 ATOM 77 CD1 LEU 10 6.156 29.232 50.164 1.00 0.00 ATOM 78 CD2 LEU 10 7.352 26.971 50.269 1.00 0.00 ATOM 79 O LEU 10 11.699 28.099 48.999 1.00 0.00 ATOM 80 C LEU 10 11.144 29.084 49.544 1.00 0.00 ATOM 81 N ARG 11 11.522 30.337 49.317 1.00 0.00 ATOM 82 CA ARG 11 12.605 30.639 48.348 1.00 0.00 ATOM 83 CB ARG 11 12.655 32.137 48.035 1.00 0.00 ATOM 84 CG ARG 11 11.419 32.644 47.270 1.00 0.00 ATOM 85 CD ARG 11 11.426 34.173 47.070 1.00 0.00 ATOM 86 NE ARG 11 12.613 34.646 46.367 1.00 0.00 ATOM 87 CZ ARG 11 12.810 34.519 45.059 1.00 0.00 ATOM 88 NH1 ARG 11 11.883 33.948 44.285 1.00 0.00 ATOM 89 NH2 ARG 11 13.934 34.977 44.520 1.00 0.00 ATOM 90 O ARG 11 14.810 29.763 48.040 1.00 0.00 ATOM 91 C ARG 11 13.974 30.150 48.834 1.00 0.00 ATOM 92 N SER 12 14.185 30.162 50.150 1.00 0.00 ATOM 93 CA SER 12 15.469 29.792 50.735 1.00 0.00 ATOM 94 CB SER 12 15.464 30.062 52.242 1.00 0.00 ATOM 95 OG SER 12 14.694 29.069 52.908 1.00 0.00 ATOM 96 O SER 12 16.970 27.938 50.443 1.00 0.00 ATOM 97 C SER 12 15.798 28.317 50.470 1.00 0.00 ATOM 98 N LEU 13 14.778 27.486 50.242 1.00 0.00 ATOM 99 CA LEU 13 15.016 26.037 50.163 1.00 0.00 ATOM 100 CB LEU 13 13.718 25.257 50.417 1.00 0.00 ATOM 101 CG LEU 13 13.088 25.517 51.785 1.00 0.00 ATOM 102 CD1 LEU 13 11.743 24.775 51.883 1.00 0.00 ATOM 103 CD2 LEU 13 14.024 25.187 52.984 1.00 0.00 ATOM 104 O LEU 13 16.086 24.414 48.716 1.00 0.00 ATOM 105 C LEU 13 15.671 25.581 48.853 1.00 0.00 ATOM 106 N ARG 14 15.790 26.497 47.903 1.00 0.00 ATOM 107 CA ARG 14 16.578 26.223 46.717 1.00 0.00 ATOM 108 CB ARG 14 16.285 27.240 45.634 1.00 0.00 ATOM 109 CG ARG 14 16.896 28.614 45.833 1.00 0.00 ATOM 110 CD ARG 14 16.107 29.629 44.996 1.00 0.00 ATOM 111 NE ARG 14 14.668 29.409 45.202 1.00 0.00 ATOM 112 CZ ARG 14 13.681 29.948 44.479 1.00 0.00 ATOM 113 NH1 ARG 14 13.952 30.766 43.467 1.00 0.00 ATOM 114 NH2 ARG 14 12.410 29.664 44.778 1.00 0.00 ATOM 115 O ARG 14 18.883 25.735 46.157 1.00 0.00 ATOM 116 C ARG 14 18.105 26.179 47.007 1.00 0.00 ATOM 117 N GLU 15 18.514 26.645 48.189 1.00 0.00 ATOM 118 CA GLU 15 19.925 26.626 48.593 1.00 0.00 ATOM 119 CB GLU 15 20.327 27.955 49.234 1.00 0.00 ATOM 120 CG GLU 15 20.082 29.182 48.377 1.00 0.00 ATOM 121 CD GLU 15 20.199 30.498 49.175 1.00 0.00 ATOM 122 OE1 GLU 15 21.270 30.752 49.759 1.00 0.00 ATOM 123 OE2 GLU 15 19.201 31.265 49.222 1.00 0.00 ATOM 124 O GLU 15 19.427 25.395 50.585 1.00 0.00 ATOM 125 C GLU 15 20.176 25.523 49.606 1.00 0.00 ATOM 126 N ARG 16 21.242 24.752 49.403 1.00 0.00 ATOM 127 CA ARG 16 21.585 23.669 50.326 1.00 0.00 ATOM 128 CB ARG 16 22.889 22.991 49.882 1.00 0.00 ATOM 129 CG ARG 16 23.443 22.068 50.929 1.00 0.00 ATOM 130 CD ARG 16 24.325 20.980 50.360 1.00 0.00 ATOM 131 NE ARG 16 24.690 20.022 51.406 1.00 0.00 ATOM 132 CZ ARG 16 23.899 19.050 51.861 1.00 0.00 ATOM 133 NH1 ARG 16 24.339 18.253 52.821 1.00 0.00 ATOM 134 NH2 ARG 16 22.672 18.873 51.372 1.00 0.00 ATOM 135 O ARG 16 21.304 23.505 52.729 1.00 0.00 ATOM 136 C ARG 16 21.726 24.172 51.774 1.00 0.00 ATOM 137 N LYS 17 22.326 25.350 51.916 1.00 0.00 ATOM 138 CA LYS 17 22.542 25.973 53.217 1.00 0.00 ATOM 139 CB LYS 17 23.113 27.382 53.028 1.00 0.00 ATOM 140 CG LYS 17 23.147 28.249 54.271 1.00 0.00 ATOM 141 CD LYS 17 23.478 29.696 53.892 1.00 0.00 ATOM 142 CE LYS 17 23.392 30.619 55.081 1.00 0.00 ATOM 143 NZ LYS 17 23.822 32.014 54.727 1.00 0.00 ATOM 144 O LYS 17 21.229 25.642 55.210 1.00 0.00 ATOM 145 C LYS 17 21.245 26.005 54.026 1.00 0.00 ATOM 146 N TYR 18 20.158 26.423 53.382 1.00 0.00 ATOM 147 CA TYR 18 18.894 26.569 54.073 1.00 0.00 ATOM 148 CB TYR 18 18.062 27.697 53.455 1.00 0.00 ATOM 149 CG TYR 18 18.741 29.030 53.712 1.00 0.00 ATOM 150 CD1 TYR 18 18.745 29.593 54.991 1.00 0.00 ATOM 151 CD2 TYR 18 19.427 29.697 52.699 1.00 0.00 ATOM 152 CE1 TYR 18 19.377 30.790 55.245 1.00 0.00 ATOM 153 CE2 TYR 18 20.070 30.913 52.950 1.00 0.00 ATOM 154 CZ TYR 18 20.031 31.448 54.222 1.00 0.00 ATOM 155 OH TYR 18 20.669 32.625 54.493 1.00 0.00 ATOM 156 O TYR 18 17.403 25.096 55.222 1.00 0.00 ATOM 157 C TYR 18 18.112 25.271 54.224 1.00 0.00 ATOM 158 N ARG 19 18.272 24.348 53.274 1.00 0.00 ATOM 159 CA ARG 19 17.688 23.018 53.429 1.00 0.00 ATOM 160 CB ARG 19 17.932 22.128 52.209 1.00 0.00 ATOM 161 CG ARG 19 17.178 22.607 50.970 1.00 0.00 ATOM 162 CD ARG 19 17.103 21.511 49.883 1.00 0.00 ATOM 163 NE ARG 19 18.415 21.214 49.305 1.00 0.00 ATOM 164 CZ ARG 19 18.993 21.913 48.332 1.00 0.00 ATOM 165 NH1 ARG 19 18.390 22.974 47.817 1.00 0.00 ATOM 166 NH2 ARG 19 20.182 21.546 47.877 1.00 0.00 ATOM 167 O ARG 19 17.511 21.784 55.449 1.00 0.00 ATOM 168 C ARG 19 18.258 22.377 54.679 1.00 0.00 ATOM 169 N LEU 20 19.567 22.547 54.893 1.00 0.00 ATOM 170 CA LEU 20 20.246 21.998 56.060 1.00 0.00 ATOM 171 CB LEU 20 21.767 22.131 55.924 1.00 0.00 ATOM 172 CG LEU 20 22.476 21.178 54.965 1.00 0.00 ATOM 173 CD1 LEU 20 23.930 21.571 54.852 1.00 0.00 ATOM 174 CD2 LEU 20 22.322 19.706 55.407 1.00 0.00 ATOM 175 O LEU 20 19.520 21.999 58.345 1.00 0.00 ATOM 176 C LEU 20 19.800 22.675 57.350 1.00 0.00 ATOM 177 N ARG 21 19.731 24.004 57.330 1.00 0.00 ATOM 178 CA ARG 21 19.402 24.766 58.537 1.00 0.00 ATOM 179 CB ARG 21 19.582 26.251 58.271 1.00 0.00 ATOM 180 CG ARG 21 19.608 27.070 59.509 1.00 0.00 ATOM 181 CD ARG 21 19.901 28.490 59.206 1.00 0.00 ATOM 182 NE ARG 21 21.322 28.732 58.984 1.00 0.00 ATOM 183 CZ ARG 21 21.814 29.917 58.646 1.00 0.00 ATOM 184 NH1 ARG 21 20.999 30.953 58.512 1.00 0.00 ATOM 185 NH2 ARG 21 23.112 30.067 58.444 1.00 0.00 ATOM 186 O ARG 21 17.672 24.351 60.172 1.00 0.00 ATOM 187 C ARG 21 17.962 24.485 58.971 1.00 0.00 ATOM 188 N GLU 22 17.080 24.393 57.973 1.00 0.00 ATOM 189 CA GLU 22 15.656 24.161 58.195 1.00 0.00 ATOM 190 CB GLU 22 14.828 24.828 57.087 1.00 0.00 ATOM 191 CG GLU 22 14.925 26.361 57.047 1.00 0.00 ATOM 192 CD GLU 22 14.520 27.011 58.359 1.00 0.00 ATOM 193 OE1 GLU 22 13.618 26.475 59.045 1.00 0.00 ATOM 194 OE2 GLU 22 15.108 28.061 58.706 1.00 0.00 ATOM 195 O GLU 22 14.153 22.347 58.591 1.00 0.00 ATOM 196 C GLU 22 15.291 22.688 58.250 1.00 0.00 ATOM 197 N GLN 23 16.245 21.823 57.897 1.00 0.00 ATOM 198 CA GLN 23 15.992 20.390 57.743 1.00 0.00 ATOM 199 CB GLN 23 15.922 19.667 59.107 1.00 0.00 ATOM 200 CG GLN 23 17.314 19.476 59.768 1.00 0.00 ATOM 201 CD GLN 23 18.241 18.580 58.932 1.00 0.00 ATOM 202 OE1 GLN 23 17.961 17.391 58.721 1.00 0.00 ATOM 203 NE2 GLN 23 19.336 19.159 58.438 1.00 0.00 ATOM 204 O GLN 23 13.795 19.497 57.343 1.00 0.00 ATOM 205 C GLN 23 14.721 20.199 56.926 1.00 0.00 ATOM 206 N ALA 24 14.683 20.855 55.764 1.00 0.00 ATOM 207 CA ALA 24 13.500 20.852 54.911 1.00 0.00 ATOM 208 CB ALA 24 12.591 22.016 55.269 1.00 0.00 ATOM 209 O ALA 24 14.960 21.361 53.051 1.00 0.00 ATOM 210 C ALA 24 13.868 20.917 53.419 1.00 0.00 ATOM 211 N PHE 25 12.954 20.477 52.562 1.00 0.00 ATOM 212 CA PHE 25 13.153 20.623 51.120 1.00 0.00 ATOM 213 CB PHE 25 13.963 19.443 50.542 1.00 0.00 ATOM 214 CG PHE 25 13.214 18.126 50.529 1.00 0.00 ATOM 215 CD1 PHE 25 12.555 17.701 49.378 1.00 0.00 ATOM 216 CD2 PHE 25 13.134 17.341 51.668 1.00 0.00 ATOM 217 CE1 PHE 25 11.873 16.485 49.355 1.00 0.00 ATOM 218 CE2 PHE 25 12.433 16.096 51.655 1.00 0.00 ATOM 219 CZ PHE 25 11.807 15.687 50.494 1.00 0.00 ATOM 220 O PHE 25 10.781 20.272 51.029 1.00 0.00 ATOM 221 C PHE 25 11.796 20.737 50.466 1.00 0.00 ATOM 222 N ALA 26 11.753 21.352 49.287 1.00 0.00 ATOM 223 CA ALA 26 10.500 21.552 48.593 1.00 0.00 ATOM 224 CB ALA 26 10.371 23.012 48.130 1.00 0.00 ATOM 225 O ALA 26 11.339 20.163 46.771 1.00 0.00 ATOM 226 C ALA 26 10.348 20.602 47.397 1.00 0.00 ATOM 227 N VAL 27 9.096 20.347 47.067 1.00 0.00 ATOM 228 CA VAL 27 8.678 19.519 45.935 1.00 0.00 ATOM 229 CB VAL 27 8.200 18.121 46.415 1.00 0.00 ATOM 230 CG1 VAL 27 7.742 17.207 45.233 1.00 0.00 ATOM 231 CG2 VAL 27 9.320 17.420 47.234 1.00 0.00 ATOM 232 O VAL 27 6.609 20.765 45.945 1.00 0.00 ATOM 233 C VAL 27 7.537 20.256 45.262 1.00 0.00 ATOM 234 N GLU 28 7.602 20.331 43.941 1.00 0.00 ATOM 235 CA GLU 28 6.602 21.058 43.155 1.00 0.00 ATOM 236 CB GLU 28 7.243 22.200 42.375 1.00 0.00 ATOM 237 CG GLU 28 8.075 23.155 43.251 1.00 0.00 ATOM 238 CD GLU 28 8.568 24.349 42.432 1.00 0.00 ATOM 239 OE1 GLU 28 7.883 24.705 41.457 1.00 0.00 ATOM 240 OE2 GLU 28 9.646 24.910 42.733 1.00 0.00 ATOM 241 O GLU 28 6.251 19.237 41.582 1.00 0.00 ATOM 242 C GLU 28 5.764 20.183 42.225 1.00 0.00 ATOM 243 N GLY 29 4.482 20.512 42.178 1.00 0.00 ATOM 244 CA GLY 29 3.578 19.932 41.213 1.00 0.00 ATOM 245 O GLY 29 3.255 18.061 42.627 1.00 0.00 ATOM 246 C GLY 29 2.777 18.774 41.770 1.00 0.00 ATOM 247 N PRO 30 1.547 18.580 41.276 1.00 0.00 ATOM 248 CA PRO 30 0.678 17.544 41.835 1.00 0.00 ATOM 249 CB PRO 30 -0.612 17.638 40.987 1.00 0.00 ATOM 250 CG PRO 30 -0.276 18.518 39.804 1.00 0.00 ATOM 251 CD PRO 30 0.898 19.366 40.204 1.00 0.00 ATOM 252 O PRO 30 0.926 15.311 42.620 1.00 0.00 ATOM 253 C PRO 30 1.223 16.118 41.748 1.00 0.00 ATOM 254 N LYS 31 1.949 15.792 40.682 1.00 0.00 ATOM 255 CA LYS 31 2.374 14.398 40.476 1.00 0.00 ATOM 256 CB LYS 31 2.991 14.200 39.085 1.00 0.00 ATOM 257 CG LYS 31 2.014 14.277 37.947 1.00 0.00 ATOM 258 CD LYS 31 2.656 13.853 36.607 1.00 0.00 ATOM 259 CE LYS 31 2.064 14.666 35.446 1.00 0.00 ATOM 260 NZ LYS 31 2.444 14.113 34.109 1.00 0.00 ATOM 261 O LYS 31 3.206 12.986 42.267 1.00 0.00 ATOM 262 C LYS 31 3.372 14.003 41.572 1.00 0.00 ATOM 263 N LEU 32 4.393 14.834 41.752 1.00 0.00 ATOM 264 CA LEU 32 5.419 14.536 42.696 1.00 0.00 ATOM 265 CB LEU 32 6.688 15.356 42.429 1.00 0.00 ATOM 266 CG LEU 32 7.456 15.036 41.140 1.00 0.00 ATOM 267 CD1 LEU 32 8.484 16.132 40.921 1.00 0.00 ATOM 268 CD2 LEU 32 8.111 13.663 41.194 1.00 0.00 ATOM 269 O LEU 32 5.246 13.899 44.985 1.00 0.00 ATOM 270 C LEU 32 4.929 14.724 44.128 1.00 0.00 ATOM 271 N VAL 33 4.146 15.772 44.385 1.00 0.00 ATOM 272 CA VAL 33 3.668 16.015 45.745 1.00 0.00 ATOM 273 CB VAL 33 2.970 17.411 45.884 1.00 0.00 ATOM 274 CG1 VAL 33 2.288 17.535 47.238 1.00 0.00 ATOM 275 CG2 VAL 33 4.005 18.547 45.723 1.00 0.00 ATOM 276 O VAL 33 2.938 14.302 47.255 1.00 0.00 ATOM 277 C VAL 33 2.754 14.867 46.173 1.00 0.00 ATOM 278 N GLY 34 1.812 14.491 45.303 1.00 0.00 ATOM 279 CA GLY 34 0.887 13.385 45.574 1.00 0.00 ATOM 280 O GLY 34 1.328 11.402 46.869 1.00 0.00 ATOM 281 C GLY 34 1.617 12.091 45.884 1.00 0.00 ATOM 282 N GLU 35 2.611 11.763 45.079 1.00 0.00 ATOM 283 CA GLU 35 3.323 10.534 45.336 1.00 0.00 ATOM 284 CB GLU 35 4.169 10.113 44.151 1.00 0.00 ATOM 285 CG GLU 35 4.548 8.643 44.280 1.00 0.00 ATOM 286 CD GLU 35 4.535 7.920 42.984 1.00 0.00 ATOM 287 OE1 GLU 35 4.440 8.598 41.931 1.00 0.00 ATOM 288 OE2 GLU 35 4.603 6.665 43.035 1.00 0.00 ATOM 289 O GLU 35 4.344 9.456 47.212 1.00 0.00 ATOM 290 C GLU 35 4.180 10.523 46.590 1.00 0.00 ATOM 291 N MET 36 4.725 11.673 46.972 1.00 0.00 ATOM 292 CA MET 36 5.671 11.691 48.082 1.00 0.00 ATOM 293 CB MET 36 6.829 12.645 47.769 1.00 0.00 ATOM 294 CG MET 36 7.618 12.307 46.500 1.00 0.00 ATOM 295 SD MET 36 8.993 13.694 46.109 1.00 0.00 ATOM 296 CE MET 36 10.153 13.463 47.685 1.00 0.00 ATOM 297 O MET 36 5.616 11.745 50.507 1.00 0.00 ATOM 298 C MET 36 5.022 12.010 49.453 1.00 0.00 ATOM 299 N LEU 37 3.802 12.548 49.440 1.00 0.00 ATOM 300 CA LEU 37 3.076 12.824 50.705 1.00 0.00 ATOM 301 CB LEU 37 1.647 13.370 50.448 1.00 0.00 ATOM 302 CG LEU 37 1.547 14.875 50.217 1.00 0.00 ATOM 303 CD1 LEU 37 0.192 15.247 49.576 1.00 0.00 ATOM 304 CD2 LEU 37 1.795 15.679 51.507 1.00 0.00 ATOM 305 O LEU 37 3.241 11.892 52.903 1.00 0.00 ATOM 306 C LEU 37 3.034 11.669 51.714 1.00 0.00 ATOM 307 N PRO 38 2.711 10.440 51.262 1.00 0.00 ATOM 308 CA PRO 38 2.651 9.326 52.223 1.00 0.00 ATOM 309 CB PRO 38 2.142 8.151 51.379 1.00 0.00 ATOM 310 CG PRO 38 1.504 8.783 50.174 1.00 0.00 ATOM 311 CD PRO 38 2.336 10.010 49.905 1.00 0.00 ATOM 312 O PRO 38 4.033 8.138 53.785 1.00 0.00 ATOM 313 C PRO 38 3.993 8.943 52.838 1.00 0.00 ATOM 314 N PHE 39 5.089 9.479 52.320 1.00 0.00 ATOM 315 CA PHE 39 6.419 8.976 52.717 1.00 0.00 ATOM 316 CB PHE 39 7.122 8.399 51.501 1.00 0.00 ATOM 317 CG PHE 39 6.385 7.251 50.890 1.00 0.00 ATOM 318 CD1 PHE 39 6.437 5.990 51.470 1.00 0.00 ATOM 319 CD2 PHE 39 5.597 7.447 49.761 1.00 0.00 ATOM 320 CE1 PHE 39 5.719 4.923 50.914 1.00 0.00 ATOM 321 CE2 PHE 39 4.893 6.383 49.188 1.00 0.00 ATOM 322 CZ PHE 39 4.952 5.121 49.770 1.00 0.00 ATOM 323 O PHE 39 8.450 9.677 53.835 1.00 0.00 ATOM 324 C PHE 39 7.328 10.003 53.402 1.00 0.00 ATOM 325 N TYR 40 6.870 11.242 53.447 1.00 0.00 ATOM 326 CA TYR 40 7.643 12.364 53.972 1.00 0.00 ATOM 327 CB TYR 40 8.209 13.251 52.840 1.00 0.00 ATOM 328 CG TYR 40 9.302 12.548 52.108 1.00 0.00 ATOM 329 CD1 TYR 40 10.640 12.704 52.496 1.00 0.00 ATOM 330 CD2 TYR 40 8.996 11.668 51.066 1.00 0.00 ATOM 331 CE1 TYR 40 11.640 12.023 51.844 1.00 0.00 ATOM 332 CE2 TYR 40 9.985 10.950 50.425 1.00 0.00 ATOM 333 CZ TYR 40 11.309 11.145 50.806 1.00 0.00 ATOM 334 OH TYR 40 12.296 10.445 50.154 1.00 0.00 ATOM 335 O TYR 40 5.522 13.165 54.631 1.00 0.00 ATOM 336 C TYR 40 6.730 13.176 54.835 1.00 0.00 ATOM 337 N ARG 41 7.323 13.867 55.801 1.00 0.00 ATOM 338 CA ARG 41 6.568 14.655 56.751 1.00 0.00 ATOM 339 CB ARG 41 7.367 14.791 58.037 1.00 0.00 ATOM 340 CG ARG 41 6.540 14.828 59.301 1.00 0.00 ATOM 341 CD ARG 41 5.723 16.078 59.387 1.00 0.00 ATOM 342 NE ARG 41 5.065 16.194 60.689 1.00 0.00 ATOM 343 CZ ARG 41 4.265 17.200 61.038 1.00 0.00 ATOM 344 NH1 ARG 41 3.716 17.220 62.265 1.00 0.00 ATOM 345 NH2 ARG 41 4.019 18.192 60.172 1.00 0.00 ATOM 346 O ARG 41 7.296 16.791 55.998 1.00 0.00 ATOM 347 C ARG 41 6.352 16.027 56.145 1.00 0.00 ATOM 348 N CYS 42 5.106 16.346 55.827 1.00 0.00 ATOM 349 CA CYS 42 4.796 17.634 55.214 1.00 0.00 ATOM 350 CB CYS 42 3.573 17.504 54.307 1.00 0.00 ATOM 351 SG CYS 42 3.176 19.072 53.493 1.00 0.00 ATOM 352 O CYS 42 3.822 18.606 57.204 1.00 0.00 ATOM 353 C CYS 42 4.614 18.748 56.272 1.00 0.00 ATOM 354 N ARG 43 5.374 19.830 56.105 1.00 0.00 ATOM 355 CA ARG 43 5.418 21.006 56.978 1.00 0.00 ATOM 356 CB ARG 43 6.874 21.507 56.929 1.00 0.00 ATOM 357 CG ARG 43 7.310 22.602 57.895 1.00 0.00 ATOM 358 CD ARG 43 8.846 22.672 57.889 1.00 0.00 ATOM 359 NE ARG 43 9.374 23.946 58.358 1.00 0.00 ATOM 360 CZ ARG 43 10.657 24.181 58.628 1.00 0.00 ATOM 361 NH1 ARG 43 11.040 25.377 59.061 1.00 0.00 ATOM 362 NH2 ARG 43 11.558 23.222 58.479 1.00 0.00 ATOM 363 O ARG 43 3.868 22.860 57.215 1.00 0.00 ATOM 364 C ARG 43 4.475 22.105 56.457 1.00 0.00 ATOM 365 N MET 44 4.427 22.217 55.130 1.00 0.00 ATOM 366 CA MET 44 3.708 23.292 54.470 1.00 0.00 ATOM 367 CB MET 44 4.617 24.513 54.352 1.00 0.00 ATOM 368 CG MET 44 4.098 25.601 53.447 1.00 0.00 ATOM 369 SD MET 44 5.119 27.286 53.678 1.00 0.00 ATOM 370 CE MET 44 3.997 28.096 55.040 1.00 0.00 ATOM 371 O MET 44 3.968 22.098 52.405 1.00 0.00 ATOM 372 C MET 44 3.249 22.826 53.089 1.00 0.00 ATOM 373 N LEU 45 2.045 23.241 52.703 1.00 0.00 ATOM 374 CA LEU 45 1.477 22.889 51.400 1.00 0.00 ATOM 375 CB LEU 45 0.524 21.706 51.528 1.00 0.00 ATOM 376 CG LEU 45 -0.036 21.153 50.222 1.00 0.00 ATOM 377 CD1 LEU 45 1.091 20.580 49.333 1.00 0.00 ATOM 378 CD2 LEU 45 -1.085 20.082 50.520 1.00 0.00 ATOM 379 O LEU 45 -0.141 24.646 51.514 1.00 0.00 ATOM 380 C LEU 45 0.761 24.124 50.876 1.00 0.00 ATOM 381 N VAL 46 1.185 24.598 49.715 1.00 0.00 ATOM 382 CA VAL 46 0.712 25.877 49.170 1.00 0.00 ATOM 383 CB VAL 46 1.880 26.853 49.133 1.00 0.00 ATOM 384 CG1 VAL 46 1.569 28.060 48.328 1.00 0.00 ATOM 385 CG2 VAL 46 2.243 27.270 50.564 1.00 0.00 ATOM 386 O VAL 46 0.952 24.952 46.967 1.00 0.00 ATOM 387 C VAL 46 0.227 25.573 47.756 1.00 0.00 ATOM 388 N GLY 47 -1.004 25.941 47.446 1.00 0.00 ATOM 389 CA GLY 47 -1.496 25.665 46.113 1.00 0.00 ATOM 390 O GLY 47 -3.420 26.912 46.748 1.00 0.00 ATOM 391 C GLY 47 -2.821 26.336 45.851 1.00 0.00 ATOM 392 N THR 48 -3.284 26.241 44.611 1.00 0.00 ATOM 393 CA THR 48 -4.614 26.707 44.272 1.00 0.00 ATOM 394 CB THR 48 -4.786 26.841 42.757 1.00 0.00 ATOM 395 CG2 THR 48 -3.878 27.927 42.201 1.00 0.00 ATOM 396 OG1 THR 48 -4.481 25.578 42.135 1.00 0.00 ATOM 397 O THR 48 -5.272 24.515 44.970 1.00 0.00 ATOM 398 C THR 48 -5.616 25.689 44.786 1.00 0.00 ATOM 399 N ALA 49 -6.855 26.137 45.007 1.00 0.00 ATOM 400 CA ALA 49 -7.937 25.265 45.477 1.00 0.00 ATOM 401 CB ALA 49 -9.287 26.020 45.459 1.00 0.00 ATOM 402 O ALA 49 -8.206 22.886 45.268 1.00 0.00 ATOM 403 C ALA 49 -8.039 23.966 44.679 1.00 0.00 ATOM 404 N ALA 50 -7.931 24.059 43.350 1.00 0.00 ATOM 405 CA ALA 50 -8.080 22.875 42.481 1.00 0.00 ATOM 406 CB ALA 50 -8.134 23.278 41.004 1.00 0.00 ATOM 407 O ALA 50 -7.184 20.648 42.661 1.00 0.00 ATOM 408 C ALA 50 -6.962 21.858 42.737 1.00 0.00 ATOM 409 N MET 51 -5.775 22.358 43.061 1.00 0.00 ATOM 410 CA MET 51 -4.650 21.487 43.413 1.00 0.00 ATOM 411 CB MET 51 -3.319 22.228 43.276 1.00 0.00 ATOM 412 CG MET 51 -3.010 22.664 41.841 1.00 0.00 ATOM 413 SD MET 51 -2.776 21.118 40.662 1.00 0.00 ATOM 414 CE MET 51 -4.571 21.050 39.847 1.00 0.00 ATOM 415 O MET 51 -4.559 19.692 44.992 1.00 0.00 ATOM 416 C MET 51 -4.802 20.884 44.801 1.00 0.00 ATOM 417 N LEU 52 -5.218 21.690 45.771 1.00 0.00 ATOM 418 CA LEU 52 -5.316 21.202 47.149 1.00 0.00 ATOM 419 CB LEU 52 -5.516 22.369 48.119 1.00 0.00 ATOM 420 CG LEU 52 -4.350 23.357 48.221 1.00 0.00 ATOM 421 CD1 LEU 52 -4.746 24.535 49.095 1.00 0.00 ATOM 422 CD2 LEU 52 -3.116 22.655 48.798 1.00 0.00 ATOM 423 O LEU 52 -6.296 19.233 48.151 1.00 0.00 ATOM 424 C LEU 52 -6.426 20.151 47.341 1.00 0.00 ATOM 425 N ARG 53 -7.519 20.289 46.606 1.00 0.00 ATOM 426 CA ARG 53 -8.623 19.354 46.764 1.00 0.00 ATOM 427 CB ARG 53 -9.844 19.832 45.981 1.00 0.00 ATOM 428 CG ARG 53 -9.735 19.588 44.475 1.00 0.00 ATOM 429 CD ARG 53 -11.027 19.888 43.762 1.00 0.00 ATOM 430 NE ARG 53 -12.048 18.889 44.063 1.00 0.00 ATOM 431 CZ ARG 53 -13.210 18.792 43.428 1.00 0.00 ATOM 432 NH1 ARG 53 -14.070 17.851 43.781 1.00 0.00 ATOM 433 NH2 ARG 53 -13.515 19.635 42.442 1.00 0.00 ATOM 434 O ARG 53 -8.804 16.942 46.828 1.00 0.00 ATOM 435 C ARG 53 -8.233 17.927 46.336 1.00 0.00 ATOM 436 N ALA 54 -7.243 17.833 45.441 1.00 0.00 ATOM 437 CA ALA 54 -6.855 16.554 44.848 1.00 0.00 ATOM 438 CB ALA 54 -6.255 16.757 43.469 1.00 0.00 ATOM 439 O ALA 54 -5.671 14.580 45.472 1.00 0.00 ATOM 440 C ALA 54 -5.901 15.754 45.730 1.00 0.00 ATOM 441 N VAL 55 -5.353 16.375 46.771 1.00 0.00 ATOM 442 CA VAL 55 -4.464 15.650 47.681 1.00 0.00 ATOM 443 CB VAL 55 -3.056 16.305 47.773 1.00 0.00 ATOM 444 CG1 VAL 55 -2.338 16.234 46.419 1.00 0.00 ATOM 445 CG2 VAL 55 -3.151 17.729 48.216 1.00 0.00 ATOM 446 O VAL 55 -5.749 16.538 49.499 1.00 0.00 ATOM 447 C VAL 55 -5.086 15.577 49.066 1.00 0.00 ATOM 448 N SER 56 -4.872 14.471 49.779 1.00 0.00 ATOM 449 CA SER 56 -5.376 14.407 51.151 1.00 0.00 ATOM 450 CB SER 56 -5.410 12.992 51.751 1.00 0.00 ATOM 451 OG SER 56 -4.355 12.192 51.269 1.00 0.00 ATOM 452 O SER 56 -3.334 15.344 51.952 1.00 0.00 ATOM 453 C SER 56 -4.566 15.363 51.987 1.00 0.00 ATOM 454 N THR 57 -5.277 16.252 52.669 1.00 0.00 ATOM 455 CA THR 57 -4.678 17.287 53.479 1.00 0.00 ATOM 456 CB THR 57 -5.750 18.061 54.266 1.00 0.00 ATOM 457 CG2 THR 57 -5.303 19.492 54.534 1.00 0.00 ATOM 458 OG1 THR 57 -6.978 18.073 53.522 1.00 0.00 ATOM 459 O THR 57 -4.054 15.681 55.140 1.00 0.00 ATOM 460 C THR 57 -3.697 16.635 54.439 1.00 0.00 ATOM 461 N PRO 58 -2.443 17.124 54.451 1.00 0.00 ATOM 462 CA PRO 58 -1.426 16.560 55.337 1.00 0.00 ATOM 463 CB PRO 58 -0.162 17.353 54.985 1.00 0.00 ATOM 464 CG PRO 58 -0.460 18.069 53.704 1.00 0.00 ATOM 465 CD PRO 58 -1.934 18.251 53.654 1.00 0.00 ATOM 466 O PRO 58 -2.307 17.901 57.114 1.00 0.00 ATOM 467 C PRO 58 -1.790 16.826 56.790 1.00 0.00 ATOM 468 N HIS 59 -1.543 15.845 57.647 1.00 0.00 ATOM 469 CA HIS 59 -1.792 16.056 59.065 1.00 0.00 ATOM 470 CB HIS 59 -1.860 14.736 59.846 1.00 0.00 ATOM 471 CG HIS 59 -3.259 14.276 60.141 1.00 0.00 ATOM 472 CD2 HIS 59 -4.113 14.606 61.141 1.00 0.00 ATOM 473 ND1 HIS 59 -3.928 13.359 59.356 1.00 0.00 ATOM 474 CE1 HIS 59 -5.131 13.144 59.861 1.00 0.00 ATOM 475 NE2 HIS 59 -5.268 13.888 60.944 1.00 0.00 ATOM 476 O HIS 59 0.459 16.895 59.464 1.00 0.00 ATOM 477 C HIS 59 -0.763 17.031 59.644 1.00 0.00 ATOM 478 N ASP 60 -1.283 18.065 60.298 1.00 0.00 ATOM 479 CA ASP 60 -0.435 19.053 60.972 1.00 0.00 ATOM 480 CB ASP 60 0.345 18.389 62.120 1.00 0.00 ATOM 481 CG ASP 60 0.844 19.397 63.138 1.00 0.00 ATOM 482 OD1 ASP 60 0.056 20.288 63.524 1.00 0.00 ATOM 483 OD2 ASP 60 2.023 19.307 63.530 1.00 0.00 ATOM 484 O ASP 60 1.694 20.018 60.395 1.00 0.00 ATOM 485 C ASP 60 0.529 19.821 60.060 1.00 0.00 ATOM 486 N ALA 61 0.041 20.256 58.906 1.00 0.00 ATOM 487 CA ALA 61 0.833 21.114 58.042 1.00 0.00 ATOM 488 CB ALA 61 1.011 20.489 56.652 1.00 0.00 ATOM 489 O ALA 61 -1.024 22.621 58.134 1.00 0.00 ATOM 490 C ALA 61 0.179 22.483 57.941 1.00 0.00 ATOM 491 N GLU 62 0.981 23.497 57.665 1.00 0.00 ATOM 492 CA GLU 62 0.436 24.772 57.247 1.00 0.00 ATOM 493 CB GLU 62 1.434 25.884 57.485 1.00 0.00 ATOM 494 CG GLU 62 0.892 27.226 57.109 1.00 0.00 ATOM 495 CD GLU 62 1.405 28.310 58.006 1.00 0.00 ATOM 496 OE1 GLU 62 0.658 29.290 58.199 1.00 0.00 ATOM 497 OE2 GLU 62 2.548 28.169 58.514 1.00 0.00 ATOM 498 O GLU 62 0.870 24.567 54.869 1.00 0.00 ATOM 499 C GLU 62 0.023 24.717 55.765 1.00 0.00 ATOM 500 N VAL 63 -1.281 24.834 55.530 1.00 0.00 ATOM 501 CA VAL 63 -1.853 24.743 54.201 1.00 0.00 ATOM 502 CB VAL 63 -2.992 23.699 54.162 1.00 0.00 ATOM 503 CG1 VAL 63 -3.634 23.656 52.787 1.00 0.00 ATOM 504 CG2 VAL 63 -2.446 22.323 54.543 1.00 0.00 ATOM 505 O VAL 63 -3.164 26.728 54.513 1.00 0.00 ATOM 506 C VAL 63 -2.367 26.113 53.788 1.00 0.00 ATOM 507 N VAL 64 -1.884 26.615 52.654 1.00 0.00 ATOM 508 CA VAL 64 -2.271 27.964 52.202 1.00 0.00 ATOM 509 CB VAL 64 -1.074 28.952 52.067 1.00 0.00 ATOM 510 CG1 VAL 64 -1.571 30.354 51.694 1.00 0.00 ATOM 511 CG2 VAL 64 -0.235 29.027 53.365 1.00 0.00 ATOM 512 O VAL 64 -2.281 27.329 49.934 1.00 0.00 ATOM 513 C VAL 64 -2.923 27.803 50.858 1.00 0.00 ATOM 514 N GLU 65 -4.196 28.168 50.748 1.00 0.00 ATOM 515 CA GLU 65 -4.857 28.140 49.452 1.00 0.00 ATOM 516 CB GLU 65 -6.362 27.853 49.586 1.00 0.00 ATOM 517 CG GLU 65 -7.140 27.895 48.258 1.00 0.00 ATOM 518 CD GLU 65 -8.656 28.056 48.452 1.00 0.00 ATOM 519 OE1 GLU 65 -9.281 27.124 48.999 1.00 0.00 ATOM 520 OE2 GLU 65 -9.225 29.103 48.044 1.00 0.00 ATOM 521 O GLU 65 -4.968 30.521 49.371 1.00 0.00 ATOM 522 C GLU 65 -4.631 29.489 48.792 1.00 0.00 ATOM 523 N LEU 66 -4.082 29.467 47.580 1.00 0.00 ATOM 524 CA LEU 66 -3.760 30.684 46.846 1.00 0.00 ATOM 525 CB LEU 66 -2.320 30.612 46.347 1.00 0.00 ATOM 526 CG LEU 66 -1.230 30.628 47.427 1.00 0.00 ATOM 527 CD1 LEU 66 0.103 30.438 46.772 1.00 0.00 ATOM 528 CD2 LEU 66 -1.235 31.913 48.216 1.00 0.00 ATOM 529 O LEU 66 -5.200 29.954 45.073 1.00 0.00 ATOM 530 C LEU 66 -4.713 30.917 45.675 1.00 0.00 ATOM 531 N PRO 67 -4.963 32.188 45.321 1.00 0.00 ATOM 532 CA PRO 67 -5.883 32.414 44.211 1.00 0.00 ATOM 533 CB PRO 67 -6.097 33.935 44.234 1.00 0.00 ATOM 534 CG PRO 67 -4.836 34.470 44.831 1.00 0.00 ATOM 535 CD PRO 67 -4.427 33.452 45.864 1.00 0.00 ATOM 536 O PRO 67 -4.004 31.927 42.814 1.00 0.00 ATOM 537 C PRO 67 -5.235 31.999 42.904 1.00 0.00 ATOM 538 N GLU 68 -6.072 31.741 41.909 1.00 0.00 ATOM 539 CA GLU 68 -5.656 31.478 40.531 1.00 0.00 ATOM 540 CB GLU 68 -6.906 31.463 39.641 1.00 0.00 ATOM 541 CG GLU 68 -6.902 30.416 38.530 1.00 0.00 ATOM 542 CD GLU 68 -6.586 29.017 39.036 1.00 0.00 ATOM 543 OE1 GLU 68 -5.488 28.516 38.708 1.00 0.00 ATOM 544 OE2 GLU 68 -7.411 28.421 39.773 1.00 0.00 ATOM 545 O GLU 68 -3.734 32.237 39.286 1.00 0.00 ATOM 546 C GLU 68 -4.677 32.549 40.020 1.00 0.00 ATOM 547 N SER 69 -4.877 33.792 40.455 1.00 0.00 ATOM 548 CA SER 69 -4.019 34.906 40.037 1.00 0.00 ATOM 549 CB SER 69 -4.686 36.232 40.370 1.00 0.00 ATOM 550 OG SER 69 -4.786 36.385 41.769 1.00 0.00 ATOM 551 O SER 69 -1.749 35.654 40.133 1.00 0.00 ATOM 552 C SER 69 -2.608 34.925 40.633 1.00 0.00 ATOM 553 N PHE 70 -2.381 34.186 41.718 1.00 0.00 ATOM 554 CA PHE 70 -1.060 34.168 42.352 1.00 0.00 ATOM 555 CB PHE 70 -1.034 33.260 43.581 1.00 0.00 ATOM 556 CG PHE 70 0.336 33.156 44.228 1.00 0.00 ATOM 557 CD1 PHE 70 0.743 34.092 45.168 1.00 0.00 ATOM 558 CD2 PHE 70 1.212 32.130 43.882 1.00 0.00 ATOM 559 CE1 PHE 70 2.009 34.014 45.768 1.00 0.00 ATOM 560 CE2 PHE 70 2.483 32.034 44.484 1.00 0.00 ATOM 561 CZ PHE 70 2.877 32.988 45.424 1.00 0.00 ATOM 562 O PHE 70 -0.218 32.690 40.672 1.00 0.00 ATOM 563 C PHE 70 -0.009 33.679 41.354 1.00 0.00 ATOM 564 N ASP 71 1.118 34.384 41.289 1.00 0.00 ATOM 565 CA ASP 71 2.184 34.028 40.373 1.00 0.00 ATOM 566 CB ASP 71 2.867 35.288 39.847 1.00 0.00 ATOM 567 CG ASP 71 3.857 34.996 38.749 1.00 0.00 ATOM 568 OD1 ASP 71 4.230 33.815 38.567 1.00 0.00 ATOM 569 OD2 ASP 71 4.278 35.954 38.063 1.00 0.00 ATOM 570 O ASP 71 4.060 33.561 41.799 1.00 0.00 ATOM 571 C ASP 71 3.203 33.108 41.038 1.00 0.00 ATOM 572 N PHE 72 3.144 31.825 40.708 1.00 0.00 ATOM 573 CA PHE 72 4.056 30.855 41.329 1.00 0.00 ATOM 574 CB PHE 72 3.658 29.404 41.011 1.00 0.00 ATOM 575 CG PHE 72 2.620 28.869 41.969 1.00 0.00 ATOM 576 CD1 PHE 72 1.270 29.214 41.808 1.00 0.00 ATOM 577 CD2 PHE 72 2.993 28.116 43.078 1.00 0.00 ATOM 578 CE1 PHE 72 0.311 28.777 42.699 1.00 0.00 ATOM 579 CE2 PHE 72 2.025 27.680 43.978 1.00 0.00 ATOM 580 CZ PHE 72 0.668 28.016 43.772 1.00 0.00 ATOM 581 O PHE 72 6.371 30.583 41.805 1.00 0.00 ATOM 582 C PHE 72 5.535 31.097 41.060 1.00 0.00 ATOM 583 N LYS 73 5.871 31.884 40.033 1.00 0.00 ATOM 584 CA LYS 73 7.272 32.282 39.829 1.00 0.00 ATOM 585 CB LYS 73 7.471 33.093 38.536 1.00 0.00 ATOM 586 CG LYS 73 7.155 32.292 37.274 1.00 0.00 ATOM 587 CD LYS 73 7.255 33.130 35.987 1.00 0.00 ATOM 588 CE LYS 73 6.951 32.249 34.771 1.00 0.00 ATOM 589 NZ LYS 73 7.247 32.939 33.472 1.00 0.00 ATOM 590 O LYS 73 9.026 33.221 41.162 1.00 0.00 ATOM 591 C LYS 73 7.809 33.058 41.026 1.00 0.00 ATOM 592 N ARG 74 6.910 33.552 41.887 1.00 0.00 ATOM 593 CA ARG 74 7.343 34.264 43.091 1.00 0.00 ATOM 594 CB ARG 74 6.171 34.958 43.778 1.00 0.00 ATOM 595 CG ARG 74 5.649 36.127 42.978 1.00 0.00 ATOM 596 CD ARG 74 4.282 36.588 43.480 1.00 0.00 ATOM 597 NE ARG 74 4.409 37.257 44.760 1.00 0.00 ATOM 598 CZ ARG 74 3.386 37.623 45.521 1.00 0.00 ATOM 599 NH1 ARG 74 2.133 37.352 45.151 1.00 0.00 ATOM 600 NH2 ARG 74 3.625 38.269 46.651 1.00 0.00 ATOM 601 O ARG 74 8.925 33.772 44.827 1.00 0.00 ATOM 602 C ARG 74 8.059 33.331 44.061 1.00 0.00 ATOM 603 N ILE 75 7.730 32.038 43.982 1.00 0.00 ATOM 604 CA ILE 75 8.254 31.041 44.928 1.00 0.00 ATOM 605 CB ILE 75 7.160 30.614 45.934 1.00 0.00 ATOM 606 CG1 ILE 75 5.950 30.025 45.205 1.00 0.00 ATOM 607 CG2 ILE 75 6.798 31.796 46.872 1.00 0.00 ATOM 608 CD1 ILE 75 4.932 29.339 46.118 1.00 0.00 ATOM 609 O ILE 75 9.738 29.126 44.921 1.00 0.00 ATOM 610 C ILE 75 8.928 29.812 44.277 1.00 0.00 ATOM 611 N SER 76 8.612 29.543 43.014 1.00 0.00 ATOM 612 CA SER 76 9.125 28.346 42.340 1.00 0.00 ATOM 613 CB SER 76 8.156 27.895 41.230 1.00 0.00 ATOM 614 OG SER 76 8.715 26.861 40.425 1.00 0.00 ATOM 615 O SER 76 11.049 29.549 41.521 1.00 0.00 ATOM 616 C SER 76 10.543 28.461 41.787 1.00 0.00 ATOM 617 N THR 77 11.166 27.300 41.589 1.00 0.00 ATOM 618 CA THR 77 12.478 27.211 40.995 1.00 0.00 ATOM 619 CB THR 77 13.351 26.145 41.705 1.00 0.00 ATOM 620 CG2 THR 77 13.579 26.544 43.180 1.00 0.00 ATOM 621 OG1 THR 77 12.699 24.861 41.647 1.00 0.00 ATOM 622 O THR 77 13.366 26.694 38.851 1.00 0.00 ATOM 623 C THR 77 12.354 26.823 39.533 1.00 0.00 ATOM 624 N GLN 78 11.124 26.633 39.060 1.00 0.00 ATOM 625 CA GLN 78 10.890 26.006 37.757 1.00 0.00 ATOM 626 CB GLN 78 9.746 24.995 37.840 1.00 0.00 ATOM 627 CG GLN 78 10.022 23.803 38.769 1.00 0.00 ATOM 628 CD GLN 78 11.261 23.030 38.374 1.00 0.00 ATOM 629 OE1 GLN 78 12.303 23.134 39.025 1.00 0.00 ATOM 630 NE2 GLN 78 11.163 22.258 37.297 1.00 0.00 ATOM 631 O GLN 78 9.963 28.055 36.984 1.00 0.00 ATOM 632 C GLN 78 10.585 27.042 36.699 1.00 0.00 ATOM 633 N THR 79 11.031 26.801 35.473 1.00 0.00 ATOM 634 CA THR 79 10.793 27.775 34.397 1.00 0.00 ATOM 635 CB THR 79 11.584 27.437 33.138 1.00 0.00 ATOM 636 CG2 THR 79 12.944 28.124 33.177 1.00 0.00 ATOM 637 OG1 THR 79 11.811 26.035 33.104 1.00 0.00 ATOM 638 O THR 79 8.837 29.085 33.914 1.00 0.00 ATOM 639 C THR 79 9.292 27.966 34.131 1.00 0.00 ATOM 640 N THR 80 8.523 26.882 34.224 1.00 0.00 ATOM 641 CA THR 80 7.057 26.952 34.093 1.00 0.00 ATOM 642 CB THR 80 6.554 26.242 32.797 1.00 0.00 ATOM 643 CG2 THR 80 5.093 26.595 32.533 1.00 0.00 ATOM 644 OG1 THR 80 7.353 26.661 31.688 1.00 0.00 ATOM 645 O THR 80 5.987 25.166 35.287 1.00 0.00 ATOM 646 C THR 80 6.372 26.343 35.314 1.00 0.00 ATOM 647 N PRO 81 6.207 27.142 36.391 1.00 0.00 ATOM 648 CA PRO 81 5.748 26.546 37.643 1.00 0.00 ATOM 649 CB PRO 81 5.737 27.735 38.626 1.00 0.00 ATOM 650 CG PRO 81 6.598 28.783 37.996 1.00 0.00 ATOM 651 CD PRO 81 6.417 28.597 36.521 1.00 0.00 ATOM 652 O PRO 81 3.498 26.411 36.799 1.00 0.00 ATOM 653 C PRO 81 4.354 25.936 37.556 1.00 0.00 ATOM 654 N GLN 82 4.166 24.864 38.317 1.00 0.00 ATOM 655 CA GLN 82 2.876 24.234 38.560 1.00 0.00 ATOM 656 CB GLN 82 3.039 22.712 38.629 1.00 0.00 ATOM 657 CG GLN 82 3.435 22.081 37.311 1.00 0.00 ATOM 658 CD GLN 82 3.612 20.583 37.430 1.00 0.00 ATOM 659 OE1 GLN 82 2.676 19.834 37.203 1.00 0.00 ATOM 660 NE2 GLN 82 4.807 20.144 37.807 1.00 0.00 ATOM 661 O GLN 82 3.104 24.968 40.835 1.00 0.00 ATOM 662 C GLN 82 2.330 24.745 39.894 1.00 0.00 ATOM 663 N PRO 83 1.007 24.905 40.003 1.00 0.00 ATOM 664 CA PRO 83 0.415 25.590 41.160 1.00 0.00 ATOM 665 CB PRO 83 -0.962 26.047 40.632 1.00 0.00 ATOM 666 CG PRO 83 -1.256 25.160 39.505 1.00 0.00 ATOM 667 CD PRO 83 -0.009 24.493 39.015 1.00 0.00 ATOM 668 O PRO 83 -0.790 24.821 43.087 1.00 0.00 ATOM 669 C PRO 83 0.267 24.789 42.461 1.00 0.00 ATOM 670 N LEU 84 1.326 24.079 42.860 1.00 0.00 ATOM 671 CA LEU 84 1.341 23.340 44.101 1.00 0.00 ATOM 672 CB LEU 84 0.670 21.957 43.904 1.00 0.00 ATOM 673 CG LEU 84 0.446 21.099 45.143 1.00 0.00 ATOM 674 CD1 LEU 84 -0.584 21.752 46.066 1.00 0.00 ATOM 675 CD2 LEU 84 0.025 19.661 44.701 1.00 0.00 ATOM 676 O LEU 84 3.633 22.730 43.724 1.00 0.00 ATOM 677 C LEU 84 2.809 23.171 44.517 1.00 0.00 ATOM 678 N MET 85 3.121 23.556 45.746 1.00 0.00 ATOM 679 CA MET 85 4.469 23.422 46.255 1.00 0.00 ATOM 680 CB MET 85 5.196 24.778 46.189 1.00 0.00 ATOM 681 CG MET 85 6.689 24.709 46.527 1.00 0.00 ATOM 682 SD MET 85 7.566 26.428 46.021 1.00 0.00 ATOM 683 CE MET 85 9.426 25.942 46.495 1.00 0.00 ATOM 684 O MET 85 3.593 23.514 48.484 1.00 0.00 ATOM 685 C MET 85 4.339 22.929 47.685 1.00 0.00 ATOM 686 N ALA 86 5.031 21.832 47.995 1.00 0.00 ATOM 687 CA ALA 86 5.031 21.245 49.343 1.00 0.00 ATOM 688 CB ALA 86 4.693 19.716 49.261 1.00 0.00 ATOM 689 O ALA 86 7.402 21.453 49.289 1.00 0.00 ATOM 690 C ALA 86 6.391 21.448 49.977 1.00 0.00 ATOM 691 N VAL 87 6.426 21.587 51.300 1.00 0.00 ATOM 692 CA VAL 87 7.680 21.566 52.007 1.00 0.00 ATOM 693 CB VAL 87 7.911 22.834 52.851 1.00 0.00 ATOM 694 CG1 VAL 87 9.218 22.673 53.657 1.00 0.00 ATOM 695 CG2 VAL 87 8.009 24.093 51.945 1.00 0.00 ATOM 696 O VAL 87 6.684 20.160 53.681 1.00 0.00 ATOM 697 C VAL 87 7.634 20.326 52.901 1.00 0.00 ATOM 698 N PHE 88 8.640 19.467 52.765 1.00 0.00 ATOM 699 CA PHE 88 8.759 18.253 53.571 1.00 0.00 ATOM 700 CB PHE 88 8.945 17.027 52.677 1.00 0.00 ATOM 701 CG PHE 88 7.750 16.701 51.828 1.00 0.00 ATOM 702 CD1 PHE 88 6.584 16.174 52.396 1.00 0.00 ATOM 703 CD2 PHE 88 7.808 16.868 50.451 1.00 0.00 ATOM 704 CE1 PHE 88 5.469 15.860 51.593 1.00 0.00 ATOM 705 CE2 PHE 88 6.709 16.526 49.637 1.00 0.00 ATOM 706 CZ PHE 88 5.540 16.028 50.220 1.00 0.00 ATOM 707 O PHE 88 10.959 19.006 54.082 1.00 0.00 ATOM 708 C PHE 88 9.977 18.339 54.443 1.00 0.00 ATOM 709 N ASP 89 9.937 17.632 55.578 1.00 0.00 ATOM 710 CA ASP 89 11.111 17.429 56.387 1.00 0.00 ATOM 711 CB ASP 89 10.746 16.664 57.663 1.00 0.00 ATOM 712 CG ASP 89 10.059 17.528 58.703 1.00 0.00 ATOM 713 OD1 ASP 89 9.903 18.756 58.495 1.00 0.00 ATOM 714 OD2 ASP 89 9.692 16.950 59.743 1.00 0.00 ATOM 715 O ASP 89 11.825 15.561 55.035 1.00 0.00 ATOM 716 C ASP 89 12.144 16.598 55.642 1.00 0.00 ATOM 717 N LEU 90 13.390 17.044 55.718 1.00 0.00 ATOM 718 CA LEU 90 14.519 16.252 55.289 1.00 0.00 ATOM 719 CB LEU 90 15.769 17.119 55.437 1.00 0.00 ATOM 720 CG LEU 90 16.960 17.036 54.499 1.00 0.00 ATOM 721 CD1 LEU 90 16.538 17.124 53.059 1.00 0.00 ATOM 722 CD2 LEU 90 17.918 18.172 54.831 1.00 0.00 ATOM 723 O LEU 90 14.517 15.185 57.439 1.00 0.00 ATOM 724 C LEU 90 14.574 15.029 56.217 1.00 0.00 ATOM 725 N PRO 91 14.635 13.808 55.651 1.00 0.00 ATOM 726 CA PRO 91 14.668 12.593 56.452 1.00 0.00 ATOM 727 CB PRO 91 14.955 11.490 55.430 1.00 0.00 ATOM 728 CG PRO 91 14.523 12.018 54.164 1.00 0.00 ATOM 729 CD PRO 91 14.652 13.515 54.211 1.00 0.00 ATOM 730 O PRO 91 16.872 13.183 57.140 1.00 0.00 ATOM 731 C PRO 91 15.801 12.661 57.454 1.00 0.00 ATOM 732 N ALA 92 15.543 12.181 58.660 1.00 0.00 ATOM 733 CA ALA 92 16.517 12.259 59.718 1.00 0.00 ATOM 734 CB ALA 92 15.920 11.743 61.021 1.00 0.00 ATOM 735 O ALA 92 17.655 10.180 59.450 1.00 0.00 ATOM 736 C ALA 92 17.684 11.402 59.271 1.00 0.00 ATOM 737 N GLU 93 18.695 12.054 58.683 1.00 0.00 ATOM 738 CA GLU 93 19.801 11.381 57.970 1.00 0.00 ATOM 739 CB GLU 93 21.013 12.304 57.820 1.00 0.00 ATOM 740 CG GLU 93 21.938 11.923 56.664 1.00 0.00 ATOM 741 CD GLU 93 22.738 13.102 56.134 1.00 0.00 ATOM 742 OE1 GLU 93 23.969 13.137 56.364 1.00 0.00 ATOM 743 OE2 GLU 93 22.139 13.991 55.488 1.00 0.00 ATOM 744 O GLU 93 20.754 9.870 59.602 1.00 0.00 ATOM 745 C GLU 93 20.200 10.000 58.506 1.00 0.00 ATOM 746 N PRO 94 19.926 8.957 57.707 1.00 0.00 ATOM 747 CA PRO 94 19.987 7.606 58.242 1.00 0.00 ATOM 748 CB PRO 94 19.003 6.849 57.349 1.00 0.00 ATOM 749 CG PRO 94 19.126 7.537 55.998 1.00 0.00 ATOM 750 CD PRO 94 19.554 8.973 56.277 1.00 0.00 ATOM 751 O PRO 94 22.229 7.356 57.377 1.00 0.00 ATOM 752 C PRO 94 21.379 6.962 58.186 1.00 0.00 ATOM 753 N GLU 95 21.601 6.012 59.087 1.00 0.00 ATOM 754 CA GLU 95 22.648 5.032 58.912 1.00 0.00 ATOM 755 CB GLU 95 22.506 3.934 59.961 1.00 0.00 ATOM 756 CG GLU 95 23.638 3.808 60.919 1.00 0.00 ATOM 757 CD GLU 95 24.977 3.748 60.237 1.00 0.00 ATOM 758 OE1 GLU 95 25.206 2.809 59.420 1.00 0.00 ATOM 759 OE2 GLU 95 25.795 4.649 60.537 1.00 0.00 ATOM 760 O GLU 95 21.280 4.195 57.115 1.00 0.00 ATOM 761 C GLU 95 22.434 4.411 57.528 1.00 0.00 ATOM 762 N PRO 96 23.522 4.174 56.775 1.00 0.00 ATOM 763 CA PRO 96 23.305 3.431 55.529 1.00 0.00 ATOM 764 CB PRO 96 24.693 3.409 54.886 1.00 0.00 ATOM 765 CG PRO 96 25.644 3.633 55.997 1.00 0.00 ATOM 766 CD PRO 96 24.935 4.552 56.951 1.00 0.00 ATOM 767 O PRO 96 23.376 1.364 56.748 1.00 0.00 ATOM 768 C PRO 96 22.855 2.002 55.827 1.00 0.00 ATOM 769 N VAL 97 21.912 1.518 55.027 1.00 0.00 ATOM 770 CA VAL 97 21.306 0.225 55.200 1.00 0.00 ATOM 771 CB VAL 97 19.780 0.400 55.544 1.00 0.00 ATOM 772 CG1 VAL 97 18.984 -0.874 55.284 1.00 0.00 ATOM 773 CG2 VAL 97 19.602 0.886 56.999 1.00 0.00 ATOM 774 O VAL 97 21.411 0.069 52.787 1.00 0.00 ATOM 775 C VAL 97 21.513 -0.533 53.878 1.00 0.00 ATOM 776 N VAL 98 21.858 -1.818 53.970 1.00 0.00 ATOM 777 CA VAL 98 21.876 -2.703 52.780 1.00 0.00 ATOM 778 CB VAL 98 23.152 -3.611 52.680 1.00 0.00 ATOM 779 CG1 VAL 98 23.143 -4.435 51.355 1.00 0.00 ATOM 780 CG2 VAL 98 24.441 -2.800 52.753 1.00 0.00 ATOM 781 O VAL 98 20.514 -4.403 53.743 1.00 0.00 ATOM 782 C VAL 98 20.645 -3.599 52.832 1.00 0.00 ATOM 783 N GLU 99 19.730 -3.471 51.864 1.00 0.00 ATOM 784 CA GLU 99 18.600 -4.408 51.785 1.00 0.00 ATOM 785 CB GLU 99 17.280 -3.801 52.303 1.00 0.00 ATOM 786 CG GLU 99 17.286 -3.561 53.826 1.00 0.00 ATOM 787 CD GLU 99 16.081 -2.785 54.384 1.00 0.00 ATOM 788 OE1 GLU 99 15.690 -3.118 55.534 1.00 0.00 ATOM 789 OE2 GLU 99 15.556 -1.848 53.713 1.00 0.00 ATOM 790 O GLU 99 18.076 -3.903 49.524 1.00 0.00 ATOM 791 C GLU 99 18.507 -4.733 50.307 1.00 0.00 ATOM 792 N GLY 100 18.974 -5.920 49.934 1.00 0.00 ATOM 793 CA GLY 100 19.142 -6.266 48.536 1.00 0.00 ATOM 794 O GLY 100 21.099 -4.833 48.516 1.00 0.00 ATOM 795 C GLY 100 20.245 -5.465 47.857 1.00 0.00 ATOM 796 N LEU 101 20.228 -5.482 46.527 1.00 0.00 ATOM 797 CA LEU 101 21.197 -4.746 45.762 1.00 0.00 ATOM 798 CB LEU 101 20.939 -4.964 44.266 1.00 0.00 ATOM 799 CG LEU 101 21.760 -4.083 43.333 1.00 0.00 ATOM 800 CD1 LEU 101 23.297 -4.354 43.583 1.00 0.00 ATOM 801 CD2 LEU 101 21.334 -4.392 41.875 1.00 0.00 ATOM 802 O LEU 101 19.970 -2.668 46.030 1.00 0.00 ATOM 803 C LEU 101 21.072 -3.258 46.109 1.00 0.00 ATOM 804 N THR 102 22.209 -2.679 46.471 1.00 0.00 ATOM 805 CA THR 102 22.296 -1.327 46.989 1.00 0.00 ATOM 806 CB THR 102 22.739 -1.386 48.461 1.00 0.00 ATOM 807 CG2 THR 102 22.917 0.032 49.068 1.00 0.00 ATOM 808 OG1 THR 102 21.748 -2.112 49.206 1.00 0.00 ATOM 809 O THR 102 24.459 -1.067 46.000 1.00 0.00 ATOM 810 C THR 102 23.330 -0.589 46.157 1.00 0.00 ATOM 811 N LEU 103 22.946 0.569 45.617 1.00 0.00 ATOM 812 CA LEU 103 23.841 1.369 44.802 1.00 0.00 ATOM 813 CB LEU 103 23.069 2.144 43.721 1.00 0.00 ATOM 814 CG LEU 103 22.163 1.299 42.858 1.00 0.00 ATOM 815 CD1 LEU 103 21.543 2.250 41.813 1.00 0.00 ATOM 816 CD2 LEU 103 22.961 0.140 42.214 1.00 0.00 ATOM 817 O LEU 103 24.061 2.911 46.623 1.00 0.00 ATOM 818 C LEU 103 24.609 2.345 45.650 1.00 0.00 ATOM 819 N LEU 104 25.890 2.506 45.321 1.00 0.00 ATOM 820 CA LEU 104 26.663 3.587 45.885 1.00 0.00 ATOM 821 CB LEU 104 27.827 3.065 46.740 1.00 0.00 ATOM 822 CG LEU 104 28.653 4.096 47.541 1.00 0.00 ATOM 823 CD1 LEU 104 29.598 4.893 46.674 1.00 0.00 ATOM 824 CD2 LEU 104 27.813 5.040 48.323 1.00 0.00 ATOM 825 O LEU 104 27.840 3.948 43.828 1.00 0.00 ATOM 826 C LEU 104 27.180 4.445 44.735 1.00 0.00 ATOM 827 N LEU 105 26.869 5.728 44.787 1.00 0.00 ATOM 828 CA LEU 105 27.325 6.674 43.773 1.00 0.00 ATOM 829 CB LEU 105 26.221 7.677 43.443 1.00 0.00 ATOM 830 CG LEU 105 24.874 7.068 43.040 1.00 0.00 ATOM 831 CD1 LEU 105 24.037 8.182 42.429 1.00 0.00 ATOM 832 CD2 LEU 105 25.057 5.886 42.049 1.00 0.00 ATOM 833 O LEU 105 28.396 8.214 45.254 1.00 0.00 ATOM 834 C LEU 105 28.529 7.398 44.337 1.00 0.00 ATOM 835 N ASP 106 29.710 7.099 43.795 1.00 0.00 ATOM 836 CA ASP 106 30.980 7.707 44.282 1.00 0.00 ATOM 837 CB ASP 106 32.131 6.678 44.184 1.00 0.00 ATOM 838 CG ASP 106 33.485 7.238 44.623 1.00 0.00 ATOM 839 OD1 ASP 106 33.518 8.177 45.447 1.00 0.00 ATOM 840 OD2 ASP 106 34.542 6.713 44.173 1.00 0.00 ATOM 841 O ASP 106 31.906 8.726 42.329 1.00 0.00 ATOM 842 C ASP 106 31.336 8.913 43.409 1.00 0.00 ATOM 843 N GLY 107 31.015 10.126 43.857 1.00 0.00 ATOM 844 CA GLY 107 31.392 11.340 43.116 1.00 0.00 ATOM 845 O GLY 107 31.184 12.035 40.825 1.00 0.00 ATOM 846 C GLY 107 30.639 11.516 41.804 1.00 0.00 ATOM 847 N VAL 108 29.368 11.112 41.793 1.00 0.00 ATOM 848 CA VAL 108 28.501 11.289 40.627 1.00 0.00 ATOM 849 CB VAL 108 27.455 10.172 40.510 1.00 0.00 ATOM 850 CG1 VAL 108 26.505 10.439 39.316 1.00 0.00 ATOM 851 CG2 VAL 108 28.148 8.833 40.301 1.00 0.00 ATOM 852 O VAL 108 26.824 12.829 41.481 1.00 0.00 ATOM 853 C VAL 108 27.861 12.670 40.808 1.00 0.00 ATOM 854 N GLN 109 28.527 13.672 40.241 1.00 0.00 ATOM 855 CA GLN 109 28.212 15.071 40.532 1.00 0.00 ATOM 856 CB GLN 109 29.426 15.976 40.301 1.00 0.00 ATOM 857 CG GLN 109 30.708 15.344 40.781 1.00 0.00 ATOM 858 CD GLN 109 31.746 16.342 41.211 1.00 0.00 ATOM 859 OE1 GLN 109 31.890 17.416 40.609 1.00 0.00 ATOM 860 NE2 GLN 109 32.482 16.000 42.271 1.00 0.00 ATOM 861 O GLN 109 26.345 16.497 40.170 1.00 0.00 ATOM 862 C GLN 109 27.030 15.585 39.737 1.00 0.00 ATOM 863 N ASP 110 26.789 15.016 38.571 1.00 0.00 ATOM 864 CA ASP 110 25.791 15.589 37.687 1.00 0.00 ATOM 865 CB ASP 110 25.974 15.073 36.264 1.00 0.00 ATOM 866 CG ASP 110 24.977 15.698 35.298 1.00 0.00 ATOM 867 OD1 ASP 110 25.129 16.878 34.982 1.00 0.00 ATOM 868 OD2 ASP 110 24.027 15.012 34.886 1.00 0.00 ATOM 869 O ASP 110 23.992 14.146 38.337 1.00 0.00 ATOM 870 C ASP 110 24.369 15.299 38.179 1.00 0.00 ATOM 871 N PRO 111 23.585 16.361 38.436 1.00 0.00 ATOM 872 CA PRO 111 22.188 16.219 38.860 1.00 0.00 ATOM 873 CB PRO 111 21.690 17.679 38.932 1.00 0.00 ATOM 874 CG PRO 111 22.907 18.477 39.113 1.00 0.00 ATOM 875 CD PRO 111 24.007 17.773 38.397 1.00 0.00 ATOM 876 O PRO 111 20.537 14.582 38.327 1.00 0.00 ATOM 877 C PRO 111 21.348 15.398 37.890 1.00 0.00 ATOM 878 N GLY 112 21.538 15.614 36.585 1.00 0.00 ATOM 879 CA GLY 112 20.844 14.822 35.565 1.00 0.00 ATOM 880 O GLY 112 20.144 12.542 35.734 1.00 0.00 ATOM 881 C GLY 112 21.096 13.338 35.719 1.00 0.00 ATOM 882 N ASN 113 22.375 12.958 35.819 1.00 0.00 ATOM 883 CA ASN 113 22.762 11.564 35.990 1.00 0.00 ATOM 884 CB ASN 113 24.293 11.397 35.994 1.00 0.00 ATOM 885 CG ASN 113 24.905 11.618 34.617 1.00 0.00 ATOM 886 ND2 ASN 113 26.186 11.990 34.576 1.00 0.00 ATOM 887 OD1 ASN 113 24.226 11.487 33.602 1.00 0.00 ATOM 888 O ASN 113 21.652 9.841 37.241 1.00 0.00 ATOM 889 C ASN 113 22.158 10.972 37.267 1.00 0.00 ATOM 890 N VAL 114 22.176 11.739 38.368 1.00 0.00 ATOM 891 CA VAL 114 21.678 11.200 39.637 1.00 0.00 ATOM 892 CB VAL 114 22.049 12.082 40.871 1.00 0.00 ATOM 893 CG1 VAL 114 21.306 11.605 42.134 1.00 0.00 ATOM 894 CG2 VAL 114 23.587 12.066 41.125 1.00 0.00 ATOM 895 O VAL 114 19.699 9.883 39.963 1.00 0.00 ATOM 896 C VAL 114 20.174 10.942 39.546 1.00 0.00 ATOM 897 N GLY 115 19.437 11.890 38.963 1.00 0.00 ATOM 898 CA GLY 115 18.000 11.723 38.737 1.00 0.00 ATOM 899 O GLY 115 16.749 9.748 38.190 1.00 0.00 ATOM 900 C GLY 115 17.689 10.501 37.895 1.00 0.00 ATOM 901 N THR 116 18.423 10.348 36.798 1.00 0.00 ATOM 902 CA THR 116 18.226 9.192 35.931 1.00 0.00 ATOM 903 CB THR 116 19.106 9.280 34.678 1.00 0.00 ATOM 904 CG2 THR 116 18.880 8.077 33.758 1.00 0.00 ATOM 905 OG1 THR 116 18.771 10.487 33.972 1.00 0.00 ATOM 906 O THR 116 17.738 6.916 36.534 1.00 0.00 ATOM 907 C THR 116 18.477 7.895 36.704 1.00 0.00 ATOM 908 N ILE 117 19.544 7.874 37.493 1.00 0.00 ATOM 909 CA ILE 117 19.891 6.704 38.310 1.00 0.00 ATOM 910 CB ILE 117 21.272 6.846 38.992 1.00 0.00 ATOM 911 CG1 ILE 117 22.348 6.636 37.929 1.00 0.00 ATOM 912 CG2 ILE 117 21.447 5.803 40.130 1.00 0.00 ATOM 913 CD1 ILE 117 23.724 7.270 38.318 1.00 0.00 ATOM 914 O ILE 117 18.414 5.234 39.472 1.00 0.00 ATOM 915 C ILE 117 18.783 6.400 39.310 1.00 0.00 ATOM 916 N LEU 118 18.268 7.433 39.983 1.00 0.00 ATOM 917 CA LEU 118 17.135 7.226 40.892 1.00 0.00 ATOM 918 CB LEU 118 16.705 8.534 41.577 1.00 0.00 ATOM 919 CG LEU 118 17.686 9.115 42.606 1.00 0.00 ATOM 920 CD1 LEU 118 17.140 10.469 43.104 1.00 0.00 ATOM 921 CD2 LEU 118 17.878 8.133 43.784 1.00 0.00 ATOM 922 O LEU 118 15.264 5.725 40.765 1.00 0.00 ATOM 923 C LEU 118 15.934 6.580 40.190 1.00 0.00 ATOM 924 N ARG 119 15.604 7.055 38.982 1.00 0.00 ATOM 925 CA ARG 119 14.486 6.482 38.223 1.00 0.00 ATOM 926 CB ARG 119 14.181 7.314 36.976 1.00 0.00 ATOM 927 CG ARG 119 13.732 8.726 37.325 1.00 0.00 ATOM 928 CD ARG 119 13.453 9.590 36.097 1.00 0.00 ATOM 929 NE ARG 119 12.705 8.827 35.114 1.00 0.00 ATOM 930 CZ ARG 119 12.321 9.273 33.922 1.00 0.00 ATOM 931 NH1 ARG 119 12.587 10.520 33.536 1.00 0.00 ATOM 932 NH2 ARG 119 11.661 8.458 33.115 1.00 0.00 ATOM 933 O ARG 119 13.838 4.184 37.881 1.00 0.00 ATOM 934 C ARG 119 14.752 5.031 37.837 1.00 0.00 ATOM 935 N THR 120 15.988 4.739 37.446 1.00 0.00 ATOM 936 CA THR 120 16.386 3.361 37.140 1.00 0.00 ATOM 937 CB THR 120 17.830 3.316 36.596 1.00 0.00 ATOM 938 CG2 THR 120 18.385 1.859 36.594 1.00 0.00 ATOM 939 OG1 THR 120 17.827 3.826 35.261 1.00 0.00 ATOM 940 O THR 120 15.741 1.366 38.294 1.00 0.00 ATOM 941 C THR 120 16.285 2.459 38.372 1.00 0.00 ATOM 942 N ALA 121 16.800 2.935 39.506 1.00 0.00 ATOM 943 CA ALA 121 16.707 2.214 40.779 1.00 0.00 ATOM 944 CB ALA 121 17.366 3.050 41.903 1.00 0.00 ATOM 945 O ALA 121 14.875 0.799 41.470 1.00 0.00 ATOM 946 C ALA 121 15.230 1.916 41.111 1.00 0.00 ATOM 947 N ASP 122 14.360 2.902 40.943 1.00 0.00 ATOM 948 CA ASP 122 12.949 2.694 41.196 1.00 0.00 ATOM 949 CB ASP 122 12.166 4.019 41.139 1.00 0.00 ATOM 950 CG ASP 122 10.744 3.882 41.634 1.00 0.00 ATOM 951 OD1 ASP 122 10.451 3.047 42.519 1.00 0.00 ATOM 952 OD2 ASP 122 9.896 4.624 41.138 1.00 0.00 ATOM 953 O ASP 122 11.626 0.768 40.685 1.00 0.00 ATOM 954 C ASP 122 12.359 1.665 40.239 1.00 0.00 ATOM 955 N TRP 123 12.650 1.802 38.945 1.00 0.00 ATOM 956 CA TRP 123 12.134 0.878 37.923 1.00 0.00 ATOM 957 CB TRP 123 12.752 1.200 36.541 1.00 0.00 ATOM 958 CG TRP 123 12.075 0.462 35.406 1.00 0.00 ATOM 959 CD1 TRP 123 12.370 -0.788 34.912 1.00 0.00 ATOM 960 CD2 TRP 123 10.966 0.939 34.655 1.00 0.00 ATOM 961 CE2 TRP 123 10.633 -0.063 33.711 1.00 0.00 ATOM 962 CE3 TRP 123 10.222 2.130 34.682 1.00 0.00 ATOM 963 NE1 TRP 123 11.506 -1.107 33.888 1.00 0.00 ATOM 964 CZ2 TRP 123 9.592 0.095 32.797 1.00 0.00 ATOM 965 CZ3 TRP 123 9.176 2.278 33.787 1.00 0.00 ATOM 966 CH2 TRP 123 8.875 1.263 32.852 1.00 0.00 ATOM 967 O TRP 123 11.576 -1.468 38.158 1.00 0.00 ATOM 968 C TRP 123 12.436 -0.592 38.291 1.00 0.00 ATOM 969 N PHE 124 13.679 -0.854 38.709 1.00 0.00 ATOM 970 CA PHE 124 14.129 -2.235 38.976 1.00 0.00 ATOM 971 CB PHE 124 15.568 -2.390 38.528 1.00 0.00 ATOM 972 CG PHE 124 15.703 -2.391 37.018 1.00 0.00 ATOM 973 CD1 PHE 124 15.223 -3.472 36.267 1.00 0.00 ATOM 974 CD2 PHE 124 16.227 -1.281 36.359 1.00 0.00 ATOM 975 CE1 PHE 124 15.299 -3.478 34.864 1.00 0.00 ATOM 976 CE2 PHE 124 16.346 -1.293 34.952 1.00 0.00 ATOM 977 CZ PHE 124 15.865 -2.379 34.220 1.00 0.00 ATOM 978 O PHE 124 14.231 -3.850 40.791 1.00 0.00 ATOM 979 C PHE 124 13.946 -2.688 40.432 1.00 0.00 ATOM 980 N GLY 125 13.480 -1.779 41.270 1.00 0.00 ATOM 981 CA GLY 125 13.092 -2.118 42.654 1.00 0.00 ATOM 982 O GLY 125 14.235 -2.741 44.682 1.00 0.00 ATOM 983 C GLY 125 14.268 -2.078 43.631 1.00 0.00 ATOM 984 N ILE 126 15.314 -1.314 43.290 1.00 0.00 ATOM 985 CA ILE 126 16.393 -1.024 44.232 1.00 0.00 ATOM 986 CB ILE 126 17.521 -0.157 43.556 1.00 0.00 ATOM 987 CG1 ILE 126 18.206 -0.928 42.409 1.00 0.00 ATOM 988 CG2 ILE 126 18.510 0.434 44.614 1.00 0.00 ATOM 989 CD1 ILE 126 19.498 -1.568 42.700 1.00 0.00 ATOM 990 O ILE 126 15.121 0.740 45.267 1.00 0.00 ATOM 991 C ILE 126 15.839 -0.244 45.437 1.00 0.00 ATOM 992 N ARG 127 16.114 -0.693 46.651 1.00 0.00 ATOM 993 CA ARG 127 15.533 -0.024 47.817 1.00 0.00 ATOM 994 CB ARG 127 15.165 -1.064 48.877 1.00 0.00 ATOM 995 CG ARG 127 13.982 -1.937 48.393 1.00 0.00 ATOM 996 CD ARG 127 14.004 -3.270 49.053 1.00 0.00 ATOM 997 NE ARG 127 13.730 -3.170 50.482 1.00 0.00 ATOM 998 CZ ARG 127 13.166 -4.139 51.184 1.00 0.00 ATOM 999 NH1 ARG 127 12.809 -5.255 50.563 1.00 0.00 ATOM 1000 NH2 ARG 127 12.941 -3.990 52.485 1.00 0.00 ATOM 1001 O ARG 127 15.857 1.902 49.195 1.00 0.00 ATOM 1002 C ARG 127 16.380 1.055 48.437 1.00 0.00 ATOM 1003 N HIS 128 17.684 1.030 48.149 1.00 0.00 ATOM 1004 CA HIS 128 18.615 1.964 48.799 1.00 0.00 ATOM 1005 CB HIS 128 19.345 1.315 50.011 1.00 0.00 ATOM 1006 CG HIS 128 18.430 0.997 51.140 1.00 0.00 ATOM 1007 CD2 HIS 128 17.725 -0.122 51.428 1.00 0.00 ATOM 1008 ND1 HIS 128 18.087 1.925 52.094 1.00 0.00 ATOM 1009 CE1 HIS 128 17.229 1.382 52.943 1.00 0.00 ATOM 1010 NE2 HIS 128 16.994 0.140 52.562 1.00 0.00 ATOM 1011 O HIS 128 20.216 1.648 47.098 1.00 0.00 ATOM 1012 C HIS 128 19.637 2.443 47.846 1.00 0.00 ATOM 1013 N VAL 129 19.865 3.754 47.876 1.00 0.00 ATOM 1014 CA VAL 129 20.899 4.380 47.029 1.00 0.00 ATOM 1015 CB VAL 129 20.321 5.226 45.843 1.00 0.00 ATOM 1016 CG1 VAL 129 21.432 6.012 45.134 1.00 0.00 ATOM 1017 CG2 VAL 129 19.567 4.335 44.826 1.00 0.00 ATOM 1018 O VAL 129 21.180 6.181 48.625 1.00 0.00 ATOM 1019 C VAL 129 21.709 5.259 47.974 1.00 0.00 ATOM 1020 N TRP 130 23.000 4.971 48.056 1.00 0.00 ATOM 1021 CA TRP 130 23.868 5.746 48.902 1.00 0.00 ATOM 1022 CB TRP 130 24.881 4.842 49.629 1.00 0.00 ATOM 1023 CG TRP 130 24.327 3.723 50.470 1.00 0.00 ATOM 1024 CD1 TRP 130 23.043 3.560 50.942 1.00 0.00 ATOM 1025 CD2 TRP 130 25.094 2.667 50.991 1.00 0.00 ATOM 1026 CE2 TRP 130 24.230 1.837 51.734 1.00 0.00 ATOM 1027 CE3 TRP 130 26.447 2.313 50.868 1.00 0.00 ATOM 1028 NE1 TRP 130 22.977 2.405 51.698 1.00 0.00 ATOM 1029 CZ2 TRP 130 24.674 0.668 52.361 1.00 0.00 ATOM 1030 CZ3 TRP 130 26.898 1.146 51.501 1.00 0.00 ATOM 1031 CH2 TRP 130 26.001 0.346 52.254 1.00 0.00 ATOM 1032 O TRP 130 24.976 6.443 46.903 1.00 0.00 ATOM 1033 C TRP 130 24.648 6.731 48.061 1.00 0.00 ATOM 1034 N LEU 131 24.957 7.881 48.636 1.00 0.00 ATOM 1035 CA LEU 131 25.629 8.944 47.895 1.00 0.00 ATOM 1036 CB LEU 131 24.704 10.173 47.777 1.00 0.00 ATOM 1037 CG LEU 131 23.468 9.702 47.021 1.00 0.00 ATOM 1038 CD1 LEU 131 22.151 9.942 47.771 1.00 0.00 ATOM 1039 CD2 LEU 131 23.436 10.140 45.569 1.00 0.00 ATOM 1040 O LEU 131 27.008 9.767 49.709 1.00 0.00 ATOM 1041 C LEU 131 26.952 9.296 48.558 1.00 0.00 ATOM 1042 N GLY 132 28.040 9.046 47.853 1.00 0.00 ATOM 1043 CA GLY 132 29.350 9.309 48.435 1.00 0.00 ATOM 1044 O GLY 132 29.104 11.560 47.679 1.00 0.00 ATOM 1045 C GLY 132 29.842 10.712 48.181 1.00 0.00 ATOM 1046 N THR 133 31.119 10.921 48.501 1.00 0.00 ATOM 1047 CA THR 133 31.808 12.187 48.401 1.00 0.00 ATOM 1048 CB THR 133 33.345 11.972 48.609 1.00 0.00 ATOM 1049 CG2 THR 133 34.143 13.286 48.460 1.00 0.00 ATOM 1050 OG1 THR 133 33.574 11.419 49.910 1.00 0.00 ATOM 1051 O THR 133 31.947 12.308 46.025 1.00 0.00 ATOM 1052 C THR 133 31.597 12.864 47.057 1.00 0.00 ATOM 1053 N GLY 134 31.022 14.056 47.079 1.00 0.00 ATOM 1054 CA GLY 134 30.949 14.867 45.882 1.00 0.00 ATOM 1055 O GLY 134 29.629 15.178 43.931 1.00 0.00 ATOM 1056 C GLY 134 29.772 14.550 44.970 1.00 0.00 ATOM 1057 N SER 135 28.925 13.609 45.351 1.00 0.00 ATOM 1058 CA SER 135 27.710 13.315 44.557 1.00 0.00 ATOM 1059 CB SER 135 27.145 11.946 44.921 1.00 0.00 ATOM 1060 OG SER 135 28.049 10.934 44.490 1.00 0.00 ATOM 1061 O SER 135 26.648 15.184 45.656 1.00 0.00 ATOM 1062 C SER 135 26.647 14.415 44.692 1.00 0.00 ATOM 1063 N ALA 136 25.788 14.535 43.688 1.00 0.00 ATOM 1064 CA ALA 136 24.735 15.564 43.676 1.00 0.00 ATOM 1065 CB ALA 136 23.942 15.505 42.361 1.00 0.00 ATOM 1066 O ALA 136 23.640 14.307 45.395 1.00 0.00 ATOM 1067 C ALA 136 23.803 15.409 44.873 1.00 0.00 ATOM 1068 N ASP 137 23.211 16.514 45.315 1.00 0.00 ATOM 1069 CA ASP 137 22.270 16.501 46.436 1.00 0.00 ATOM 1070 CB ASP 137 22.153 17.930 47.027 1.00 0.00 ATOM 1071 CG ASP 137 21.221 18.020 48.242 1.00 0.00 ATOM 1072 OD1 ASP 137 20.549 17.040 48.614 1.00 0.00 ATOM 1073 OD2 ASP 137 21.170 19.105 48.848 1.00 0.00 ATOM 1074 O ASP 137 20.254 16.693 45.150 1.00 0.00 ATOM 1075 C ASP 137 20.901 16.001 45.931 1.00 0.00 ATOM 1076 N VAL 138 20.450 14.835 46.389 1.00 0.00 ATOM 1077 CA VAL 138 19.184 14.251 45.888 1.00 0.00 ATOM 1078 CB VAL 138 18.947 12.776 46.325 1.00 0.00 ATOM 1079 CG1 VAL 138 19.959 11.856 45.664 1.00 0.00 ATOM 1080 CG2 VAL 138 18.972 12.641 47.865 1.00 0.00 ATOM 1081 O VAL 138 16.934 15.012 45.527 1.00 0.00 ATOM 1082 C VAL 138 17.950 15.094 46.230 1.00 0.00 ATOM 1083 N PHE 139 18.060 15.912 47.275 1.00 0.00 ATOM 1084 CA PHE 139 16.948 16.762 47.712 1.00 0.00 ATOM 1085 CB PHE 139 16.849 16.777 49.231 1.00 0.00 ATOM 1086 CG PHE 139 16.519 15.422 49.801 1.00 0.00 ATOM 1087 CD1 PHE 139 15.263 14.861 49.587 1.00 0.00 ATOM 1088 CD2 PHE 139 17.471 14.699 50.510 1.00 0.00 ATOM 1089 CE1 PHE 139 14.952 13.595 50.069 1.00 0.00 ATOM 1090 CE2 PHE 139 17.163 13.430 51.015 1.00 0.00 ATOM 1091 CZ PHE 139 15.905 12.883 50.790 1.00 0.00 ATOM 1092 O PHE 139 16.148 19.015 47.456 1.00 0.00 ATOM 1093 C PHE 139 16.987 18.164 47.124 1.00 0.00 ATOM 1094 N SER 140 17.963 18.410 46.252 1.00 0.00 ATOM 1095 CA SER 140 18.028 19.687 45.521 1.00 0.00 ATOM 1096 CB SER 140 19.364 19.828 44.776 1.00 0.00 ATOM 1097 OG SER 140 19.465 18.820 43.772 1.00 0.00 ATOM 1098 O SER 140 16.454 18.598 44.096 1.00 0.00 ATOM 1099 C SER 140 16.846 19.671 44.534 1.00 0.00 ATOM 1100 N PRO 141 16.246 20.845 44.235 1.00 0.00 ATOM 1101 CA PRO 141 15.156 20.938 43.258 1.00 0.00 ATOM 1102 CB PRO 141 15.034 22.436 43.022 1.00 0.00 ATOM 1103 CG PRO 141 15.462 23.051 44.315 1.00 0.00 ATOM 1104 CD PRO 141 16.539 22.155 44.855 1.00 0.00 ATOM 1105 O PRO 141 14.596 19.633 41.321 1.00 0.00 ATOM 1106 C PRO 141 15.472 20.256 41.929 1.00 0.00 ATOM 1107 N LYS 142 16.709 20.392 41.461 1.00 0.00 ATOM 1108 CA LYS 142 17.024 19.830 40.154 1.00 0.00 ATOM 1109 CB LYS 142 18.411 20.260 39.670 1.00 0.00 ATOM 1110 CG LYS 142 18.675 19.847 38.218 1.00 0.00 ATOM 1111 CD LYS 142 19.456 20.906 37.434 1.00 0.00 ATOM 1112 CE LYS 142 19.423 20.608 35.929 1.00 0.00 ATOM 1113 NZ LYS 142 19.903 21.768 35.076 1.00 0.00 ATOM 1114 O LYS 142 16.197 17.743 39.251 1.00 0.00 ATOM 1115 C LYS 142 16.839 18.300 40.158 1.00 0.00 ATOM 1116 N VAL 143 17.350 17.627 41.183 1.00 0.00 ATOM 1117 CA VAL 143 17.150 16.183 41.281 1.00 0.00 ATOM 1118 CB VAL 143 18.087 15.521 42.300 1.00 0.00 ATOM 1119 CG1 VAL 143 17.762 13.990 42.425 1.00 0.00 ATOM 1120 CG2 VAL 143 19.556 15.776 41.879 1.00 0.00 ATOM 1121 O VAL 143 15.139 14.972 40.875 1.00 0.00 ATOM 1122 C VAL 143 15.707 15.804 41.577 1.00 0.00 ATOM 1123 N VAL 144 15.110 16.441 42.588 1.00 0.00 ATOM 1124 CA VAL 144 13.732 16.134 42.998 1.00 0.00 ATOM 1125 CB VAL 144 13.236 17.090 44.125 1.00 0.00 ATOM 1126 CG1 VAL 144 11.708 17.064 44.252 1.00 0.00 ATOM 1127 CG2 VAL 144 13.912 16.717 45.451 1.00 0.00 ATOM 1128 O VAL 144 12.020 15.259 41.552 1.00 0.00 ATOM 1129 C VAL 144 12.767 16.212 41.825 1.00 0.00 ATOM 1130 N GLN 145 12.778 17.349 41.133 1.00 0.00 ATOM 1131 CA GLN 145 11.841 17.573 40.050 1.00 0.00 ATOM 1132 CB GLN 145 11.900 19.020 39.562 1.00 0.00 ATOM 1133 CG GLN 145 11.458 20.009 40.654 1.00 0.00 ATOM 1134 CD GLN 145 10.054 19.736 41.202 1.00 0.00 ATOM 1135 OE1 GLN 145 9.874 19.665 42.405 1.00 0.00 ATOM 1136 NE2 GLN 145 9.060 19.607 40.316 1.00 0.00 ATOM 1137 O GLN 145 11.084 16.396 38.108 1.00 0.00 ATOM 1138 C GLN 145 12.020 16.595 38.878 1.00 0.00 ATOM 1139 N ALA 146 13.206 16.000 38.762 1.00 0.00 ATOM 1140 CA ALA 146 13.490 15.031 37.698 1.00 0.00 ATOM 1141 CB ALA 146 14.871 15.287 37.122 1.00 0.00 ATOM 1142 O ALA 146 13.740 12.647 37.454 1.00 0.00 ATOM 1143 C ALA 146 13.384 13.582 38.194 1.00 0.00 ATOM 1144 N SER 147 12.881 13.399 39.419 1.00 0.00 ATOM 1145 CA SER 147 12.908 12.081 40.071 1.00 0.00 ATOM 1146 CB SER 147 12.978 12.252 41.614 1.00 0.00 ATOM 1147 OG SER 147 11.755 12.771 42.124 1.00 0.00 ATOM 1148 O SER 147 11.878 9.901 39.944 1.00 0.00 ATOM 1149 C SER 147 11.779 11.106 39.669 1.00 0.00 ATOM 1150 N MET 148 10.720 11.610 39.034 1.00 0.00 ATOM 1151 CA MET 148 9.580 10.771 38.600 1.00 0.00 ATOM 1152 CB MET 148 10.000 9.775 37.501 1.00 0.00 ATOM 1153 CG MET 148 9.553 10.109 36.082 1.00 0.00 ATOM 1154 SD MET 148 8.663 8.621 35.087 1.00 0.00 ATOM 1155 CE MET 148 9.208 7.047 36.118 1.00 0.00 ATOM 1156 O MET 148 8.390 8.901 39.541 1.00 0.00 ATOM 1157 C MET 148 8.927 9.993 39.750 1.00 0.00 ATOM 1158 N GLY 149 8.988 10.548 40.960 1.00 0.00 ATOM 1159 CA GLY 149 8.416 9.892 42.130 1.00 0.00 ATOM 1160 O GLY 149 8.899 8.190 43.723 1.00 0.00 ATOM 1161 C GLY 149 9.321 8.873 42.789 1.00 0.00 ATOM 1162 N ALA 150 10.567 8.764 42.321 1.00 0.00 ATOM 1163 CA ALA 150 11.441 7.684 42.817 1.00 0.00 ATOM 1164 CB ALA 150 12.756 7.647 42.053 1.00 0.00 ATOM 1165 O ALA 150 11.911 6.720 45.009 1.00 0.00 ATOM 1166 C ALA 150 11.701 7.759 44.340 1.00 0.00 ATOM 1167 N LEU 151 11.667 8.969 44.888 1.00 0.00 ATOM 1168 CA LEU 151 11.917 9.153 46.319 1.00 0.00 ATOM 1169 CB LEU 151 12.238 10.616 46.636 1.00 0.00 ATOM 1170 CG LEU 151 13.423 11.151 45.817 1.00 0.00 ATOM 1171 CD1 LEU 151 13.512 12.670 45.875 1.00 0.00 ATOM 1172 CD2 LEU 151 14.748 10.504 46.268 1.00 0.00 ATOM 1173 O LEU 151 10.960 8.534 48.435 1.00 0.00 ATOM 1174 C LEU 151 10.792 8.632 47.214 1.00 0.00 ATOM 1175 N ALA 152 9.668 8.262 46.620 1.00 0.00 ATOM 1176 CA ALA 152 8.630 7.563 47.365 1.00 0.00 ATOM 1177 CB ALA 152 7.325 7.501 46.553 1.00 0.00 ATOM 1178 O ALA 152 8.604 5.654 48.816 1.00 0.00 ATOM 1179 C ALA 152 9.070 6.166 47.794 1.00 0.00 ATOM 1180 N ARG 153 9.945 5.529 47.013 1.00 0.00 ATOM 1181 CA ARG 153 10.258 4.149 47.250 1.00 0.00 ATOM 1182 CB ARG 153 9.681 3.275 46.157 1.00 0.00 ATOM 1183 CG ARG 153 8.199 2.992 46.300 1.00 0.00 ATOM 1184 CD ARG 153 7.674 2.422 44.985 1.00 0.00 ATOM 1185 NE ARG 153 7.919 3.377 43.912 1.00 0.00 ATOM 1186 CZ ARG 153 7.100 4.374 43.611 1.00 0.00 ATOM 1187 NH1 ARG 153 5.969 4.536 44.298 1.00 0.00 ATOM 1188 NH2 ARG 153 7.412 5.210 42.625 1.00 0.00 ATOM 1189 O ARG 153 12.115 2.798 47.807 1.00 0.00 ATOM 1190 C ARG 153 11.743 3.870 47.359 1.00 0.00 ATOM 1191 N VAL 154 12.576 4.808 46.921 1.00 0.00 ATOM 1192 CA VAL 154 14.038 4.625 46.956 1.00 0.00 ATOM 1193 CB VAL 154 14.711 4.943 45.590 1.00 0.00 ATOM 1194 CG1 VAL 154 16.232 4.750 45.687 1.00 0.00 ATOM 1195 CG2 VAL 154 14.106 4.079 44.458 1.00 0.00 ATOM 1196 O VAL 154 14.424 6.782 48.003 1.00 0.00 ATOM 1197 C VAL 154 14.564 5.539 48.067 1.00 0.00 ATOM 1198 N GLN 155 15.112 4.922 49.114 1.00 0.00 ATOM 1199 CA GLN 155 15.677 5.689 50.222 1.00 0.00 ATOM 1200 CB GLN 155 15.676 4.912 51.547 1.00 0.00 ATOM 1201 CG GLN 155 16.256 5.788 52.701 1.00 0.00 ATOM 1202 CD GLN 155 16.567 5.030 53.991 1.00 0.00 ATOM 1203 OE1 GLN 155 17.472 4.179 54.043 1.00 0.00 ATOM 1204 NE2 GLN 155 15.853 5.378 55.056 1.00 0.00 ATOM 1205 O GLN 155 17.996 5.290 49.710 1.00 0.00 ATOM 1206 C GLN 155 17.114 6.135 49.918 1.00 0.00 ATOM 1207 N PRO 156 17.356 7.456 49.882 1.00 0.00 ATOM 1208 CA PRO 156 18.703 7.896 49.552 1.00 0.00 ATOM 1209 CB PRO 156 18.448 9.116 48.689 1.00 0.00 ATOM 1210 CG PRO 156 17.162 9.743 49.303 1.00 0.00 ATOM 1211 CD PRO 156 16.397 8.576 49.978 1.00 0.00 ATOM 1212 O PRO 156 18.970 8.811 51.739 1.00 0.00 ATOM 1213 C PRO 156 19.517 8.226 50.802 1.00 0.00 ATOM 1214 N THR 157 20.801 7.875 50.822 1.00 0.00 ATOM 1215 CA THR 157 21.586 8.030 52.038 1.00 0.00 ATOM 1216 CB THR 157 21.856 6.664 52.747 1.00 0.00 ATOM 1217 CG2 THR 157 22.639 6.881 54.057 1.00 0.00 ATOM 1218 OG1 THR 157 20.604 6.041 53.078 1.00 0.00 ATOM 1219 O THR 157 23.795 8.114 51.204 1.00 0.00 ATOM 1220 C THR 157 22.897 8.723 51.737 1.00 0.00 ATOM 1221 N PRO 158 23.000 10.023 52.066 1.00 0.00 ATOM 1222 CA PRO 158 24.324 10.658 51.962 1.00 0.00 ATOM 1223 CB PRO 158 24.040 12.124 52.325 1.00 0.00 ATOM 1224 CG PRO 158 22.532 12.274 52.171 1.00 0.00 ATOM 1225 CD PRO 158 21.947 10.963 52.504 1.00 0.00 ATOM 1226 O PRO 158 24.944 9.910 54.161 1.00 0.00 ATOM 1227 C PRO 158 25.282 10.021 52.973 1.00 0.00 ATOM 1228 N LEU 159 26.465 9.607 52.536 1.00 0.00 ATOM 1229 CA LEU 159 27.387 8.932 53.437 1.00 0.00 ATOM 1230 CB LEU 159 28.196 7.849 52.718 1.00 0.00 ATOM 1231 CG LEU 159 27.469 6.689 52.034 1.00 0.00 ATOM 1232 CD1 LEU 159 28.473 5.710 51.474 1.00 0.00 ATOM 1233 CD2 LEU 159 26.584 5.972 53.028 1.00 0.00 ATOM 1234 O LEU 159 28.740 10.887 53.465 1.00 0.00 ATOM 1235 C LEU 159 28.340 9.910 54.091 1.00 0.00 ATOM 1236 N LYS 160 28.681 9.642 55.354 1.00 0.00 ATOM 1237 CA LYS 160 29.672 10.414 56.087 1.00 0.00 ATOM 1238 CB LYS 160 29.582 10.114 57.588 1.00 0.00 ATOM 1239 CG LYS 160 28.353 10.618 58.312 1.00 0.00 ATOM 1240 CD LYS 160 28.542 10.443 59.822 1.00 0.00 ATOM 1241 CE LYS 160 27.241 10.670 60.577 1.00 0.00 ATOM 1242 NZ LYS 160 26.123 9.890 59.960 1.00 0.00 ATOM 1243 O LYS 160 31.961 10.905 55.431 1.00 0.00 ATOM 1244 C LYS 160 31.084 10.037 55.626 1.00 0.00 ATOM 1245 N ASN 161 31.319 8.734 55.505 1.00 0.00 ATOM 1246 CA ASN 161 32.661 8.227 55.211 1.00 0.00 ATOM 1247 CB ASN 161 33.426 7.879 56.487 1.00 0.00 ATOM 1248 CG ASN 161 34.914 7.491 56.228 1.00 0.00 ATOM 1249 ND2 ASN 161 35.727 7.618 57.265 1.00 0.00 ATOM 1250 OD1 ASN 161 35.305 7.066 55.137 1.00 0.00 ATOM 1251 O ASN 161 32.314 5.886 54.907 1.00 0.00 ATOM 1252 C ASN 161 32.463 6.992 54.370 1.00 0.00 ATOM 1253 N THR 162 32.475 7.194 53.061 1.00 0.00 ATOM 1254 CA THR 162 32.243 6.110 52.082 1.00 0.00 ATOM 1255 CB THR 162 32.479 6.616 50.634 1.00 0.00 ATOM 1256 CG2 THR 162 32.217 5.517 49.611 1.00 0.00 ATOM 1257 OG1 THR 162 31.619 7.736 50.380 1.00 0.00 ATOM 1258 O THR 162 32.691 3.768 52.376 1.00 0.00 ATOM 1259 C THR 162 33.149 4.907 52.322 1.00 0.00 ATOM 1260 N VAL 163 34.441 5.180 52.463 1.00 0.00 ATOM 1261 CA VAL 163 35.428 4.137 52.617 1.00 0.00 ATOM 1262 CB VAL 163 36.881 4.692 52.572 1.00 0.00 ATOM 1263 CG1 VAL 163 37.881 3.621 53.019 1.00 0.00 ATOM 1264 CG2 VAL 163 37.209 5.159 51.150 1.00 0.00 ATOM 1265 O VAL 163 35.141 2.123 53.821 1.00 0.00 ATOM 1266 C VAL 163 35.179 3.344 53.883 1.00 0.00 ATOM 1267 N ASP 164 34.959 4.038 55.000 1.00 0.00 ATOM 1268 CA ASP 164 34.682 3.410 56.303 1.00 0.00 ATOM 1269 CB ASP 164 34.373 4.476 57.349 1.00 0.00 ATOM 1270 CG ASP 164 35.536 4.822 58.206 1.00 0.00 ATOM 1271 OD1 ASP 164 35.269 5.105 59.403 1.00 0.00 ATOM 1272 OD2 ASP 164 36.700 4.821 57.713 1.00 0.00 ATOM 1273 O ASP 164 33.430 1.404 56.758 1.00 0.00 ATOM 1274 C ASP 164 33.441 2.512 56.215 1.00 0.00 ATOM 1275 N THR 165 32.394 3.022 55.567 1.00 0.00 ATOM 1276 CA THR 165 31.166 2.288 55.357 1.00 0.00 ATOM 1277 CB THR 165 30.113 3.182 54.689 1.00 0.00 ATOM 1278 CG2 THR 165 28.856 2.386 54.312 1.00 0.00 ATOM 1279 OG1 THR 165 29.749 4.198 55.622 1.00 0.00 ATOM 1280 O THR 165 30.926 -0.047 54.848 1.00 0.00 ATOM 1281 C THR 165 31.383 1.051 54.497 1.00 0.00 ATOM 1282 N LEU 166 32.070 1.210 53.361 1.00 0.00 ATOM 1283 CA LEU 166 32.378 0.058 52.534 1.00 0.00 ATOM 1284 CB LEU 166 33.112 0.477 51.261 1.00 0.00 ATOM 1285 CG LEU 166 32.273 1.066 50.149 1.00 0.00 ATOM 1286 CD1 LEU 166 33.196 1.333 48.942 1.00 0.00 ATOM 1287 CD2 LEU 166 31.084 0.159 49.766 1.00 0.00 ATOM 1288 O LEU 166 32.937 -2.173 53.218 1.00 0.00 ATOM 1289 C LEU 166 33.216 -0.977 53.285 1.00 0.00 ATOM 1290 N ALA 167 34.237 -0.522 53.985 1.00 0.00 ATOM 1291 CA ALA 167 35.111 -1.423 54.733 1.00 0.00 ATOM 1292 CB ALA 167 36.205 -0.665 55.403 1.00 0.00 ATOM 1293 O ALA 167 34.425 -3.406 55.888 1.00 0.00 ATOM 1294 C ALA 167 34.284 -2.198 55.751 1.00 0.00 ATOM 1295 N TYR 168 33.373 -1.500 56.412 1.00 0.00 ATOM 1296 CA TYR 168 32.560 -2.099 57.460 1.00 0.00 ATOM 1297 CB TYR 168 31.763 -1.003 58.163 1.00 0.00 ATOM 1298 CG TYR 168 30.750 -1.490 59.163 1.00 0.00 ATOM 1299 CD1 TYR 168 31.160 -2.077 60.373 1.00 0.00 ATOM 1300 CD2 TYR 168 29.392 -1.344 58.922 1.00 0.00 ATOM 1301 CE1 TYR 168 30.237 -2.515 61.299 1.00 0.00 ATOM 1302 CE2 TYR 168 28.449 -1.779 59.859 1.00 0.00 ATOM 1303 CZ TYR 168 28.881 -2.359 61.027 1.00 0.00 ATOM 1304 OH TYR 168 27.945 -2.781 61.937 1.00 0.00 ATOM 1305 O TYR 168 31.609 -4.336 57.416 1.00 0.00 ATOM 1306 C TYR 168 31.636 -3.204 56.900 1.00 0.00 ATOM 1307 N PHE 169 30.879 -2.873 55.863 1.00 0.00 ATOM 1308 CA PHE 169 29.973 -3.857 55.245 1.00 0.00 ATOM 1309 CB PHE 169 28.986 -3.184 54.303 1.00 0.00 ATOM 1310 CG PHE 169 27.893 -2.490 55.025 1.00 0.00 ATOM 1311 CD1 PHE 169 26.950 -3.225 55.734 1.00 0.00 ATOM 1312 CD2 PHE 169 27.842 -1.113 55.081 1.00 0.00 ATOM 1313 CE1 PHE 169 25.915 -2.576 56.435 1.00 0.00 ATOM 1314 CE2 PHE 169 26.817 -0.456 55.772 1.00 0.00 ATOM 1315 CZ PHE 169 25.853 -1.185 56.445 1.00 0.00 ATOM 1316 O PHE 169 30.324 -6.163 54.685 1.00 0.00 ATOM 1317 C PHE 169 30.730 -4.990 54.582 1.00 0.00 ATOM 1318 N ARG 170 31.873 -4.652 53.982 1.00 0.00 ATOM 1319 CA ARG 170 32.746 -5.652 53.367 1.00 0.00 ATOM 1320 CB ARG 170 33.935 -4.985 52.634 1.00 0.00 ATOM 1321 CG ARG 170 34.870 -5.986 51.966 1.00 0.00 ATOM 1322 CD ARG 170 36.168 -5.382 51.403 1.00 0.00 ATOM 1323 NE ARG 170 36.850 -4.461 52.317 1.00 0.00 ATOM 1324 CZ ARG 170 37.693 -4.809 53.285 1.00 0.00 ATOM 1325 NH1 ARG 170 37.993 -6.087 53.511 1.00 0.00 ATOM 1326 NH2 ARG 170 38.246 -3.865 54.046 1.00 0.00 ATOM 1327 O ARG 170 33.265 -7.898 54.138 1.00 0.00 ATOM 1328 C ARG 170 33.247 -6.684 54.397 1.00 0.00 ATOM 1329 N ARG 171 33.643 -6.206 55.577 1.00 0.00 ATOM 1330 CA ARG 171 34.136 -7.099 56.619 1.00 0.00 ATOM 1331 CB ARG 171 34.946 -6.320 57.666 1.00 0.00 ATOM 1332 CG ARG 171 36.451 -6.094 57.196 1.00 0.00 ATOM 1333 CD ARG 171 37.168 -4.980 57.981 1.00 0.00 ATOM 1334 NE ARG 171 37.403 -5.302 59.403 1.00 0.00 ATOM 1335 CZ ARG 171 38.512 -5.884 59.890 1.00 0.00 ATOM 1336 NH1 ARG 171 38.622 -6.116 61.203 1.00 0.00 ATOM 1337 NH2 ARG 171 39.512 -6.238 58.999 1.00 0.00 ATOM 1338 O ARG 171 33.273 -8.973 57.870 1.00 0.00 ATOM 1339 C ARG 171 33.012 -7.949 57.242 1.00 0.00 ATOM 1340 N GLN 172 31.757 -7.544 57.038 1.00 0.00 ATOM 1341 CA GLN 172 30.609 -8.402 57.423 1.00 0.00 ATOM 1342 CB GLN 172 29.382 -7.568 57.726 1.00 0.00 ATOM 1343 CG GLN 172 29.759 -6.390 58.539 1.00 0.00 ATOM 1344 CD GLN 172 28.648 -5.862 59.347 1.00 0.00 ATOM 1345 OE1 GLN 172 28.418 -6.288 60.500 1.00 0.00 ATOM 1346 NE2 GLN 172 27.957 -4.892 58.785 1.00 0.00 ATOM 1347 O GLN 172 29.417 -10.352 56.671 1.00 0.00 ATOM 1348 C GLN 172 30.264 -9.492 56.401 1.00 0.00 ATOM 1349 N GLY 173 30.943 -9.478 55.262 1.00 0.00 ATOM 1350 CA GLY 173 30.766 -10.501 54.242 1.00 0.00 ATOM 1351 O GLY 173 29.304 -10.949 52.402 1.00 0.00 ATOM 1352 C GLY 173 29.735 -10.109 53.192 1.00 0.00 ATOM 1353 N ILE 174 29.331 -8.842 53.186 1.00 0.00 ATOM 1354 CA ILE 174 28.541 -8.293 52.052 1.00 0.00 ATOM 1355 CB ILE 174 27.732 -7.067 52.459 1.00 0.00 ATOM 1356 CG1 ILE 174 26.725 -7.479 53.541 1.00 0.00 ATOM 1357 CG2 ILE 174 27.051 -6.368 51.206 1.00 0.00 ATOM 1358 CD1 ILE 174 26.093 -6.357 54.197 1.00 0.00 ATOM 1359 O ILE 174 30.454 -7.239 51.022 1.00 0.00 ATOM 1360 C ILE 174 29.465 -7.982 50.870 1.00 0.00 ATOM 1361 N PRO 175 29.187 -8.598 49.703 1.00 0.00 ATOM 1362 CA PRO 175 30.027 -8.383 48.544 1.00 0.00 ATOM 1363 CB PRO 175 29.430 -9.335 47.480 1.00 0.00 ATOM 1364 CG PRO 175 28.036 -9.608 47.958 1.00 0.00 ATOM 1365 CD PRO 175 28.076 -9.533 49.437 1.00 0.00 ATOM 1366 O PRO 175 28.820 -6.356 48.030 1.00 0.00 ATOM 1367 C PRO 175 29.916 -6.943 48.043 1.00 0.00 ATOM 1368 N VAL 176 31.047 -6.401 47.633 1.00 0.00 ATOM 1369 CA VAL 176 31.120 -5.047 47.141 1.00 0.00 ATOM 1370 CB VAL 176 32.046 -4.150 48.011 1.00 0.00 ATOM 1371 CG1 VAL 176 32.004 -2.712 47.501 1.00 0.00 ATOM 1372 CG2 VAL 176 31.630 -4.211 49.488 1.00 0.00 ATOM 1373 O VAL 176 32.762 -5.314 45.401 1.00 0.00 ATOM 1374 C VAL 176 31.589 -5.065 45.694 1.00 0.00 ATOM 1375 N TYR 177 30.659 -4.804 44.796 1.00 0.00 ATOM 1376 CA TYR 177 30.934 -4.802 43.367 1.00 0.00 ATOM 1377 CB TYR 177 29.712 -5.341 42.612 1.00 0.00 ATOM 1378 CG TYR 177 29.448 -6.780 42.909 1.00 0.00 ATOM 1379 CD1 TYR 177 28.628 -7.153 43.973 1.00 0.00 ATOM 1380 CD2 TYR 177 30.007 -7.779 42.116 1.00 0.00 ATOM 1381 CE1 TYR 177 28.389 -8.486 44.249 1.00 0.00 ATOM 1382 CE2 TYR 177 29.770 -9.110 42.373 1.00 0.00 ATOM 1383 CZ TYR 177 28.956 -9.456 43.444 1.00 0.00 ATOM 1384 OH TYR 177 28.725 -10.783 43.730 1.00 0.00 ATOM 1385 O TYR 177 30.736 -2.410 43.558 1.00 0.00 ATOM 1386 C TYR 177 31.208 -3.372 42.927 1.00 0.00 ATOM 1387 N GLY 178 32.000 -3.235 41.876 1.00 0.00 ATOM 1388 CA GLY 178 32.310 -1.923 41.300 1.00 0.00 ATOM 1389 O GLY 178 32.836 -2.984 39.221 1.00 0.00 ATOM 1390 C GLY 178 32.355 -1.992 39.794 1.00 0.00 ATOM 1391 N ALA 179 31.898 -0.919 39.146 1.00 0.00 ATOM 1392 CA ALA 179 31.897 -0.833 37.692 1.00 0.00 ATOM 1393 CB ALA 179 30.686 -0.033 37.219 1.00 0.00 ATOM 1394 O ALA 179 33.486 0.986 37.611 1.00 0.00 ATOM 1395 C ALA 179 33.195 -0.162 37.222 1.00 0.00 ATOM 1396 N PHE 180 33.986 -0.901 36.443 1.00 0.00 ATOM 1397 CA PHE 180 35.300 -0.438 35.993 1.00 0.00 ATOM 1398 CB PHE 180 36.407 -1.198 36.710 1.00 0.00 ATOM 1399 CG PHE 180 36.511 -0.866 38.178 1.00 0.00 ATOM 1400 CD1 PHE 180 37.263 0.227 38.607 1.00 0.00 ATOM 1401 CD2 PHE 180 35.864 -1.649 39.124 1.00 0.00 ATOM 1402 CE1 PHE 180 37.360 0.535 39.978 1.00 0.00 ATOM 1403 CE2 PHE 180 35.951 -1.357 40.477 1.00 0.00 ATOM 1404 CZ PHE 180 36.722 -0.267 40.905 1.00 0.00 ATOM 1405 O PHE 180 34.679 -1.449 33.935 1.00 0.00 ATOM 1406 C PHE 180 35.448 -0.685 34.515 1.00 0.00 ATOM 1407 N LEU 181 36.430 -0.040 33.901 1.00 0.00 ATOM 1408 CA LEU 181 36.695 -0.265 32.489 1.00 0.00 ATOM 1409 CB LEU 181 37.419 0.942 31.893 1.00 0.00 ATOM 1410 CG LEU 181 36.569 2.220 31.841 1.00 0.00 ATOM 1411 CD1 LEU 181 37.366 3.396 31.254 1.00 0.00 ATOM 1412 CD2 LEU 181 35.253 1.996 31.057 1.00 0.00 ATOM 1413 O LEU 181 37.503 -2.100 31.159 1.00 0.00 ATOM 1414 C LEU 181 37.479 -1.554 32.264 1.00 0.00 ATOM 1415 N ASP 182 38.142 -2.003 33.321 1.00 0.00 ATOM 1416 CA ASP 182 38.880 -3.268 33.340 1.00 0.00 ATOM 1417 CB ASP 182 40.380 -3.014 33.557 1.00 0.00 ATOM 1418 CG ASP 182 41.187 -4.304 33.752 1.00 0.00 ATOM 1419 OD1 ASP 182 40.725 -5.204 34.491 1.00 0.00 ATOM 1420 OD2 ASP 182 42.299 -4.413 33.181 1.00 0.00 ATOM 1421 O ASP 182 38.293 -3.617 35.645 1.00 0.00 ATOM 1422 C ASP 182 38.328 -4.093 34.499 1.00 0.00 ATOM 1423 N GLY 183 37.903 -5.318 34.222 1.00 0.00 ATOM 1424 CA GLY 183 37.341 -6.170 35.261 1.00 0.00 ATOM 1425 O GLY 183 36.843 -7.615 33.436 1.00 0.00 ATOM 1426 C GLY 183 36.698 -7.382 34.627 1.00 0.00 ATOM 1427 N GLN 184 35.968 -8.151 35.421 1.00 0.00 ATOM 1428 CA GLN 184 35.251 -9.312 34.892 1.00 0.00 ATOM 1429 CB GLN 184 34.816 -10.202 36.051 1.00 0.00 ATOM 1430 CG GLN 184 34.086 -11.456 35.591 1.00 0.00 ATOM 1431 CD GLN 184 33.903 -12.453 36.714 1.00 0.00 ATOM 1432 OE1 GLN 184 33.738 -12.074 37.872 1.00 0.00 ATOM 1433 NE2 GLN 184 33.908 -13.730 36.369 1.00 0.00 ATOM 1434 O GLN 184 33.235 -8.074 34.601 1.00 0.00 ATOM 1435 C GLN 184 34.000 -8.889 34.113 1.00 0.00 ATOM 1436 N SER 185 33.772 -9.463 32.931 1.00 0.00 ATOM 1437 CA SER 185 32.522 -9.198 32.208 1.00 0.00 ATOM 1438 CB SER 185 32.362 -10.103 30.987 1.00 0.00 ATOM 1439 OG SER 185 31.036 -9.978 30.495 1.00 0.00 ATOM 1440 O SER 185 31.260 -10.496 33.771 1.00 0.00 ATOM 1441 C SER 185 31.343 -9.441 33.133 1.00 0.00 ATOM 1442 N LEU 186 30.416 -8.483 33.205 1.00 0.00 ATOM 1443 CA LEU 186 29.203 -8.623 34.021 1.00 0.00 ATOM 1444 CB LEU 186 28.358 -7.331 34.023 1.00 0.00 ATOM 1445 CG LEU 186 27.287 -7.106 32.947 1.00 0.00 ATOM 1446 CD1 LEU 186 26.250 -6.095 33.384 1.00 0.00 ATOM 1447 CD2 LEU 186 27.911 -6.685 31.631 1.00 0.00 ATOM 1448 O LEU 186 27.525 -10.301 34.379 1.00 0.00 ATOM 1449 C LEU 186 28.330 -9.810 33.591 1.00 0.00 ATOM 1450 N TYR 187 28.469 -10.240 32.343 1.00 0.00 ATOM 1451 CA TYR 187 27.745 -11.419 31.859 1.00 0.00 ATOM 1452 CB TYR 187 27.665 -11.419 30.328 1.00 0.00 ATOM 1453 CG TYR 187 27.107 -10.116 29.809 1.00 0.00 ATOM 1454 CD1 TYR 187 25.931 -9.575 30.335 1.00 0.00 ATOM 1455 CD2 TYR 187 27.759 -9.421 28.812 1.00 0.00 ATOM 1456 CE1 TYR 187 25.428 -8.353 29.876 1.00 0.00 ATOM 1457 CE2 TYR 187 27.259 -8.219 28.334 1.00 0.00 ATOM 1458 CZ TYR 187 26.103 -7.686 28.879 1.00 0.00 ATOM 1459 OH TYR 187 25.639 -6.473 28.372 1.00 0.00 ATOM 1460 O TYR 187 27.634 -13.739 32.365 1.00 0.00 ATOM 1461 C TYR 187 28.330 -12.734 32.353 1.00 0.00 ATOM 1462 N GLU 188 29.603 -12.716 32.751 1.00 0.00 ATOM 1463 CA GLU 188 30.290 -13.920 33.226 1.00 0.00 ATOM 1464 CB GLU 188 31.718 -13.992 32.661 1.00 0.00 ATOM 1465 CG GLU 188 31.767 -13.941 31.140 1.00 0.00 ATOM 1466 CD GLU 188 33.184 -14.007 30.565 1.00 0.00 ATOM 1467 OE1 GLU 188 34.177 -13.764 31.291 1.00 0.00 ATOM 1468 OE2 GLU 188 33.291 -14.290 29.366 1.00 0.00 ATOM 1469 O GLU 188 30.597 -15.085 35.298 1.00 0.00 ATOM 1470 C GLU 188 30.339 -14.017 34.757 1.00 0.00 ATOM 1471 N ALA 189 30.110 -12.905 35.448 1.00 0.00 ATOM 1472 CA ALA 189 30.219 -12.893 36.886 1.00 0.00 ATOM 1473 CB ALA 189 30.333 -11.446 37.390 1.00 0.00 ATOM 1474 O ALA 189 27.887 -13.289 37.039 1.00 0.00 ATOM 1475 C ALA 189 28.989 -13.580 37.470 1.00 0.00 ATOM 1476 N PRO 190 29.167 -14.503 38.442 1.00 0.00 ATOM 1477 CA PRO 190 27.942 -15.004 39.060 1.00 0.00 ATOM 1478 CB PRO 190 28.388 -16.262 39.835 1.00 0.00 ATOM 1479 CG PRO 190 29.882 -16.407 39.580 1.00 0.00 ATOM 1480 CD PRO 190 30.381 -15.107 39.022 1.00 0.00 ATOM 1481 O PRO 190 28.303 -13.356 40.734 1.00 0.00 ATOM 1482 C PRO 190 27.485 -13.912 40.010 1.00 0.00 ATOM 1483 N LEU 191 26.217 -13.569 39.977 1.00 0.00 ATOM 1484 CA LEU 191 25.716 -12.486 40.808 1.00 0.00 ATOM 1485 CB LEU 191 24.984 -11.461 39.918 1.00 0.00 ATOM 1486 CG LEU 191 25.765 -10.735 38.804 1.00 0.00 ATOM 1487 CD1 LEU 191 24.865 -9.849 37.934 1.00 0.00 ATOM 1488 CD2 LEU 191 26.936 -9.950 39.416 1.00 0.00 ATOM 1489 O LEU 191 24.082 -14.067 41.584 1.00 0.00 ATOM 1490 C LEU 191 24.734 -13.037 41.835 1.00 0.00 ATOM 1491 N PRO 192 24.592 -12.342 42.985 1.00 0.00 ATOM 1492 CA PRO 192 23.540 -12.753 43.907 1.00 0.00 ATOM 1493 CB PRO 192 23.868 -11.971 45.202 1.00 0.00 ATOM 1494 CG PRO 192 25.170 -11.304 44.985 1.00 0.00 ATOM 1495 CD PRO 192 25.348 -11.190 43.509 1.00 0.00 ATOM 1496 O PRO 192 22.107 -11.464 42.499 1.00 0.00 ATOM 1497 C PRO 192 22.187 -12.331 43.376 1.00 0.00 ATOM 1498 N ASN 193 21.120 -12.947 43.883 1.00 0.00 ATOM 1499 CA ASN 193 19.768 -12.504 43.518 1.00 0.00 ATOM 1500 CB ASN 193 18.717 -13.380 44.215 1.00 0.00 ATOM 1501 CG ASN 193 17.288 -13.073 43.762 1.00 0.00 ATOM 1502 ND2 ASN 193 16.757 -13.927 42.899 1.00 0.00 ATOM 1503 OD1 ASN 193 16.659 -12.102 44.204 1.00 0.00 ATOM 1504 O ASN 193 20.210 -10.612 44.915 1.00 0.00 ATOM 1505 C ASN 193 19.592 -11.054 43.952 1.00 0.00 ATOM 1506 N PHE 194 18.713 -10.339 43.259 1.00 0.00 ATOM 1507 CA PHE 194 18.399 -8.945 43.578 1.00 0.00 ATOM 1508 CB PHE 194 17.232 -8.485 42.701 1.00 0.00 ATOM 1509 CG PHE 194 17.313 -7.056 42.302 1.00 0.00 ATOM 1510 CD1 PHE 194 17.858 -6.712 41.073 1.00 0.00 ATOM 1511 CD2 PHE 194 16.834 -6.046 43.137 1.00 0.00 ATOM 1512 CE1 PHE 194 17.920 -5.381 40.663 1.00 0.00 ATOM 1513 CE2 PHE 194 16.914 -4.701 42.751 1.00 0.00 ATOM 1514 CZ PHE 194 17.463 -4.379 41.504 1.00 0.00 ATOM 1515 O PHE 194 18.353 -7.644 45.615 1.00 0.00 ATOM 1516 C PHE 194 18.040 -8.708 45.053 1.00 0.00 ATOM 1517 N THR 195 17.401 -9.687 45.686 1.00 0.00 ATOM 1518 CA THR 195 16.988 -9.535 47.087 1.00 0.00 ATOM 1519 CB THR 195 15.834 -10.469 47.421 1.00 0.00 ATOM 1520 CG2 THR 195 14.601 -10.079 46.643 1.00 0.00 ATOM 1521 OG1 THR 195 16.222 -11.805 47.098 1.00 0.00 ATOM 1522 O THR 195 17.901 -9.613 49.302 1.00 0.00 ATOM 1523 C THR 195 18.089 -9.822 48.095 1.00 0.00 ATOM 1524 N GLU 196 19.225 -10.323 47.623 1.00 0.00 ATOM 1525 CA GLU 196 20.344 -10.618 48.516 1.00 0.00 ATOM 1526 CB GLU 196 21.194 -11.746 47.960 1.00 0.00 ATOM 1527 CG GLU 196 20.446 -13.077 47.916 1.00 0.00 ATOM 1528 CD GLU 196 21.314 -14.199 47.375 1.00 0.00 ATOM 1529 OE1 GLU 196 22.104 -14.766 48.163 1.00 0.00 ATOM 1530 OE2 GLU 196 21.199 -14.529 46.180 1.00 0.00 ATOM 1531 O GLU 196 21.263 -8.537 47.860 1.00 0.00 ATOM 1532 C GLU 196 21.203 -9.380 48.726 1.00 0.00 ATOM 1533 N PRO 197 21.841 -9.262 49.900 1.00 0.00 ATOM 1534 CA PRO 197 22.655 -8.079 50.173 1.00 0.00 ATOM 1535 CB PRO 197 23.054 -8.258 51.652 1.00 0.00 ATOM 1536 CG PRO 197 22.957 -9.718 51.920 1.00 0.00 ATOM 1537 CD PRO 197 21.814 -10.200 51.047 1.00 0.00 ATOM 1538 O PRO 197 24.621 -8.924 49.077 1.00 0.00 ATOM 1539 C PRO 197 23.874 -7.975 49.251 1.00 0.00 ATOM 1540 N ALA 198 24.040 -6.821 48.616 1.00 0.00 ATOM 1541 CA ALA 198 25.216 -6.574 47.791 1.00 0.00 ATOM 1542 CB ALA 198 25.081 -7.221 46.393 1.00 0.00 ATOM 1543 O ALA 198 24.272 -4.417 47.526 1.00 0.00 ATOM 1544 C ALA 198 25.291 -5.078 47.601 1.00 0.00 ATOM 1545 N ILE 199 26.502 -4.566 47.493 1.00 0.00 ATOM 1546 CA ILE 199 26.687 -3.147 47.198 1.00 0.00 ATOM 1547 CB ILE 199 27.593 -2.477 48.267 1.00 0.00 ATOM 1548 CG1 ILE 199 26.914 -2.531 49.658 1.00 0.00 ATOM 1549 CG2 ILE 199 27.941 -1.052 47.834 1.00 0.00 ATOM 1550 CD1 ILE 199 27.932 -2.488 50.842 1.00 0.00 ATOM 1551 O ILE 199 28.226 -3.839 45.498 1.00 0.00 ATOM 1552 C ILE 199 27.315 -3.049 45.819 1.00 0.00 ATOM 1553 N LEU 200 26.827 -2.103 45.008 1.00 0.00 ATOM 1554 CA LEU 200 27.365 -1.866 43.677 1.00 0.00 ATOM 1555 CB LEU 200 26.305 -2.166 42.585 1.00 0.00 ATOM 1556 CG LEU 200 26.640 -1.734 41.148 1.00 0.00 ATOM 1557 CD1 LEU 200 27.961 -2.396 40.700 1.00 0.00 ATOM 1558 CD2 LEU 200 25.487 -2.166 40.203 1.00 0.00 ATOM 1559 O LEU 200 26.971 0.517 43.699 1.00 0.00 ATOM 1560 C LEU 200 27.790 -0.412 43.594 1.00 0.00 ATOM 1561 N VAL 201 29.076 -0.227 43.389 1.00 0.00 ATOM 1562 CA VAL 201 29.661 1.107 43.389 1.00 0.00 ATOM 1563 CB VAL 201 31.083 1.118 44.029 1.00 0.00 ATOM 1564 CG1 VAL 201 31.671 2.564 44.029 1.00 0.00 ATOM 1565 CG2 VAL 201 31.064 0.519 45.519 1.00 0.00 ATOM 1566 O VAL 201 30.319 0.942 41.073 1.00 0.00 ATOM 1567 C VAL 201 29.767 1.627 41.961 1.00 0.00 ATOM 1568 N LEU 202 29.288 2.851 41.755 1.00 0.00 ATOM 1569 CA LEU 202 29.344 3.511 40.447 1.00 0.00 ATOM 1570 CB LEU 202 27.926 3.736 39.929 1.00 0.00 ATOM 1571 CG LEU 202 27.288 2.337 39.719 1.00 0.00 ATOM 1572 CD1 LEU 202 25.843 2.297 40.117 1.00 0.00 ATOM 1573 CD2 LEU 202 27.523 1.915 38.267 1.00 0.00 ATOM 1574 O LEU 202 29.721 5.638 41.486 1.00 0.00 ATOM 1575 C LEU 202 30.069 4.851 40.602 1.00 0.00 ATOM 1576 N GLY 203 31.069 5.112 39.762 1.00 0.00 ATOM 1577 CA GLY 203 31.760 6.416 39.782 1.00 0.00 ATOM 1578 O GLY 203 30.726 6.838 37.679 1.00 0.00 ATOM 1579 C GLY 203 31.390 7.291 38.592 1.00 0.00 ATOM 1580 N SER 204 31.862 8.534 38.548 1.00 0.00 ATOM 1581 CA SER 204 31.605 9.336 37.348 1.00 0.00 ATOM 1582 CB SER 204 31.987 10.774 37.550 1.00 0.00 ATOM 1583 OG SER 204 33.394 10.884 37.600 1.00 0.00 ATOM 1584 O SER 204 33.494 8.305 36.353 1.00 0.00 ATOM 1585 C SER 204 32.391 8.795 36.171 1.00 0.00 ATOM 1586 N GLU 205 31.815 8.898 34.970 1.00 0.00 ATOM 1587 CA GLU 205 32.516 8.595 33.719 1.00 0.00 ATOM 1588 CB GLU 205 31.556 8.733 32.532 1.00 0.00 ATOM 1589 CG GLU 205 32.189 9.092 31.218 1.00 0.00 ATOM 1590 CD GLU 205 31.165 9.384 30.135 1.00 0.00 ATOM 1591 OE1 GLU 205 30.064 9.914 30.439 1.00 0.00 ATOM 1592 OE2 GLU 205 31.480 9.084 28.968 1.00 0.00 ATOM 1593 O GLU 205 34.762 8.993 32.952 1.00 0.00 ATOM 1594 C GLU 205 33.782 9.456 33.542 1.00 0.00 ATOM 1595 N GLY 206 33.759 10.682 34.071 1.00 0.00 ATOM 1596 CA GLY 206 34.922 11.573 34.058 1.00 0.00 ATOM 1597 O GLY 206 37.261 11.200 34.311 1.00 0.00 ATOM 1598 C GLY 206 36.156 11.096 34.821 1.00 0.00 ATOM 1599 N ARG 207 35.983 10.574 36.035 1.00 0.00 ATOM 1600 CA ARG 207 37.116 10.104 36.840 1.00 0.00 ATOM 1601 CB ARG 207 37.340 11.009 38.062 1.00 0.00 ATOM 1602 CG ARG 207 36.114 11.792 38.544 1.00 0.00 ATOM 1603 CD ARG 207 35.947 13.140 37.824 1.00 0.00 ATOM 1604 NE ARG 207 34.538 13.428 37.550 1.00 0.00 ATOM 1605 CZ ARG 207 33.686 13.967 38.421 1.00 0.00 ATOM 1606 NH1 ARG 207 32.427 14.170 38.065 1.00 0.00 ATOM 1607 NH2 ARG 207 34.083 14.304 39.642 1.00 0.00 ATOM 1608 O ARG 207 38.022 8.019 37.649 1.00 0.00 ATOM 1609 C ARG 207 37.022 8.634 37.267 1.00 0.00 ATOM 1610 N GLY 208 35.826 8.074 37.215 1.00 0.00 ATOM 1611 CA GLY 208 35.614 6.697 37.648 1.00 0.00 ATOM 1612 O GLY 208 35.724 7.619 39.864 1.00 0.00 ATOM 1613 C GLY 208 35.684 6.604 39.165 1.00 0.00 ATOM 1614 N ILE 209 35.714 5.377 39.664 1.00 0.00 ATOM 1615 CA ILE 209 35.770 5.130 41.100 1.00 0.00 ATOM 1616 CB ILE 209 35.518 3.642 41.355 1.00 0.00 ATOM 1617 CG1 ILE 209 34.094 3.302 40.834 1.00 0.00 ATOM 1618 CG2 ILE 209 35.744 3.309 42.842 1.00 0.00 ATOM 1619 CD1 ILE 209 33.611 1.839 40.991 1.00 0.00 ATOM 1620 O ILE 209 38.158 5.289 41.016 1.00 0.00 ATOM 1621 C ILE 209 37.125 5.593 41.624 1.00 0.00 ATOM 1622 N SER 210 37.139 6.333 42.735 1.00 0.00 ATOM 1623 CA SER 210 38.403 6.840 43.263 1.00 0.00 ATOM 1624 CB SER 210 38.146 7.804 44.409 1.00 0.00 ATOM 1625 OG SER 210 37.596 7.097 45.497 1.00 0.00 ATOM 1626 O SER 210 38.740 4.638 44.145 1.00 0.00 ATOM 1627 C SER 210 39.268 5.682 43.753 1.00 0.00 ATOM 1628 N PRO 211 40.605 5.861 43.741 1.00 0.00 ATOM 1629 CA PRO 211 41.491 4.790 44.190 1.00 0.00 ATOM 1630 CB PRO 211 42.877 5.449 44.136 1.00 0.00 ATOM 1631 CG PRO 211 42.744 6.439 43.058 1.00 0.00 ATOM 1632 CD PRO 211 41.379 7.027 43.271 1.00 0.00 ATOM 1633 O PRO 211 41.203 3.034 45.816 1.00 0.00 ATOM 1634 C PRO 211 41.169 4.262 45.607 1.00 0.00 ATOM 1635 N GLU 212 40.821 5.150 46.544 1.00 0.00 ATOM 1636 CA GLU 212 40.591 4.722 47.938 1.00 0.00 ATOM 1637 CB GLU 212 40.541 5.896 48.940 1.00 0.00 ATOM 1638 CG GLU 212 40.807 5.454 50.417 1.00 0.00 ATOM 1639 CD GLU 212 40.561 6.533 51.476 1.00 0.00 ATOM 1640 OE1 GLU 212 40.908 6.299 52.657 1.00 0.00 ATOM 1641 OE2 GLU 212 40.003 7.596 51.151 1.00 0.00 ATOM 1642 O GLU 212 39.267 2.948 48.855 1.00 0.00 ATOM 1643 C GLU 212 39.326 3.886 48.051 1.00 0.00 ATOM 1644 N VAL 213 38.315 4.229 47.265 1.00 0.00 ATOM 1645 CA VAL 213 37.089 3.441 47.196 1.00 0.00 ATOM 1646 CB VAL 213 35.929 4.267 46.554 1.00 0.00 ATOM 1647 CG1 VAL 213 34.645 3.406 46.336 1.00 0.00 ATOM 1648 CG2 VAL 213 35.571 5.446 47.470 1.00 0.00 ATOM 1649 O VAL 213 36.823 1.057 46.869 1.00 0.00 ATOM 1650 C VAL 213 37.319 2.117 46.447 1.00 0.00 ATOM 1651 N ALA 214 38.071 2.177 45.347 1.00 0.00 ATOM 1652 CA ALA 214 38.383 0.985 44.564 1.00 0.00 ATOM 1653 CB ALA 214 39.227 1.340 43.329 1.00 0.00 ATOM 1654 O ALA 214 38.874 -1.266 45.269 1.00 0.00 ATOM 1655 C ALA 214 39.095 -0.063 45.441 1.00 0.00 ATOM 1656 N ALA 215 39.914 0.388 46.390 1.00 0.00 ATOM 1657 CA ALA 215 40.585 -0.537 47.300 1.00 0.00 ATOM 1658 CB ALA 215 41.624 0.191 48.179 1.00 0.00 ATOM 1659 O ALA 215 39.997 -2.429 48.647 1.00 0.00 ATOM 1660 C ALA 215 39.626 -1.367 48.167 1.00 0.00 ATOM 1661 N GLU 216 38.393 -0.910 48.345 1.00 0.00 ATOM 1662 CA GLU 216 37.418 -1.635 49.148 1.00 0.00 ATOM 1663 CB GLU 216 36.527 -0.643 49.903 1.00 0.00 ATOM 1664 CG GLU 216 37.277 0.235 50.893 1.00 0.00 ATOM 1665 CD GLU 216 37.983 -0.551 52.008 1.00 0.00 ATOM 1666 OE1 GLU 216 37.574 -1.685 52.357 1.00 0.00 ATOM 1667 OE2 GLU 216 38.965 -0.020 52.536 1.00 0.00 ATOM 1668 O GLU 216 35.650 -3.242 48.907 1.00 0.00 ATOM 1669 C GLU 216 36.522 -2.574 48.336 1.00 0.00 ATOM 1670 N ILE 217 36.698 -2.577 47.019 1.00 0.00 ATOM 1671 CA ILE 217 35.858 -3.354 46.112 1.00 0.00 ATOM 1672 CB ILE 217 36.018 -2.854 44.663 1.00 0.00 ATOM 1673 CG1 ILE 217 35.738 -1.343 44.539 1.00 0.00 ATOM 1674 CG2 ILE 217 35.233 -3.703 43.710 1.00 0.00 ATOM 1675 CD1 ILE 217 34.349 -0.877 44.768 1.00 0.00 ATOM 1676 O ILE 217 37.501 -5.089 45.992 1.00 0.00 ATOM 1677 C ILE 217 36.297 -4.807 46.109 1.00 0.00 ATOM 1678 N THR 218 35.347 -5.734 46.246 1.00 0.00 ATOM 1679 CA THR 218 35.715 -7.163 46.255 1.00 0.00 ATOM 1680 CB THR 218 34.868 -8.013 47.236 1.00 0.00 ATOM 1681 CG2 THR 218 35.086 -7.554 48.643 1.00 0.00 ATOM 1682 OG1 THR 218 33.473 -7.928 46.895 1.00 0.00 ATOM 1683 O THR 218 36.398 -8.715 44.582 1.00 0.00 ATOM 1684 C THR 218 35.668 -7.783 44.865 1.00 0.00 ATOM 1685 N ASP 219 34.839 -7.229 43.998 1.00 0.00 ATOM 1686 CA ASP 219 34.535 -7.832 42.698 1.00 0.00 ATOM 1687 CB ASP 219 33.226 -8.619 42.795 1.00 0.00 ATOM 1688 CG ASP 219 33.310 -9.790 43.770 1.00 0.00 ATOM 1689 OD1 ASP 219 33.626 -10.898 43.300 1.00 0.00 ATOM 1690 OD2 ASP 219 33.106 -9.616 44.994 1.00 0.00 ATOM 1691 O ASP 219 33.404 -5.981 41.638 1.00 0.00 ATOM 1692 C ASP 219 34.393 -6.728 41.646 1.00 0.00 ATOM 1693 N ARG 220 35.372 -6.634 40.749 1.00 0.00 ATOM 1694 CA ARG 220 35.300 -5.641 39.662 1.00 0.00 ATOM 1695 CB ARG 220 36.702 -5.286 39.157 1.00 0.00 ATOM 1696 CG ARG 220 37.561 -4.629 40.161 1.00 0.00 ATOM 1697 CD ARG 220 38.993 -4.507 39.596 1.00 0.00 ATOM 1698 NE ARG 220 39.515 -3.220 40.016 1.00 0.00 ATOM 1699 CZ ARG 220 39.796 -2.198 39.215 1.00 0.00 ATOM 1700 NH1 ARG 220 40.257 -1.086 39.769 1.00 0.00 ATOM 1701 NH2 ARG 220 39.667 -2.284 37.886 1.00 0.00 ATOM 1702 O ARG 220 34.797 -7.263 37.992 1.00 0.00 ATOM 1703 C ARG 220 34.501 -6.175 38.481 1.00 0.00 ATOM 1704 N LEU 221 33.540 -5.383 38.019 1.00 0.00 ATOM 1705 CA LEU 221 32.705 -5.708 36.873 1.00 0.00 ATOM 1706 CB LEU 221 31.209 -5.641 37.255 1.00 0.00 ATOM 1707 CG LEU 221 30.795 -6.506 38.463 1.00 0.00 ATOM 1708 CD1 LEU 221 29.314 -6.292 38.748 1.00 0.00 ATOM 1709 CD2 LEU 221 31.061 -7.995 38.143 1.00 0.00 ATOM 1710 O LEU 221 33.165 -3.522 35.938 1.00 0.00 ATOM 1711 C LEU 221 32.944 -4.727 35.727 1.00 0.00 ATOM 1712 N THR 222 32.825 -5.236 34.511 1.00 0.00 ATOM 1713 CA THR 222 32.946 -4.396 33.334 1.00 0.00 ATOM 1714 CB THR 222 34.284 -4.649 32.624 1.00 0.00 ATOM 1715 CG2 THR 222 34.514 -3.638 31.531 1.00 0.00 ATOM 1716 OG1 THR 222 35.351 -4.518 33.570 1.00 0.00 ATOM 1717 O THR 222 31.353 -5.871 32.319 1.00 0.00 ATOM 1718 C THR 222 31.797 -4.725 32.389 1.00 0.00 ATOM 1719 N ILE 223 31.336 -3.722 31.653 1.00 0.00 ATOM 1720 CA ILE 223 30.420 -3.934 30.548 1.00 0.00 ATOM 1721 CB ILE 223 29.347 -2.817 30.477 1.00 0.00 ATOM 1722 CG1 ILE 223 28.583 -2.720 31.816 1.00 0.00 ATOM 1723 CG2 ILE 223 28.407 -3.055 29.273 1.00 0.00 ATOM 1724 CD1 ILE 223 27.740 -1.430 31.944 1.00 0.00 ATOM 1725 O ILE 223 31.786 -2.874 28.885 1.00 0.00 ATOM 1726 C ILE 223 31.260 -3.918 29.282 1.00 0.00 ATOM 1727 N PRO 224 31.376 -5.071 28.619 1.00 0.00 ATOM 1728 CA PRO 224 32.292 -5.189 27.488 1.00 0.00 ATOM 1729 CB PRO 224 32.196 -6.676 27.093 1.00 0.00 ATOM 1730 CG PRO 224 31.433 -7.350 28.214 1.00 0.00 ATOM 1731 CD PRO 224 30.618 -6.311 28.887 1.00 0.00 ATOM 1732 O PRO 224 30.664 -4.199 26.010 1.00 0.00 ATOM 1733 C PRO 224 31.865 -4.310 26.305 1.00 0.00 ATOM 1734 N ALA 225 32.843 -3.675 25.667 1.00 0.00 ATOM 1735 CA ALA 225 32.601 -2.978 24.402 1.00 0.00 ATOM 1736 CB ALA 225 33.516 -1.779 24.248 1.00 0.00 ATOM 1737 O ALA 225 33.626 -4.863 23.342 1.00 0.00 ATOM 1738 C ALA 225 32.809 -3.941 23.256 1.00 0.00 ATOM 1739 N SER 226 32.080 -3.726 22.171 1.00 0.00 ATOM 1740 CA SER 226 32.196 -4.606 21.015 1.00 0.00 ATOM 1741 CB SER 226 31.205 -5.769 21.116 1.00 0.00 ATOM 1742 OG SER 226 29.885 -5.270 21.229 1.00 0.00 ATOM 1743 O SER 226 31.344 -4.393 18.813 1.00 0.00 ATOM 1744 C SER 226 31.970 -3.865 19.727 1.00 0.00 ATOM 1745 N GLY 227 32.503 -2.649 19.645 1.00 0.00 ATOM 1746 CA GLY 227 32.377 -1.824 18.445 1.00 0.00 ATOM 1747 O GLY 227 34.109 -3.172 17.458 1.00 0.00 ATOM 1748 C GLY 227 33.348 -2.195 17.342 1.00 0.00 ATOM 1749 N LEU 228 33.331 -1.396 16.278 1.00 0.00 ATOM 1750 CA LEU 228 34.146 -1.644 15.082 1.00 0.00 ATOM 1751 CB LEU 228 33.481 -1.021 13.833 1.00 0.00 ATOM 1752 CG LEU 228 32.309 -1.729 13.110 1.00 0.00 ATOM 1753 CD1 LEU 228 32.758 -2.995 12.372 1.00 0.00 ATOM 1754 CD2 LEU 228 31.104 -2.037 14.016 1.00 0.00 ATOM 1755 O LEU 228 36.423 -1.325 14.289 1.00 0.00 ATOM 1756 C LEU 228 35.622 -1.201 15.226 1.00 0.00 ATOM 1757 N SER 229 35.969 -0.682 16.404 1.00 0.00 ATOM 1758 CA SER 229 37.360 -0.358 16.731 1.00 0.00 ATOM 1759 CB SER 229 37.600 1.162 16.735 1.00 0.00 ATOM 1760 OG SER 229 36.884 1.799 17.784 1.00 0.00 ATOM 1761 O SER 229 37.000 -0.740 19.071 1.00 0.00 ATOM 1762 C SER 229 37.700 -0.974 18.085 1.00 0.00 ATOM 1763 N VAL 230 38.759 -1.786 18.107 1.00 0.00 ATOM 1764 CA VAL 230 39.236 -2.426 19.336 1.00 0.00 ATOM 1765 CB VAL 230 39.956 -3.794 19.080 1.00 0.00 ATOM 1766 CG1 VAL 230 38.938 -4.937 19.034 1.00 0.00 ATOM 1767 CG2 VAL 230 40.814 -3.770 17.806 1.00 0.00 ATOM 1768 O VAL 230 39.609 -0.580 20.817 1.00 0.00 ATOM 1769 C VAL 230 40.120 -1.476 20.133 1.00 0.00 ATOM 1770 N GLU 235 36.473 4.341 25.544 1.00 0.00 ATOM 1771 CA GLU 235 36.578 5.064 26.813 1.00 0.00 ATOM 1772 CB GLU 235 36.409 6.571 26.603 1.00 0.00 ATOM 1773 CG GLU 235 37.509 7.214 25.767 1.00 0.00 ATOM 1774 CD GLU 235 37.697 8.690 26.094 1.00 0.00 ATOM 1775 OE1 GLU 235 36.910 9.244 26.909 1.00 0.00 ATOM 1776 OE2 GLU 235 38.639 9.289 25.537 1.00 0.00 ATOM 1777 O GLU 235 35.772 3.428 28.359 1.00 0.00 ATOM 1778 C GLU 235 35.586 4.530 27.840 1.00 0.00 ATOM 1779 N SER 236 34.536 5.290 28.140 1.00 0.00 ATOM 1780 CA SER 236 33.586 4.861 29.162 1.00 0.00 ATOM 1781 CB SER 236 33.891 5.542 30.502 1.00 0.00 ATOM 1782 OG SER 236 33.061 5.013 31.518 1.00 0.00 ATOM 1783 O SER 236 31.891 6.040 27.973 1.00 0.00 ATOM 1784 C SER 236 32.147 5.140 28.765 1.00 0.00 ATOM 1785 N LEU 237 31.216 4.357 29.314 1.00 0.00 ATOM 1786 CA LEU 237 29.798 4.632 29.137 1.00 0.00 ATOM 1787 CB LEU 237 28.964 3.367 29.331 1.00 0.00 ATOM 1788 CG LEU 237 28.970 2.329 28.210 1.00 0.00 ATOM 1789 CD1 LEU 237 28.284 1.076 28.710 1.00 0.00 ATOM 1790 CD2 LEU 237 28.312 2.897 26.945 1.00 0.00 ATOM 1791 O LEU 237 29.942 5.705 31.261 1.00 0.00 ATOM 1792 C LEU 237 29.371 5.653 30.180 1.00 0.00 ATOM 1793 N ASN 238 28.360 6.458 29.847 1.00 0.00 ATOM 1794 CA ASN 238 27.758 7.367 30.815 1.00 0.00 ATOM 1795 CB ASN 238 26.539 8.030 30.158 1.00 0.00 ATOM 1796 CG ASN 238 25.686 8.802 31.156 1.00 0.00 ATOM 1797 ND2 ASN 238 25.927 10.108 31.273 1.00 0.00 ATOM 1798 OD1 ASN 238 24.847 8.225 31.827 1.00 0.00 ATOM 1799 O ASN 238 26.962 5.408 31.978 1.00 0.00 ATOM 1800 C ASN 238 27.376 6.559 32.082 1.00 0.00 ATOM 1801 N VAL 239 27.544 7.143 33.272 1.00 0.00 ATOM 1802 CA VAL 239 27.303 6.383 34.508 1.00 0.00 ATOM 1803 CB VAL 239 27.756 7.184 35.784 1.00 0.00 ATOM 1804 CG1 VAL 239 26.997 8.497 35.896 1.00 0.00 ATOM 1805 CG2 VAL 239 27.573 6.326 37.048 1.00 0.00 ATOM 1806 O VAL 239 25.611 4.825 35.181 1.00 0.00 ATOM 1807 C VAL 239 25.848 5.898 34.655 1.00 0.00 ATOM 1808 N ALA 240 24.878 6.694 34.213 1.00 0.00 ATOM 1809 CA ALA 240 23.480 6.275 34.344 1.00 0.00 ATOM 1810 CB ALA 240 22.544 7.471 34.073 1.00 0.00 ATOM 1811 O ALA 240 22.405 4.219 33.652 1.00 0.00 ATOM 1812 C ALA 240 23.198 5.117 33.367 1.00 0.00 ATOM 1813 N ILE 241 23.796 5.184 32.178 1.00 0.00 ATOM 1814 CA ILE 241 23.676 4.098 31.199 1.00 0.00 ATOM 1815 CB ILE 241 24.371 4.473 29.852 1.00 0.00 ATOM 1816 CG1 ILE 241 23.631 5.636 29.166 1.00 0.00 ATOM 1817 CG2 ILE 241 24.550 3.246 28.921 1.00 0.00 ATOM 1818 CD1 ILE 241 22.195 5.249 28.633 1.00 0.00 ATOM 1819 O ILE 241 23.606 1.740 31.733 1.00 0.00 ATOM 1820 C ILE 241 24.251 2.806 31.784 1.00 0.00 ATOM 1821 N ALA 242 25.456 2.891 32.354 1.00 0.00 ATOM 1822 CA ALA 242 26.093 1.736 32.947 1.00 0.00 ATOM 1823 CB ALA 242 27.516 2.101 33.468 1.00 0.00 ATOM 1824 O ALA 242 25.042 -0.012 34.220 1.00 0.00 ATOM 1825 C ALA 242 25.227 1.199 34.090 1.00 0.00 ATOM 1826 N THR 243 24.665 2.103 34.889 1.00 0.00 ATOM 1827 CA THR 243 23.805 1.680 36.002 1.00 0.00 ATOM 1828 CB THR 243 23.331 2.923 36.802 1.00 0.00 ATOM 1829 CG2 THR 243 22.398 2.534 37.954 1.00 0.00 ATOM 1830 OG1 THR 243 24.469 3.611 37.320 1.00 0.00 ATOM 1831 O THR 243 22.225 -0.139 36.113 1.00 0.00 ATOM 1832 C THR 243 22.589 0.872 35.516 1.00 0.00 ATOM 1833 N ALA 244 21.963 1.347 34.446 1.00 0.00 ATOM 1834 CA ALA 244 20.785 0.696 33.865 1.00 0.00 ATOM 1835 CB ALA 244 20.218 1.545 32.713 1.00 0.00 ATOM 1836 O ALA 244 20.411 -1.665 33.573 1.00 0.00 ATOM 1837 C ALA 244 21.147 -0.705 33.353 1.00 0.00 ATOM 1838 N ILE 245 22.280 -0.808 32.668 1.00 0.00 ATOM 1839 CA ILE 245 22.738 -2.089 32.153 1.00 0.00 ATOM 1840 CB ILE 245 24.002 -1.937 31.280 1.00 0.00 ATOM 1841 CG1 ILE 245 23.609 -1.260 29.955 1.00 0.00 ATOM 1842 CG2 ILE 245 24.598 -3.322 30.950 1.00 0.00 ATOM 1843 CD1 ILE 245 24.798 -0.580 29.255 1.00 0.00 ATOM 1844 O ILE 245 22.456 -4.218 33.288 1.00 0.00 ATOM 1845 C ILE 245 22.961 -3.061 33.317 1.00 0.00 ATOM 1846 N LEU 246 23.667 -2.592 34.341 1.00 0.00 ATOM 1847 CA LEU 246 23.991 -3.444 35.511 1.00 0.00 ATOM 1848 CB LEU 246 24.984 -2.758 36.465 1.00 0.00 ATOM 1849 CG LEU 246 26.416 -2.718 35.911 1.00 0.00 ATOM 1850 CD1 LEU 246 27.199 -1.458 36.389 1.00 0.00 ATOM 1851 CD2 LEU 246 27.156 -3.990 36.274 1.00 0.00 ATOM 1852 O LEU 246 22.557 -5.091 36.517 1.00 0.00 ATOM 1853 C LEU 246 22.726 -3.888 36.258 1.00 0.00 ATOM 1854 N CYS 247 21.858 -2.935 36.615 1.00 0.00 ATOM 1855 CA CYS 247 20.574 -3.277 37.255 1.00 0.00 ATOM 1856 CB CYS 247 19.771 -2.018 37.576 1.00 0.00 ATOM 1857 SG CYS 247 20.547 -1.047 38.847 1.00 0.00 ATOM 1858 O CYS 247 19.120 -5.174 37.048 1.00 0.00 ATOM 1859 C CYS 247 19.710 -4.227 36.460 1.00 0.00 ATOM 1860 N SER 248 19.595 -3.992 35.146 1.00 0.00 ATOM 1861 CA SER 248 18.806 -4.876 34.270 1.00 0.00 ATOM 1862 CB SER 248 18.819 -4.415 32.796 1.00 0.00 ATOM 1863 OG SER 248 18.390 -5.458 31.912 1.00 0.00 ATOM 1864 O SER 248 18.544 -7.223 34.639 1.00 0.00 ATOM 1865 C SER 248 19.311 -6.299 34.386 1.00 0.00 ATOM 1866 N GLU 249 20.618 -6.466 34.228 1.00 0.00 ATOM 1867 CA GLU 249 21.220 -7.786 34.253 1.00 0.00 ATOM 1868 CB GLU 249 22.698 -7.631 33.877 1.00 0.00 ATOM 1869 CG GLU 249 23.515 -8.844 33.744 1.00 0.00 ATOM 1870 CD GLU 249 22.989 -9.906 32.754 1.00 0.00 ATOM 1871 OE1 GLU 249 22.094 -9.685 31.891 1.00 0.00 ATOM 1872 OE2 GLU 249 23.513 -11.008 32.876 1.00 0.00 ATOM 1873 O GLU 249 20.764 -9.671 35.704 1.00 0.00 ATOM 1874 C GLU 249 21.046 -8.469 35.626 1.00 0.00 ATOM 1875 N TRP 250 21.198 -7.693 36.704 1.00 0.00 ATOM 1876 CA TRP 250 20.992 -8.209 38.063 1.00 0.00 ATOM 1877 CB TRP 250 21.191 -7.102 39.099 1.00 0.00 ATOM 1878 CG TRP 250 22.123 -7.458 40.228 1.00 0.00 ATOM 1879 CD1 TRP 250 21.814 -8.136 41.389 1.00 0.00 ATOM 1880 CD2 TRP 250 23.486 -7.061 40.348 1.00 0.00 ATOM 1881 CE2 TRP 250 23.962 -7.551 41.590 1.00 0.00 ATOM 1882 CE3 TRP 250 24.373 -6.360 39.504 1.00 0.00 ATOM 1883 NE1 TRP 250 22.925 -8.191 42.215 1.00 0.00 ATOM 1884 CZ2 TRP 250 25.271 -7.340 42.024 1.00 0.00 ATOM 1885 CZ3 TRP 250 25.667 -6.139 39.945 1.00 0.00 ATOM 1886 CH2 TRP 250 26.101 -6.634 41.192 1.00 0.00 ATOM 1887 O TRP 250 19.359 -9.836 38.707 1.00 0.00 ATOM 1888 C TRP 250 19.566 -8.754 38.180 1.00 0.00 ATOM 1889 N ARG 251 18.599 -7.986 37.678 1.00 0.00 ATOM 1890 CA ARG 251 17.164 -8.365 37.714 1.00 0.00 ATOM 1891 CB ARG 251 16.313 -7.112 37.446 1.00 0.00 ATOM 1892 CG ARG 251 14.781 -7.361 37.293 1.00 0.00 ATOM 1893 CD ARG 251 14.174 -7.921 38.552 1.00 0.00 ATOM 1894 NE ARG 251 14.049 -6.950 39.641 1.00 0.00 ATOM 1895 CZ ARG 251 13.838 -7.284 40.910 1.00 0.00 ATOM 1896 NH1 ARG 251 13.710 -6.335 41.840 1.00 0.00 ATOM 1897 NH2 ARG 251 13.742 -8.578 41.261 1.00 0.00 ATOM 1898 O ARG 251 15.991 -10.409 37.102 1.00 0.00 ATOM 1899 C ARG 251 16.786 -9.509 36.758 1.00 0.00 ATOM 1900 N ARG 252 17.366 -9.513 35.561 1.00 0.00 ATOM 1901 CA ARG 252 17.140 -10.610 34.612 1.00 0.00 ATOM 1902 CB ARG 252 18.061 -10.447 33.402 1.00 0.00 ATOM 1903 CG ARG 252 17.874 -11.531 32.315 1.00 0.00 ATOM 1904 CD ARG 252 18.919 -11.421 31.222 1.00 0.00 ATOM 1905 NE ARG 252 20.282 -11.760 31.642 1.00 0.00 ATOM 1906 CZ ARG 252 20.746 -12.996 31.776 1.00 0.00 ATOM 1907 NH1 ARG 252 19.948 -14.037 31.568 1.00 0.00 ATOM 1908 NH2 ARG 252 22.005 -13.206 32.157 1.00 0.00 ATOM 1909 O ARG 252 16.739 -12.926 35.021 1.00 0.00 ATOM 1910 C ARG 252 17.437 -11.954 35.256 1.00 0.00 ATOM 1911 N ARG 253 18.507 -12.013 36.050 1.00 0.00 ATOM 1912 CA ARG 253 18.921 -13.284 36.667 1.00 0.00 ATOM 1913 CB ARG 253 20.406 -13.224 36.975 1.00 0.00 ATOM 1914 CG ARG 253 21.184 -13.067 35.744 1.00 0.00 ATOM 1915 CD ARG 253 22.592 -13.464 35.968 1.00 0.00 ATOM 1916 NE ARG 253 23.471 -12.599 35.215 1.00 0.00 ATOM 1917 CZ ARG 253 24.772 -12.531 35.435 1.00 0.00 ATOM 1918 NH1 ARG 253 25.309 -13.270 36.381 1.00 0.00 ATOM 1919 NH2 ARG 253 25.515 -11.719 34.713 1.00 0.00 ATOM 1920 O ARG 253 18.428 -14.713 38.556 1.00 0.00 ATOM 1921 C ARG 253 18.172 -13.654 37.952 1.00 0.00 ATOM 1922 N SER 254 17.250 -12.799 38.367 1.00 0.00 ATOM 1923 CA SER 254 16.603 -12.959 39.663 1.00 0.00 ATOM 1924 CB SER 254 16.391 -11.588 40.303 1.00 0.00 ATOM 1925 OG SER 254 17.669 -10.986 40.512 1.00 0.00 ATOM 1926 O SER 254 14.833 -14.197 38.585 1.00 0.00 ATOM 1927 C SER 254 15.316 -13.772 39.650 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 T0378.undertaker-align.pdb looking for model 1 WARNING: atoms too close: (T0378)S185.C and (T0378)Y187.C only 0.000 apart, marking (T0378)Y187.C as missing WARNING: atoms too close: (T0378)L186.N and (T0378)E188.N only 0.000 apart, marking (T0378)L186.N as missing WARNING: atoms too close: (T0378)L186.CA and (T0378)E188.CA only 0.000 apart, marking (T0378)L186.CA as missing WARNING: atoms too close: (T0378)A225.C and (T0378)V230.C only 0.000 apart, marking (T0378)V230.C as missing WARNING: atoms too close: (T0378)S226.N and (T0378)K231.N only 0.000 apart, marking (T0378)S226.N as missing WARNING: atoms too close: (T0378)S226.CA and (T0378)K231.CA only 0.000 apart, marking (T0378)S226.CA as missing # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # command:# naming current conformation align1 # command:Warning: Couldn't open file decoys/align1.gdt for output # fraction of real conformation used = 0.876 # GDT_score = -57.700 # GDT_score(maxd=8.000,maxw=2.900)= -58.041 # GDT_score(maxd=8.000,maxw=3.200)= -55.440 # GDT_score(maxd=8.000,maxw=3.500)= -52.685 # GDT_score(maxd=10.000,maxw=3.800)= -55.705 # GDT_score(maxd=10.000,maxw=4.000)= -53.831 # GDT_score(maxd=10.000,maxw=4.200)= -51.980 # GDT_score(maxd=12.000,maxw=4.300)= -55.530 # GDT_score(maxd=12.000,maxw=4.500)= -53.704 # GDT_score(maxd=12.000,maxw=4.700)= -51.940 # GDT_score(maxd=14.000,maxw=5.200)= -51.211 # GDT_score(maxd=14.000,maxw=5.500)= -48.803 # command:# ReadConformPDB reading from PDB file T0378.undertaker-align.pdb looking for model 2 WARNING: atoms too close: (T0378)S185.C and (T0378)Y187.C only 0.000 apart, marking (T0378)Y187.C as missing WARNING: atoms too close: (T0378)L186.N and (T0378)E188.N only 0.000 apart, marking (T0378)L186.N as missing WARNING: atoms too close: (T0378)L186.CA and (T0378)E188.CA only 0.000 apart, marking (T0378)L186.CA as missing WARNING: atoms too close: (T0378)A225.C and (T0378)V230.C only 0.000 apart, marking (T0378)V230.C as missing WARNING: atoms too close: (T0378)S226.N and (T0378)K231.N only 0.000 apart, marking (T0378)S226.N as missing WARNING: atoms too close: (T0378)S226.CA and (T0378)K231.CA only 0.000 apart, marking (T0378)S226.CA as missing # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # command:# naming current conformation align2 # command:Warning: Couldn't open file decoys/align2.gdt for output # fraction of real conformation used = 0.928 # GDT_score = -67.100 # GDT_score(maxd=8.000,maxw=2.900)= -68.143 # GDT_score(maxd=8.000,maxw=3.200)= -65.222 # GDT_score(maxd=8.000,maxw=3.500)= -62.214 # GDT_score(maxd=10.000,maxw=3.800)= -64.991 # GDT_score(maxd=10.000,maxw=4.000)= -63.041 # GDT_score(maxd=10.000,maxw=4.200)= -61.176 # GDT_score(maxd=12.000,maxw=4.300)= -64.533 # GDT_score(maxd=12.000,maxw=4.500)= -62.705 # GDT_score(maxd=12.000,maxw=4.700)= -60.896 # GDT_score(maxd=14.000,maxw=5.200)= -59.877 # GDT_score(maxd=14.000,maxw=5.500)= -57.283 # command:# ReadConformPDB reading from PDB file T0378.undertaker-align.pdb looking for model 3 WARNING: atoms too close: (T0378)R11.C and (T0378)F70.C only 0.000 apart, marking (T0378)F70.C as missing WARNING: atoms too close: (T0378)S12.N and (T0378)D71.N only 0.000 apart, marking (T0378)S12.N as missing WARNING: atoms too close: (T0378)S12.CA and (T0378)D71.CA only 0.000 apart, marking (T0378)S12.CA as missing WARNING: atoms too close: (T0378)P81.C and (T0378)E99.C only 0.000 apart, marking (T0378)E99.C as missing WARNING: atoms too close: (T0378)Q82.N and (T0378)G100.N only 0.000 apart, marking (T0378)Q82.N as missing WARNING: atoms too close: (T0378)Q82.CA and (T0378)G100.CA only 0.000 apart, marking (T0378)Q82.CA as missing WARNING: atoms too close: (T0378)S185.C and (T0378)L186.C only 0.000 apart, marking (T0378)L186.C as missing WARNING: atoms too close: (T0378)L186.N and (T0378)Y187.N only 0.000 apart, marking (T0378)L186.N as missing WARNING: atoms too close: (T0378)L186.CA and (T0378)Y187.CA only 0.000 apart, marking (T0378)L186.CA as missing WARNING: atoms too close: (T0378)A225.C and (T0378)V230.C only 0.000 apart, marking (T0378)V230.C as missing WARNING: atoms too close: (T0378)S226.N and (T0378)K231.N only 0.000 apart, marking (T0378)S226.N as missing WARNING: atoms too close: (T0378)S226.CA and (T0378)K231.CA only 0.000 apart, marking (T0378)S226.CA as missing # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # command:# naming current conformation align3 # command:# ReadConformPDB reading from PDB file T0378.undertaker-align.pdb looking for model 4 WARNING: atoms too close: (T0378)R16.C and (T0378)I75.C only 0.000 apart, marking (T0378)I75.C as missing WARNING: atoms too close: (T0378)K17.N and (T0378)S76.N only 0.000 apart, marking (T0378)K17.N as missing WARNING: atoms too close: (T0378)K17.CA and (T0378)S76.CA only 0.000 apart, marking (T0378)K17.CA as missing WARNING: atoms too close: (T0378)T77.C and (T0378)V97.C only 0.000 apart, marking (T0378)V97.C as missing WARNING: atoms too close: (T0378)Q78.N and (T0378)V98.N only 0.000 apart, marking (T0378)Q78.N as missing WARNING: atoms too close: (T0378)Q78.CA and (T0378)V98.CA only 0.000 apart, marking (T0378)Q78.CA as missing WARNING: atoms too close: (T0378)K142.C and (T0378)A146.C only 0.000 apart, marking (T0378)A146.C as missing WARNING: atoms too close: (T0378)V143.N and (T0378)S147.N only 0.000 apart, marking (T0378)V143.N as missing WARNING: atoms too close: (T0378)V143.CA and (T0378)S147.CA only 0.000 apart, marking (T0378)V143.CA as missing WARNING: atoms too close: (T0378)S185.C and (T0378)L186.C only 0.000 apart, marking (T0378)L186.C as missing WARNING: atoms too close: (T0378)L186.N and (T0378)Y187.N only 0.000 apart, marking (T0378)L186.N as missing WARNING: atoms too close: (T0378)L186.CA and (T0378)Y187.CA only 0.000 apart, marking (T0378)L186.CA as missing WARNING: atoms too close: (T0378)A225.C and (T0378)V230.C only 0.000 apart, marking (T0378)V230.C as missing WARNING: atoms too close: (T0378)S226.N and (T0378)K231.N only 0.000 apart, marking (T0378)S226.N as missing WARNING: atoms too close: (T0378)S226.CA and (T0378)K231.CA only 0.000 apart, marking (T0378)S226.CA as missing # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # command:# naming current conformation align4 # command:# ReadConformPDB reading from PDB file T0378.undertaker-align.pdb looking for model 5 WARNING: atoms too close: (T0378)G29.C and (T0378)F39.C only 0.000 apart, marking (T0378)F39.C as missing WARNING: atoms too close: (T0378)P30.N and (T0378)Y40.N only 0.000 apart, marking (T0378)P30.N as missing WARNING: atoms too close: (T0378)P30.CA and (T0378)Y40.CA only 0.000 apart, marking (T0378)P30.CA as missing WARNING: atoms too close: (T0378)F70.C and (T0378)P83.C only 0.000 apart, marking (T0378)P83.C as missing WARNING: atoms too close: (T0378)D71.N and (T0378)L84.N only 0.000 apart, marking (T0378)D71.N as missing WARNING: atoms too close: (T0378)D71.CA and (T0378)L84.CA only 0.000 apart, marking (T0378)D71.CA as missing WARNING: atoms too close: (T0378)L104.C and (T0378)L105.C only 0.000 apart, marking (T0378)L105.C as missing WARNING: atoms too close: (T0378)L105.N and (T0378)D106.N only 0.000 apart, marking (T0378)L105.N as missing WARNING: atoms too close: (T0378)L105.CA and (T0378)D106.CA only 0.000 apart, marking (T0378)L105.CA as missing WARNING: atoms too close: (T0378)A189.C and (T0378)L191.C only 0.000 apart, marking (T0378)L191.C as missing WARNING: atoms too close: (T0378)P190.N and (T0378)P192.N only 0.000 apart, marking (T0378)P190.N as missing WARNING: atoms too close: (T0378)P190.CA and (T0378)P192.CA only 0.000 apart, marking (T0378)P190.CA as missing WARNING: atoms too close: (T0378)G206.C and (T0378)R207.C only 0.000 apart, marking (T0378)R207.C as missing WARNING: atoms too close: (T0378)R207.N and (T0378)G208.N only 0.000 apart, marking (T0378)R207.N as missing WARNING: atoms too close: (T0378)R207.CA and (T0378)G208.CA only 0.000 apart, marking (T0378)R207.CA as missing # WARNING: incomplete conformation T0378 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 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ../model2.ts-submitted looking for model 1 # Found a chain break before 193 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ../model3.ts-submitted looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ../model4.ts-submitted looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ../model5.ts-submitted looking for model 1 # Found a chain break before 138 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try1-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 238 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try1-opt1.pdb.gz looking for model 1 # Found a chain break before 238 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try1-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 238 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try1-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 238 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try1-opt2.pdb.gz looking for model 1 # Found a chain break before 238 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try1-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 238 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try10-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 236 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try10-opt1.pdb.gz looking for model 1 # Found a chain break before 236 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try10-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 138 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try10-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 138 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try10-opt2.pdb.gz looking for model 1 # Found a chain break before 236 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try10-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 236 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try2-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try2-opt1.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try2-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 186 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try2-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 186 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try2-opt2.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try2-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try3-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try3-opt1.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try3-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 186 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try3-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 186 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try3-opt2.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try3-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try4-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try4-opt1.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try4-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 138 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try4-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 138 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try4-opt2.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try4-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try5-opt1-scwrl.pdb.gz looking for model 1 # ReadConformPDB reading from PDB file T0378.try5-opt1.pdb.gz looking for model 1 # ReadConformPDB reading from PDB file T0378.try5-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 191 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try5-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 191 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try5-opt2.pdb.gz looking for model 1 # Found a chain break before 99 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try5-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 99 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try6-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 218 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try6-opt1.pdb.gz looking for model 1 # Found a chain break before 218 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try6-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 224 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try6-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 224 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try6-opt2.pdb.gz looking for model 1 # Found a chain break before 218 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try6-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 218 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try7-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try7-opt1.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try7-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 67 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try7-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 67 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try7-opt2.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try7-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 232 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try8-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 193 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try8-opt1.pdb.gz looking for model 1 # Found a chain break before 193 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try8-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 193 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try8-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 193 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try8-opt2.pdb.gz looking for model 1 # Found a chain break before 196 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try8-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 196 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try9-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try9-opt1.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try9-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 82 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try9-opt2.gromacs0.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 82 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try9-opt2.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0378.try9-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 237 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file servers/3D-JIGSAW_POPULUS_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_POPULUS_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1300552821.pdb -s /var/tmp/to_scwrl_1300552821.seq -o /var/tmp/from_scwrl_1300552821.pdb > /var/tmp/scwrl_1300552821.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1300552821.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 T0378 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_POPULUS_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1197097974.pdb -s /var/tmp/to_scwrl_1197097974.seq -o /var/tmp/from_scwrl_1197097974.pdb > /var/tmp/scwrl_1197097974.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1197097974.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 T0378 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_POPULUS_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1888236165.pdb -s /var/tmp/to_scwrl_1888236165.seq -o /var/tmp/from_scwrl_1888236165.pdb > /var/tmp/scwrl_1888236165.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1888236165.pdb # conformation set from SCWRL output # naming current conformation 3D-JIGSAW_POPULUS_TS3-scwrl # ReadConformPDB reading from PDB file servers/3D-JIGSAW_POPULUS_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_POPULUS_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_387556415.pdb -s /var/tmp/to_scwrl_387556415.seq -o /var/tmp/from_scwrl_387556415.pdb > /var/tmp/scwrl_387556415.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_387556415.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 T0378 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_POPULUS_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_510792666.pdb -s /var/tmp/to_scwrl_510792666.seq -o /var/tmp/from_scwrl_510792666.pdb > /var/tmp/scwrl_510792666.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_510792666.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 T0378 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_RECOM_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_34689521.pdb -s /var/tmp/to_scwrl_34689521.seq -o /var/tmp/from_scwrl_34689521.pdb > /var/tmp/scwrl_34689521.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_34689521.pdb # conformation set from SCWRL output # naming current conformation 3D-JIGSAW_RECOM_TS1-scwrl # ReadConformPDB reading from PDB file servers/3D-JIGSAW_RECOM_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_RECOM_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_735100687.pdb -s /var/tmp/to_scwrl_735100687.seq -o /var/tmp/from_scwrl_735100687.pdb > /var/tmp/scwrl_735100687.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_735100687.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 T0378 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_RECOM_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_898956093.pdb -s /var/tmp/to_scwrl_898956093.seq -o /var/tmp/from_scwrl_898956093.pdb > /var/tmp/scwrl_898956093.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_898956093.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 T0378 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_RECOM_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_241504880.pdb -s /var/tmp/to_scwrl_241504880.seq -o /var/tmp/from_scwrl_241504880.pdb > /var/tmp/scwrl_241504880.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_241504880.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 T0378 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_RECOM_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_792630850.pdb -s /var/tmp/to_scwrl_792630850.seq -o /var/tmp/from_scwrl_792630850.pdb > /var/tmp/scwrl_792630850.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_792630850.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 T0378 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1032282097.pdb -s /var/tmp/to_scwrl_1032282097.seq -o /var/tmp/from_scwrl_1032282097.pdb > /var/tmp/scwrl_1032282097.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1032282097.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 T0378 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1779026498.pdb -s /var/tmp/to_scwrl_1779026498.seq -o /var/tmp/from_scwrl_1779026498.pdb > /var/tmp/scwrl_1779026498.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1779026498.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 T0378 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_826881947.pdb -s /var/tmp/to_scwrl_826881947.seq -o /var/tmp/from_scwrl_826881947.pdb > /var/tmp/scwrl_826881947.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_826881947.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 T0378 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_981342961.pdb -s /var/tmp/to_scwrl_981342961.seq -o /var/tmp/from_scwrl_981342961.pdb > /var/tmp/scwrl_981342961.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_981342961.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 T0378 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1132486240.pdb -s /var/tmp/to_scwrl_1132486240.seq -o /var/tmp/from_scwrl_1132486240.pdb > /var/tmp/scwrl_1132486240.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1132486240.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 105 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_114202935.pdb -s /var/tmp/to_scwrl_114202935.seq -o /var/tmp/from_scwrl_114202935.pdb > /var/tmp/scwrl_114202935.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_114202935.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 40 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1086149149.pdb -s /var/tmp/to_scwrl_1086149149.seq -o /var/tmp/from_scwrl_1086149149.pdb > /var/tmp/scwrl_1086149149.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1086149149.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 94 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1883053070.pdb -s /var/tmp/to_scwrl_1883053070.seq -o /var/tmp/from_scwrl_1883053070.pdb > /var/tmp/scwrl_1883053070.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1883053070.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 133 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_2076656209.pdb -s /var/tmp/to_scwrl_2076656209.seq -o /var/tmp/from_scwrl_2076656209.pdb > /var/tmp/scwrl_2076656209.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2076656209.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 133 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1138867013.pdb -s /var/tmp/to_scwrl_1138867013.seq -o /var/tmp/from_scwrl_1138867013.pdb > /var/tmp/scwrl_1138867013.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1138867013.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 249 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1936047755.pdb -s /var/tmp/to_scwrl_1936047755.seq -o /var/tmp/from_scwrl_1936047755.pdb > /var/tmp/scwrl_1936047755.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1936047755.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 199 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_639366155.pdb -s /var/tmp/to_scwrl_639366155.seq -o /var/tmp/from_scwrl_639366155.pdb > /var/tmp/scwrl_639366155.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_639366155.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 235 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1203742658.pdb -s /var/tmp/to_scwrl_1203742658.seq -o /var/tmp/from_scwrl_1203742658.pdb > /var/tmp/scwrl_1203742658.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1203742658.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 205 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1354676145.pdb -s /var/tmp/to_scwrl_1354676145.seq -o /var/tmp/from_scwrl_1354676145.pdb > /var/tmp/scwrl_1354676145.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1354676145.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 234 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1072730560.pdb -s /var/tmp/to_scwrl_1072730560.seq -o /var/tmp/from_scwrl_1072730560.pdb > /var/tmp/scwrl_1072730560.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1072730560.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 190 # copying to AlignedFragments data structure # naming current conformation BayesHH_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1934596461.pdb -s /var/tmp/to_scwrl_1934596461.seq -o /var/tmp/from_scwrl_1934596461.pdb > /var/tmp/scwrl_1934596461.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1934596461.pdb # conformation set from SCWRL output # naming current conformation BayesHH_TS1-scwrl # ReadConformPDB reading from PDB file servers/Bilab-ENABLE_TS1.pdb.gz looking for model 1 # Found a chain break before 253 # copying to AlignedFragments data structure # naming current conformation Bilab-ENABLE_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1418775691.pdb -s /var/tmp/to_scwrl_1418775691.seq -o /var/tmp/from_scwrl_1418775691.pdb > /var/tmp/scwrl_1418775691.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1418775691.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 177 # copying to AlignedFragments data structure # naming current conformation Bilab-ENABLE_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_2035976761.pdb -s /var/tmp/to_scwrl_2035976761.seq -o /var/tmp/from_scwrl_2035976761.pdb > /var/tmp/scwrl_2035976761.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2035976761.pdb # conformation set from SCWRL output # naming current conformation Bilab-ENABLE_TS2-scwrl # ReadConformPDB reading from PDB file servers/Bilab-ENABLE_TS3.pdb.gz looking for model 1 # Found a chain break before 132 # copying to AlignedFragments data structure # naming current conformation Bilab-ENABLE_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1258445387.pdb -s /var/tmp/to_scwrl_1258445387.seq -o /var/tmp/from_scwrl_1258445387.pdb > /var/tmp/scwrl_1258445387.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1258445387.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 186 # copying to AlignedFragments data structure # naming current conformation Bilab-ENABLE_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1927576700.pdb -s /var/tmp/to_scwrl_1927576700.seq -o /var/tmp/from_scwrl_1927576700.pdb > /var/tmp/scwrl_1927576700.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1927576700.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 186 # copying to AlignedFragments data structure # naming current conformation Bilab-ENABLE_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_476715752.pdb -s /var/tmp/to_scwrl_476715752.seq -o /var/tmp/from_scwrl_476715752.pdb > /var/tmp/scwrl_476715752.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_476715752.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 244 # copying to AlignedFragments data structure # naming current conformation CIRCLE_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_411514563.pdb -s /var/tmp/to_scwrl_411514563.seq -o /var/tmp/from_scwrl_411514563.pdb > /var/tmp/scwrl_411514563.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_411514563.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 T0378 can't currently be optimized by undertaker # naming current conformation CIRCLE_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_977191028.pdb -s /var/tmp/to_scwrl_977191028.seq -o /var/tmp/from_scwrl_977191028.pdb > /var/tmp/scwrl_977191028.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_977191028.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 224 # copying to AlignedFragments data structure # naming current conformation CIRCLE_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_217468270.pdb -s /var/tmp/to_scwrl_217468270.seq -o /var/tmp/from_scwrl_217468270.pdb > /var/tmp/scwrl_217468270.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_217468270.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 244 # copying to AlignedFragments data structure # naming current conformation CIRCLE_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_799070978.pdb -s /var/tmp/to_scwrl_799070978.seq -o /var/tmp/from_scwrl_799070978.pdb > /var/tmp/scwrl_799070978.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_799070978.pdb # conformation set from SCWRL output # naming current conformation CIRCLE_TS4-scwrl # ReadConformPDB reading from PDB file servers/CIRCLE_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # naming current conformation CIRCLE_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1487983694.pdb -s /var/tmp/to_scwrl_1487983694.seq -o /var/tmp/from_scwrl_1487983694.pdb > /var/tmp/scwrl_1487983694.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1487983694.pdb # conformation set from SCWRL output # naming current conformation CIRCLE_TS5-scwrl # ReadConformPDB reading from PDB file servers/CPHmodels_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # naming current conformation CPHmodels_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_252157791.pdb -s /var/tmp/to_scwrl_252157791.seq -o /var/tmp/from_scwrl_252157791.pdb > /var/tmp/scwrl_252157791.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_252157791.pdb # conformation set from SCWRL output # naming current conformation CPHmodels_TS1-scwrl # ReadConformPDB reading from PDB file servers/CaspIta-FOX_TS1.pdb.gz looking for model 1 # Found a chain break before 233 # copying to AlignedFragments data structure # naming current conformation CaspIta-FOX_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1534171665.pdb -s /var/tmp/to_scwrl_1534171665.seq -o /var/tmp/from_scwrl_1534171665.pdb > /var/tmp/scwrl_1534171665.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1534171665.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 T0378 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation CaspIta-FOX_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_239456140.pdb -s /var/tmp/to_scwrl_239456140.seq -o /var/tmp/from_scwrl_239456140.pdb > /var/tmp/scwrl_239456140.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_239456140.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 T0378 can't currently be optimized by undertaker # naming current conformation CaspIta-FOX_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_493662671.pdb -s /var/tmp/to_scwrl_493662671.seq -o /var/tmp/from_scwrl_493662671.pdb > /var/tmp/scwrl_493662671.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_493662671.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 T0378 can't currently be optimized by undertaker # naming current conformation CaspIta-FOX_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_179318868.pdb -s /var/tmp/to_scwrl_179318868.seq -o /var/tmp/from_scwrl_179318868.pdb > /var/tmp/scwrl_179318868.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_179318868.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 T0378 can't currently be optimized by undertaker # naming current conformation CaspIta-FOX_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1271738236.pdb -s /var/tmp/to_scwrl_1271738236.seq -o /var/tmp/from_scwrl_1271738236.pdb > /var/tmp/scwrl_1271738236.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1271738236.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 T0378 can't currently be optimized by undertaker # naming current conformation Distill_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_125205522.pdb -s /var/tmp/to_scwrl_125205522.seq -o /var/tmp/from_scwrl_125205522.pdb > /var/tmp/scwrl_125205522.log Error: Couldn't open file /var/tmp/from_scwrl_125205522.pdb or /var/tmp/from_scwrl_125205522.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_125205522_b.pdb or decoys//var/tmp/from_scwrl_125205522_b.pdb.gz for input Trying /var/tmp/from_scwrl_125205522_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_125205522_b.pdb or /var/tmp/from_scwrl_125205522_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_125205522_a.pdb or decoys//var/tmp/from_scwrl_125205522_a.pdb.gz for input Trying /var/tmp/from_scwrl_125205522_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_125205522_a.pdb or /var/tmp/from_scwrl_125205522_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_125205522.pdb or /var/tmp/from_scwrl_125205522_b.pdb or /var/tmp/from_scwrl_125205522_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 T0378 can't currently be optimized by undertaker # naming current conformation Distill_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1006200815.pdb -s /var/tmp/to_scwrl_1006200815.seq -o /var/tmp/from_scwrl_1006200815.pdb > /var/tmp/scwrl_1006200815.log Error: Couldn't open file /var/tmp/from_scwrl_1006200815.pdb or /var/tmp/from_scwrl_1006200815.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1006200815_b.pdb or decoys//var/tmp/from_scwrl_1006200815_b.pdb.gz for input Trying /var/tmp/from_scwrl_1006200815_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1006200815_b.pdb or /var/tmp/from_scwrl_1006200815_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1006200815_a.pdb or decoys//var/tmp/from_scwrl_1006200815_a.pdb.gz for input Trying /var/tmp/from_scwrl_1006200815_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1006200815_a.pdb or /var/tmp/from_scwrl_1006200815_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1006200815.pdb or /var/tmp/from_scwrl_1006200815_b.pdb or /var/tmp/from_scwrl_1006200815_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 T0378 can't currently be optimized by undertaker # naming current conformation Distill_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_105597550.pdb -s /var/tmp/to_scwrl_105597550.seq -o /var/tmp/from_scwrl_105597550.pdb > /var/tmp/scwrl_105597550.log Error: Couldn't open file /var/tmp/from_scwrl_105597550.pdb or /var/tmp/from_scwrl_105597550.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_105597550_b.pdb or decoys//var/tmp/from_scwrl_105597550_b.pdb.gz for input Trying /var/tmp/from_scwrl_105597550_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_105597550_b.pdb or /var/tmp/from_scwrl_105597550_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_105597550_a.pdb or decoys//var/tmp/from_scwrl_105597550_a.pdb.gz for input Trying /var/tmp/from_scwrl_105597550_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_105597550_a.pdb or /var/tmp/from_scwrl_105597550_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_105597550.pdb or /var/tmp/from_scwrl_105597550_b.pdb or /var/tmp/from_scwrl_105597550_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 T0378 can't currently be optimized by undertaker # naming current conformation Distill_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1257691763.pdb -s /var/tmp/to_scwrl_1257691763.seq -o /var/tmp/from_scwrl_1257691763.pdb > /var/tmp/scwrl_1257691763.log Error: Couldn't open file /var/tmp/from_scwrl_1257691763.pdb or /var/tmp/from_scwrl_1257691763.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1257691763_b.pdb or decoys//var/tmp/from_scwrl_1257691763_b.pdb.gz for input Trying /var/tmp/from_scwrl_1257691763_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1257691763_b.pdb or /var/tmp/from_scwrl_1257691763_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1257691763_a.pdb or decoys//var/tmp/from_scwrl_1257691763_a.pdb.gz for input Trying /var/tmp/from_scwrl_1257691763_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1257691763_a.pdb or /var/tmp/from_scwrl_1257691763_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1257691763.pdb or /var/tmp/from_scwrl_1257691763_b.pdb or /var/tmp/from_scwrl_1257691763_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 T0378 can't currently be optimized by undertaker # naming current conformation Distill_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1120403750.pdb -s /var/tmp/to_scwrl_1120403750.seq -o /var/tmp/from_scwrl_1120403750.pdb > /var/tmp/scwrl_1120403750.log Error: Couldn't open file /var/tmp/from_scwrl_1120403750.pdb or /var/tmp/from_scwrl_1120403750.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1120403750_b.pdb or decoys//var/tmp/from_scwrl_1120403750_b.pdb.gz for input Trying /var/tmp/from_scwrl_1120403750_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1120403750_b.pdb or /var/tmp/from_scwrl_1120403750_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1120403750_a.pdb or decoys//var/tmp/from_scwrl_1120403750_a.pdb.gz for input Trying /var/tmp/from_scwrl_1120403750_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1120403750_a.pdb or /var/tmp/from_scwrl_1120403750_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1120403750.pdb or /var/tmp/from_scwrl_1120403750_b.pdb or /var/tmp/from_scwrl_1120403750_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 191 # copying to AlignedFragments data structure # naming current conformation FAMSD_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1191746699.pdb -s /var/tmp/to_scwrl_1191746699.seq -o /var/tmp/from_scwrl_1191746699.pdb > /var/tmp/scwrl_1191746699.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1191746699.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 T0378 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation FAMSD_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_993261187.pdb -s /var/tmp/to_scwrl_993261187.seq -o /var/tmp/from_scwrl_993261187.pdb > /var/tmp/scwrl_993261187.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_993261187.pdb # conformation set from SCWRL output # naming current conformation FAMSD_TS2-scwrl # ReadConformPDB reading from PDB file servers/FAMSD_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # naming current conformation FAMSD_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1049576313.pdb -s /var/tmp/to_scwrl_1049576313.seq -o /var/tmp/from_scwrl_1049576313.pdb > /var/tmp/scwrl_1049576313.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1049576313.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 T0378 can't currently be optimized by undertaker # naming current conformation FAMSD_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_183130066.pdb -s /var/tmp/to_scwrl_183130066.seq -o /var/tmp/from_scwrl_183130066.pdb > /var/tmp/scwrl_183130066.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_183130066.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 T0378 can't currently be optimized by undertaker # naming current conformation FAMSD_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_781825295.pdb -s /var/tmp/to_scwrl_781825295.seq -o /var/tmp/from_scwrl_781825295.pdb > /var/tmp/scwrl_781825295.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_781825295.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 234 # copying to AlignedFragments data structure # naming current conformation FAMS_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1688942468.pdb -s /var/tmp/to_scwrl_1688942468.seq -o /var/tmp/from_scwrl_1688942468.pdb > /var/tmp/scwrl_1688942468.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1688942468.pdb # conformation set from SCWRL output # naming current conformation FAMS_TS1-scwrl # ReadConformPDB reading from PDB file servers/FAMS_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # naming current conformation FAMS_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1386872725.pdb -s /var/tmp/to_scwrl_1386872725.seq -o /var/tmp/from_scwrl_1386872725.pdb > /var/tmp/scwrl_1386872725.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1386872725.pdb # conformation set from SCWRL output # naming current conformation FAMS_TS2-scwrl # ReadConformPDB reading from PDB file servers/FAMS_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # naming current conformation FAMS_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_2136501440.pdb -s /var/tmp/to_scwrl_2136501440.seq -o /var/tmp/from_scwrl_2136501440.pdb > /var/tmp/scwrl_2136501440.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2136501440.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 244 # copying to AlignedFragments data structure # naming current conformation FAMS_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_614189381.pdb -s /var/tmp/to_scwrl_614189381.seq -o /var/tmp/from_scwrl_614189381.pdb > /var/tmp/scwrl_614189381.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_614189381.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 T0378 can't currently be optimized by undertaker # naming current conformation FAMS_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1173985539.pdb -s /var/tmp/to_scwrl_1173985539.seq -o /var/tmp/from_scwrl_1173985539.pdb > /var/tmp/scwrl_1173985539.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1173985539.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 176 # copying to AlignedFragments data structure # naming current conformation FOLDpro_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1407793484.pdb -s /var/tmp/to_scwrl_1407793484.seq -o /var/tmp/from_scwrl_1407793484.pdb > /var/tmp/scwrl_1407793484.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1407793484.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 176 # copying to AlignedFragments data structure # naming current conformation FOLDpro_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_502682496.pdb -s /var/tmp/to_scwrl_502682496.seq -o /var/tmp/from_scwrl_502682496.pdb > /var/tmp/scwrl_502682496.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_502682496.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 196 # copying to AlignedFragments data structure # naming current conformation FOLDpro_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_284947281.pdb -s /var/tmp/to_scwrl_284947281.seq -o /var/tmp/from_scwrl_284947281.pdb > /var/tmp/scwrl_284947281.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_284947281.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 176 # copying to AlignedFragments data structure # naming current conformation FOLDpro_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1187886538.pdb -s /var/tmp/to_scwrl_1187886538.seq -o /var/tmp/from_scwrl_1187886538.pdb > /var/tmp/scwrl_1187886538.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1187886538.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 176 # copying to AlignedFragments data structure # naming current conformation FOLDpro_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_979398248.pdb -s /var/tmp/to_scwrl_979398248.seq -o /var/tmp/from_scwrl_979398248.pdb > /var/tmp/scwrl_979398248.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_979398248.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 T0378 can't currently be optimized by undertaker # naming current conformation FORTE1_AL1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_696461844.pdb -s /var/tmp/to_scwrl_696461844.seq -o /var/tmp/from_scwrl_696461844.pdb > /var/tmp/scwrl_696461844.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_696461844.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 T0378 can't currently be optimized by undertaker # naming current conformation FORTE1_AL2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_17593919.pdb -s /var/tmp/to_scwrl_17593919.seq -o /var/tmp/from_scwrl_17593919.pdb > /var/tmp/scwrl_17593919.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_17593919.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 T0378 can't currently be optimized by undertaker # naming current conformation FORTE1_AL3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1196866517.pdb -s /var/tmp/to_scwrl_1196866517.seq -o /var/tmp/from_scwrl_1196866517.pdb > /var/tmp/scwrl_1196866517.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1196866517.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 T0378 can't currently be optimized by undertaker # naming current conformation FORTE1_AL4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1495532821.pdb -s /var/tmp/to_scwrl_1495532821.seq -o /var/tmp/from_scwrl_1495532821.pdb > /var/tmp/scwrl_1495532821.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1495532821.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 Skipped atom 498, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL5.pdb.gz Skipped atom 500, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL5.pdb.gz Skipped atom 502, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL5.pdb.gz Skipped atom 504, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL5.pdb.gz Skipped atom 506, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL5.pdb.gz Skipped atom 508, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL5.pdb.gz Skipped atom 510, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL5.pdb.gz Skipped atom 512, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL5.pdb.gz Skipped atom 514, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL5.pdb.gz Skipped atom 516, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL5.pdb.gz Skipped atom 518, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL5.pdb.gz Skipped atom 520, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL5.pdb.gz Skipped atom 522, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL5.pdb.gz Skipped atom 524, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL5.pdb.gz Skipped atom 526, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL5.pdb.gz Skipped atom 528, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL5.pdb.gz Skipped atom 530, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL5.pdb.gz Skipped atom 532, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL5.pdb.gz Skipped atom 534, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL5.pdb.gz Skipped atom 536, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL5.pdb.gz # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # naming current conformation FORTE1_AL5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1505577613.pdb -s /var/tmp/to_scwrl_1505577613.seq -o /var/tmp/from_scwrl_1505577613.pdb > /var/tmp/scwrl_1505577613.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1505577613.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 T0378 can't currently be optimized by undertaker # naming current conformation FORTE2_AL1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1449024308.pdb -s /var/tmp/to_scwrl_1449024308.seq -o /var/tmp/from_scwrl_1449024308.pdb > /var/tmp/scwrl_1449024308.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1449024308.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 T0378 can't currently be optimized by undertaker # naming current conformation FORTE2_AL2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_882220840.pdb -s /var/tmp/to_scwrl_882220840.seq -o /var/tmp/from_scwrl_882220840.pdb > /var/tmp/scwrl_882220840.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_882220840.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 T0378 can't currently be optimized by undertaker # naming current conformation FORTE2_AL3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1745033753.pdb -s /var/tmp/to_scwrl_1745033753.seq -o /var/tmp/from_scwrl_1745033753.pdb > /var/tmp/scwrl_1745033753.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1745033753.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 T0378 can't currently be optimized by undertaker # naming current conformation FORTE2_AL4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1942686980.pdb -s /var/tmp/to_scwrl_1942686980.seq -o /var/tmp/from_scwrl_1942686980.pdb > /var/tmp/scwrl_1942686980.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1942686980.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 T0378 can't currently be optimized by undertaker # naming current conformation FORTE2_AL5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1061539708.pdb -s /var/tmp/to_scwrl_1061539708.seq -o /var/tmp/from_scwrl_1061539708.pdb > /var/tmp/scwrl_1061539708.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1061539708.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 242 # copying to AlignedFragments data structure # naming current conformation FPSOLVER-SERVER_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_869288343.pdb -s /var/tmp/to_scwrl_869288343.seq -o /var/tmp/from_scwrl_869288343.pdb > /var/tmp/scwrl_869288343.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_869288343.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 216 # copying to AlignedFragments data structure # naming current conformation FPSOLVER-SERVER_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_2067892502.pdb -s /var/tmp/to_scwrl_2067892502.seq -o /var/tmp/from_scwrl_2067892502.pdb > /var/tmp/scwrl_2067892502.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2067892502.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 188 # copying to AlignedFragments data structure # naming current conformation FPSOLVER-SERVER_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_2067740523.pdb -s /var/tmp/to_scwrl_2067740523.seq -o /var/tmp/from_scwrl_2067740523.pdb > /var/tmp/scwrl_2067740523.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2067740523.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 193 # copying to AlignedFragments data structure # naming current conformation FPSOLVER-SERVER_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_974885893.pdb -s /var/tmp/to_scwrl_974885893.seq -o /var/tmp/from_scwrl_974885893.pdb > /var/tmp/scwrl_974885893.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_974885893.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 173 # copying to AlignedFragments data structure # naming current conformation FPSOLVER-SERVER_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1178100618.pdb -s /var/tmp/to_scwrl_1178100618.seq -o /var/tmp/from_scwrl_1178100618.pdb > /var/tmp/scwrl_1178100618.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1178100618.pdb # conformation set from SCWRL output # naming current conformation FPSOLVER-SERVER_TS5-scwrl # ReadConformPDB reading from PDB file servers/FUGUE_AL1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # naming current conformation FUGUE_AL1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1040660627.pdb -s /var/tmp/to_scwrl_1040660627.seq -o /var/tmp/from_scwrl_1040660627.pdb > /var/tmp/scwrl_1040660627.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1040660627.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 T0378 can't currently be optimized by undertaker # naming current conformation FUGUE_AL2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_19148945.pdb -s /var/tmp/to_scwrl_19148945.seq -o /var/tmp/from_scwrl_19148945.pdb > /var/tmp/scwrl_19148945.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_19148945.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 T0378 can't currently be optimized by undertaker # naming current conformation FUGUE_AL3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_23878158.pdb -s /var/tmp/to_scwrl_23878158.seq -o /var/tmp/from_scwrl_23878158.pdb > /var/tmp/scwrl_23878158.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_23878158.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 T0378 can't currently be optimized by undertaker # naming current conformation FUGUE_AL4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_2090236939.pdb -s /var/tmp/to_scwrl_2090236939.seq -o /var/tmp/from_scwrl_2090236939.pdb > /var/tmp/scwrl_2090236939.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2090236939.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 T0378 can't currently be optimized by undertaker # naming current conformation FUGUE_AL5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_202279012.pdb -s /var/tmp/to_scwrl_202279012.seq -o /var/tmp/from_scwrl_202279012.pdb > /var/tmp/scwrl_202279012.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_202279012.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 247 # copying to AlignedFragments data structure # naming current conformation FUNCTION_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_805703453.pdb -s /var/tmp/to_scwrl_805703453.seq -o /var/tmp/from_scwrl_805703453.pdb > /var/tmp/scwrl_805703453.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_805703453.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 251 # copying to AlignedFragments data structure # naming current conformation FUNCTION_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1631695760.pdb -s /var/tmp/to_scwrl_1631695760.seq -o /var/tmp/from_scwrl_1631695760.pdb > /var/tmp/scwrl_1631695760.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1631695760.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 253 # copying to AlignedFragments data structure # naming current conformation FUNCTION_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1589151737.pdb -s /var/tmp/to_scwrl_1589151737.seq -o /var/tmp/from_scwrl_1589151737.pdb > /var/tmp/scwrl_1589151737.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1589151737.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 253 # copying to AlignedFragments data structure # naming current conformation FUNCTION_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_794721247.pdb -s /var/tmp/to_scwrl_794721247.seq -o /var/tmp/from_scwrl_794721247.pdb > /var/tmp/scwrl_794721247.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_794721247.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 251 # copying to AlignedFragments data structure # naming current conformation FUNCTION_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_98401495.pdb -s /var/tmp/to_scwrl_98401495.seq -o /var/tmp/from_scwrl_98401495.pdb > /var/tmp/scwrl_98401495.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_98401495.pdb # conformation set from SCWRL output # naming current conformation FUNCTION_TS5-scwrl # ReadConformPDB reading from PDB file servers/Frankenstein_TS1.pdb.gz looking for model 1 # Found a chain break before 132 # copying to AlignedFragments data structure # naming current conformation Frankenstein_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_615653630.pdb -s /var/tmp/to_scwrl_615653630.seq -o /var/tmp/from_scwrl_615653630.pdb > /var/tmp/scwrl_615653630.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_615653630.pdb # conformation set from SCWRL output # naming current conformation Frankenstein_TS1-scwrl # ReadConformPDB reading from PDB file servers/Frankenstein_TS2.pdb.gz looking for model 1 # Found a chain break before 99 # copying to AlignedFragments data structure # naming current conformation Frankenstein_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_55031084.pdb -s /var/tmp/to_scwrl_55031084.seq -o /var/tmp/from_scwrl_55031084.pdb > /var/tmp/scwrl_55031084.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_55031084.pdb # conformation set from SCWRL output # naming current conformation Frankenstein_TS2-scwrl # ReadConformPDB reading from PDB file servers/Frankenstein_TS3.pdb.gz looking for model 1 # Found a chain break before 149 # copying to AlignedFragments data structure # naming current conformation Frankenstein_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_601083991.pdb -s /var/tmp/to_scwrl_601083991.seq -o /var/tmp/from_scwrl_601083991.pdb > /var/tmp/scwrl_601083991.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_601083991.pdb # conformation set from SCWRL output # naming current conformation Frankenstein_TS3-scwrl # ReadConformPDB reading from PDB file servers/Frankenstein_TS4.pdb.gz looking for model 1 # Found a chain break before 245 # copying to AlignedFragments data structure # naming current conformation Frankenstein_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_900600911.pdb -s /var/tmp/to_scwrl_900600911.seq -o /var/tmp/from_scwrl_900600911.pdb > /var/tmp/scwrl_900600911.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_900600911.pdb # conformation set from SCWRL output # naming current conformation Frankenstein_TS4-scwrl # ReadConformPDB reading from PDB file servers/Frankenstein_TS5.pdb.gz looking for model 1 # Found a chain break before 132 # copying to AlignedFragments data structure # naming current conformation Frankenstein_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1242917622.pdb -s /var/tmp/to_scwrl_1242917622.seq -o /var/tmp/from_scwrl_1242917622.pdb > /var/tmp/scwrl_1242917622.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1242917622.pdb # conformation set from SCWRL output # naming current conformation Frankenstein_TS5-scwrl # ReadConformPDB reading from PDB file servers/GeneSilicoMetaServer_TS1.pdb.gz looking for model 1 # Found a chain break before 190 # copying to AlignedFragments data structure # naming current conformation GeneSilicoMetaServer_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1580482238.pdb -s /var/tmp/to_scwrl_1580482238.seq -o /var/tmp/from_scwrl_1580482238.pdb > /var/tmp/scwrl_1580482238.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1580482238.pdb # conformation set from SCWRL output # naming current conformation GeneSilicoMetaServer_TS1-scwrl # ReadConformPDB reading from PDB file servers/GeneSilicoMetaServer_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # naming current conformation GeneSilicoMetaServer_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1597062754.pdb -s /var/tmp/to_scwrl_1597062754.seq -o /var/tmp/from_scwrl_1597062754.pdb > /var/tmp/scwrl_1597062754.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1597062754.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 76 # copying to AlignedFragments data structure # naming current conformation GeneSilicoMetaServer_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1260511542.pdb -s /var/tmp/to_scwrl_1260511542.seq -o /var/tmp/from_scwrl_1260511542.pdb > /var/tmp/scwrl_1260511542.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1260511542.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 235 # copying to AlignedFragments data structure # naming current conformation GeneSilicoMetaServer_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_629865109.pdb -s /var/tmp/to_scwrl_629865109.seq -o /var/tmp/from_scwrl_629865109.pdb > /var/tmp/scwrl_629865109.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_629865109.pdb # conformation set from SCWRL output # naming current conformation GeneSilicoMetaServer_TS4-scwrl # ReadConformPDB reading from PDB file servers/GeneSilicoMetaServer_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation GeneSilicoMetaServer_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_945111930.pdb -s /var/tmp/to_scwrl_945111930.seq -o /var/tmp/from_scwrl_945111930.pdb > /var/tmp/scwrl_945111930.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_945111930.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 76 # copying to AlignedFragments data structure # naming current conformation HHpred1_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_618605509.pdb -s /var/tmp/to_scwrl_618605509.seq -o /var/tmp/from_scwrl_618605509.pdb > /var/tmp/scwrl_618605509.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_618605509.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 111 # copying to AlignedFragments data structure # naming current conformation HHpred2_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_2078889417.pdb -s /var/tmp/to_scwrl_2078889417.seq -o /var/tmp/from_scwrl_2078889417.pdb > /var/tmp/scwrl_2078889417.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2078889417.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 132 # copying to AlignedFragments data structure # naming current conformation HHpred3_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1827332769.pdb -s /var/tmp/to_scwrl_1827332769.seq -o /var/tmp/from_scwrl_1827332769.pdb > /var/tmp/scwrl_1827332769.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1827332769.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 T0378 can't currently be optimized by undertaker # naming current conformation Huber-Torda-Server_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_216155616.pdb -s /var/tmp/to_scwrl_216155616.seq -o /var/tmp/from_scwrl_216155616.pdb > /var/tmp/scwrl_216155616.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_216155616.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 T0378 can't currently be optimized by undertaker # naming current conformation Huber-Torda-Server_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1874092750.pdb -s /var/tmp/to_scwrl_1874092750.seq -o /var/tmp/from_scwrl_1874092750.pdb > /var/tmp/scwrl_1874092750.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1874092750.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 T0378 can't currently be optimized by undertaker # naming current conformation Huber-Torda-Server_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_741388831.pdb -s /var/tmp/to_scwrl_741388831.seq -o /var/tmp/from_scwrl_741388831.pdb > /var/tmp/scwrl_741388831.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_741388831.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 T0378 can't currently be optimized by undertaker # naming current conformation Huber-Torda-Server_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1085443958.pdb -s /var/tmp/to_scwrl_1085443958.seq -o /var/tmp/from_scwrl_1085443958.pdb > /var/tmp/scwrl_1085443958.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1085443958.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 T0378 can't currently be optimized by undertaker # naming current conformation Huber-Torda-Server_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1794501606.pdb -s /var/tmp/to_scwrl_1794501606.seq -o /var/tmp/from_scwrl_1794501606.pdb > /var/tmp/scwrl_1794501606.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1794501606.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 # Found a chain break before 205 # copying to AlignedFragments data structure # naming current conformation LOOPP_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_661645707.pdb -s /var/tmp/to_scwrl_661645707.seq -o /var/tmp/from_scwrl_661645707.pdb > /var/tmp/scwrl_661645707.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_661645707.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 T0378 can't currently be optimized by undertaker # naming current conformation LOOPP_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_2060329852.pdb -s /var/tmp/to_scwrl_2060329852.seq -o /var/tmp/from_scwrl_2060329852.pdb > /var/tmp/scwrl_2060329852.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2060329852.pdb # conformation set from SCWRL output # naming current conformation LOOPP_TS2-scwrl # ReadConformPDB reading from PDB file servers/LOOPP_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation LOOPP_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_825118578.pdb -s /var/tmp/to_scwrl_825118578.seq -o /var/tmp/from_scwrl_825118578.pdb > /var/tmp/scwrl_825118578.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_825118578.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 T0378 can't currently be optimized by undertaker # naming current conformation LOOPP_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1702306333.pdb -s /var/tmp/to_scwrl_1702306333.seq -o /var/tmp/from_scwrl_1702306333.pdb > /var/tmp/scwrl_1702306333.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1702306333.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 T0378 can't currently be optimized by undertaker # naming current conformation LOOPP_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_2079478797.pdb -s /var/tmp/to_scwrl_2079478797.seq -o /var/tmp/from_scwrl_2079478797.pdb > /var/tmp/scwrl_2079478797.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2079478797.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 T0378 can't currently be optimized by undertaker # naming current conformation MIG_FROST_AL1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_848996737.pdb -s /var/tmp/to_scwrl_848996737.seq -o /var/tmp/from_scwrl_848996737.pdb > /var/tmp/scwrl_848996737.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_848996737.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 76 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server2_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1645059625.pdb -s /var/tmp/to_scwrl_1645059625.seq -o /var/tmp/from_scwrl_1645059625.pdb > /var/tmp/scwrl_1645059625.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1645059625.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 133 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server2_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_134274162.pdb -s /var/tmp/to_scwrl_134274162.seq -o /var/tmp/from_scwrl_134274162.pdb > /var/tmp/scwrl_134274162.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_134274162.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 163 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server2_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1654700189.pdb -s /var/tmp/to_scwrl_1654700189.seq -o /var/tmp/from_scwrl_1654700189.pdb > /var/tmp/scwrl_1654700189.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1654700189.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 190 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server2_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1129271739.pdb -s /var/tmp/to_scwrl_1129271739.seq -o /var/tmp/from_scwrl_1129271739.pdb > /var/tmp/scwrl_1129271739.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1129271739.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 89 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server2_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1723425899.pdb -s /var/tmp/to_scwrl_1723425899.seq -o /var/tmp/from_scwrl_1723425899.pdb > /var/tmp/scwrl_1723425899.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1723425899.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 190 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_301937789.pdb -s /var/tmp/to_scwrl_301937789.seq -o /var/tmp/from_scwrl_301937789.pdb > /var/tmp/scwrl_301937789.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_301937789.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 89 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1227673234.pdb -s /var/tmp/to_scwrl_1227673234.seq -o /var/tmp/from_scwrl_1227673234.pdb > /var/tmp/scwrl_1227673234.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1227673234.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 94 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_191595883.pdb -s /var/tmp/to_scwrl_191595883.seq -o /var/tmp/from_scwrl_191595883.pdb > /var/tmp/scwrl_191595883.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_191595883.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 133 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_356968874.pdb -s /var/tmp/to_scwrl_356968874.seq -o /var/tmp/from_scwrl_356968874.pdb > /var/tmp/scwrl_356968874.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_356968874.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 163 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1828757225.pdb -s /var/tmp/to_scwrl_1828757225.seq -o /var/tmp/from_scwrl_1828757225.pdb > /var/tmp/scwrl_1828757225.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1828757225.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 235 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1092196793.pdb -s /var/tmp/to_scwrl_1092196793.seq -o /var/tmp/from_scwrl_1092196793.pdb > /var/tmp/scwrl_1092196793.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1092196793.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 236 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1599886496.pdb -s /var/tmp/to_scwrl_1599886496.seq -o /var/tmp/from_scwrl_1599886496.pdb > /var/tmp/scwrl_1599886496.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1599886496.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 229 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1261755816.pdb -s /var/tmp/to_scwrl_1261755816.seq -o /var/tmp/from_scwrl_1261755816.pdb > /var/tmp/scwrl_1261755816.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1261755816.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 250 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_541775902.pdb -s /var/tmp/to_scwrl_541775902.seq -o /var/tmp/from_scwrl_541775902.pdb > /var/tmp/scwrl_541775902.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_541775902.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 235 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_712914392.pdb -s /var/tmp/to_scwrl_712914392.seq -o /var/tmp/from_scwrl_712914392.pdb > /var/tmp/scwrl_712914392.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_712914392.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 205 # copying to AlignedFragments data structure # naming current conformation NN_PUT_lab_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1891620925.pdb -s /var/tmp/to_scwrl_1891620925.seq -o /var/tmp/from_scwrl_1891620925.pdb > /var/tmp/scwrl_1891620925.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1891620925.pdb # conformation set from SCWRL output # naming current conformation NN_PUT_lab_TS1-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 229 ; scwrl3 -i /var/tmp/to_scwrl_1486887831.pdb -s /var/tmp/to_scwrl_1486887831.seq -o /var/tmp/from_scwrl_1486887831.pdb > /var/tmp/scwrl_1486887831.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1486887831.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 229 ; scwrl3 -i /var/tmp/to_scwrl_1331519901.pdb -s /var/tmp/to_scwrl_1331519901.seq -o /var/tmp/from_scwrl_1331519901.pdb > /var/tmp/scwrl_1331519901.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1331519901.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 229 ; scwrl3 -i /var/tmp/to_scwrl_1823026695.pdb -s /var/tmp/to_scwrl_1823026695.seq -o /var/tmp/from_scwrl_1823026695.pdb > /var/tmp/scwrl_1823026695.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1823026695.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 229 ; scwrl3 -i /var/tmp/to_scwrl_1166736953.pdb -s /var/tmp/to_scwrl_1166736953.seq -o /var/tmp/from_scwrl_1166736953.pdb > /var/tmp/scwrl_1166736953.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1166736953.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 229 ; scwrl3 -i /var/tmp/to_scwrl_1547675517.pdb -s /var/tmp/to_scwrl_1547675517.seq -o /var/tmp/from_scwrl_1547675517.pdb > /var/tmp/scwrl_1547675517.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1547675517.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 196 # copying to AlignedFragments data structure # naming current conformation PROTINFO_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1549635799.pdb -s /var/tmp/to_scwrl_1549635799.seq -o /var/tmp/from_scwrl_1549635799.pdb > /var/tmp/scwrl_1549635799.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1549635799.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 230 # copying to AlignedFragments data structure # naming current conformation PROTINFO_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1908125784.pdb -s /var/tmp/to_scwrl_1908125784.seq -o /var/tmp/from_scwrl_1908125784.pdb > /var/tmp/scwrl_1908125784.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1908125784.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 230 # copying to AlignedFragments data structure # naming current conformation PROTINFO_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_485635829.pdb -s /var/tmp/to_scwrl_485635829.seq -o /var/tmp/from_scwrl_485635829.pdb > /var/tmp/scwrl_485635829.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_485635829.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 95 # copying to AlignedFragments data structure # naming current conformation PROTINFO_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1196653758.pdb -s /var/tmp/to_scwrl_1196653758.seq -o /var/tmp/from_scwrl_1196653758.pdb > /var/tmp/scwrl_1196653758.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1196653758.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 231 # copying to AlignedFragments data structure # naming current conformation PROTINFO_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_422287844.pdb -s /var/tmp/to_scwrl_422287844.seq -o /var/tmp/from_scwrl_422287844.pdb > /var/tmp/scwrl_422287844.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_422287844.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 # Found a chain break before 253 # copying to AlignedFragments data structure # naming current conformation Pcons6_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_398482034.pdb -s /var/tmp/to_scwrl_398482034.seq -o /var/tmp/from_scwrl_398482034.pdb > /var/tmp/scwrl_398482034.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_398482034.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 # Found a chain break before 253 # copying to AlignedFragments data structure # naming current conformation Pcons6_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_2021772336.pdb -s /var/tmp/to_scwrl_2021772336.seq -o /var/tmp/from_scwrl_2021772336.pdb > /var/tmp/scwrl_2021772336.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2021772336.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 # Found a chain break before 189 # copying to AlignedFragments data structure # naming current conformation Pcons6_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_2124594177.pdb -s /var/tmp/to_scwrl_2124594177.seq -o /var/tmp/from_scwrl_2124594177.pdb > /var/tmp/scwrl_2124594177.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2124594177.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 # Found a chain break before 250 # copying to AlignedFragments data structure # naming current conformation Pcons6_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_330477185.pdb -s /var/tmp/to_scwrl_330477185.seq -o /var/tmp/from_scwrl_330477185.pdb > /var/tmp/scwrl_330477185.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_330477185.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 # Found a chain break before 235 # copying to AlignedFragments data structure # naming current conformation Pcons6_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_723285426.pdb -s /var/tmp/to_scwrl_723285426.seq -o /var/tmp/from_scwrl_723285426.pdb > /var/tmp/scwrl_723285426.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_723285426.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 T0378 can't currently be optimized by undertaker # naming current conformation Phyre-1_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1622170156.pdb -s /var/tmp/to_scwrl_1622170156.seq -o /var/tmp/from_scwrl_1622170156.pdb > /var/tmp/scwrl_1622170156.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1622170156.pdb # conformation set from SCWRL output # naming current conformation Phyre-1_TS1-scwrl # ReadConformPDB reading from PDB file servers/Phyre-2_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # naming current conformation Phyre-2_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_464751347.pdb -s /var/tmp/to_scwrl_464751347.seq -o /var/tmp/from_scwrl_464751347.pdb > /var/tmp/scwrl_464751347.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_464751347.pdb # conformation set from SCWRL output # naming current conformation Phyre-2_TS1-scwrl # ReadConformPDB reading from PDB file servers/Phyre-2_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # naming current conformation Phyre-2_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_230501969.pdb -s /var/tmp/to_scwrl_230501969.seq -o /var/tmp/from_scwrl_230501969.pdb > /var/tmp/scwrl_230501969.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_230501969.pdb # conformation set from SCWRL output # naming current conformation Phyre-2_TS2-scwrl # ReadConformPDB reading from PDB file servers/Phyre-2_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # naming current conformation Phyre-2_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_603958249.pdb -s /var/tmp/to_scwrl_603958249.seq -o /var/tmp/from_scwrl_603958249.pdb > /var/tmp/scwrl_603958249.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_603958249.pdb # conformation set from SCWRL output # naming current conformation Phyre-2_TS3-scwrl # ReadConformPDB reading from PDB file servers/Phyre-2_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # naming current conformation Phyre-2_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_40693600.pdb -s /var/tmp/to_scwrl_40693600.seq -o /var/tmp/from_scwrl_40693600.pdb > /var/tmp/scwrl_40693600.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_40693600.pdb # conformation set from SCWRL output # naming current conformation Phyre-2_TS4-scwrl # ReadConformPDB reading from PDB file servers/Phyre-2_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # naming current conformation Phyre-2_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_532439758.pdb -s /var/tmp/to_scwrl_532439758.seq -o /var/tmp/from_scwrl_532439758.pdb > /var/tmp/scwrl_532439758.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_532439758.pdb # conformation set from SCWRL output # naming current conformation Phyre-2_TS5-scwrl # ReadConformPDB reading from PDB file servers/Pmodeller6_TS1.pdb.gz looking for model 1 # Found a chain break before 235 # copying to AlignedFragments data structure # naming current conformation Pmodeller6_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1831631483.pdb -s /var/tmp/to_scwrl_1831631483.seq -o /var/tmp/from_scwrl_1831631483.pdb > /var/tmp/scwrl_1831631483.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1831631483.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 235 # copying to AlignedFragments data structure # naming current conformation Pmodeller6_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_232289483.pdb -s /var/tmp/to_scwrl_232289483.seq -o /var/tmp/from_scwrl_232289483.pdb > /var/tmp/scwrl_232289483.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_232289483.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 253 # copying to AlignedFragments data structure # naming current conformation Pmodeller6_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_889408632.pdb -s /var/tmp/to_scwrl_889408632.seq -o /var/tmp/from_scwrl_889408632.pdb > /var/tmp/scwrl_889408632.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_889408632.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 235 # copying to AlignedFragments data structure # naming current conformation Pmodeller6_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1512905061.pdb -s /var/tmp/to_scwrl_1512905061.seq -o /var/tmp/from_scwrl_1512905061.pdb > /var/tmp/scwrl_1512905061.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1512905061.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 # Found a chain break before 235 # copying to AlignedFragments data structure # naming current conformation Pmodeller6_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1324486276.pdb -s /var/tmp/to_scwrl_1324486276.seq -o /var/tmp/from_scwrl_1324486276.pdb > /var/tmp/scwrl_1324486276.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1324486276.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 76 # copying to AlignedFragments data structure # naming current conformation RAPTOR-ACE_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_341811482.pdb -s /var/tmp/to_scwrl_341811482.seq -o /var/tmp/from_scwrl_341811482.pdb > /var/tmp/scwrl_341811482.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_341811482.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 43 # copying to AlignedFragments data structure # naming current conformation RAPTOR-ACE_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_627177231.pdb -s /var/tmp/to_scwrl_627177231.seq -o /var/tmp/from_scwrl_627177231.pdb > /var/tmp/scwrl_627177231.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_627177231.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 226 # copying to AlignedFragments data structure # naming current conformation RAPTOR-ACE_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1866262178.pdb -s /var/tmp/to_scwrl_1866262178.seq -o /var/tmp/from_scwrl_1866262178.pdb > /var/tmp/scwrl_1866262178.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1866262178.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 234 # copying to AlignedFragments data structure # naming current conformation RAPTOR-ACE_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1054725874.pdb -s /var/tmp/to_scwrl_1054725874.seq -o /var/tmp/from_scwrl_1054725874.pdb > /var/tmp/scwrl_1054725874.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1054725874.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 96 # copying to AlignedFragments data structure # naming current conformation RAPTOR-ACE_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_371314509.pdb -s /var/tmp/to_scwrl_371314509.seq -o /var/tmp/from_scwrl_371314509.pdb > /var/tmp/scwrl_371314509.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_371314509.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 132 # copying to AlignedFragments data structure # naming current conformation RAPTORESS_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1205666362.pdb -s /var/tmp/to_scwrl_1205666362.seq -o /var/tmp/from_scwrl_1205666362.pdb > /var/tmp/scwrl_1205666362.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1205666362.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 223 # copying to AlignedFragments data structure # naming current conformation RAPTORESS_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_238762128.pdb -s /var/tmp/to_scwrl_238762128.seq -o /var/tmp/from_scwrl_238762128.pdb > /var/tmp/scwrl_238762128.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_238762128.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 155 # copying to AlignedFragments data structure # naming current conformation RAPTORESS_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_46857557.pdb -s /var/tmp/to_scwrl_46857557.seq -o /var/tmp/from_scwrl_46857557.pdb > /var/tmp/scwrl_46857557.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_46857557.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 237 # copying to AlignedFragments data structure # naming current conformation RAPTORESS_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_224919670.pdb -s /var/tmp/to_scwrl_224919670.seq -o /var/tmp/from_scwrl_224919670.pdb > /var/tmp/scwrl_224919670.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_224919670.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 208 # copying to AlignedFragments data structure # naming current conformation RAPTORESS_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1786437645.pdb -s /var/tmp/to_scwrl_1786437645.seq -o /var/tmp/from_scwrl_1786437645.pdb > /var/tmp/scwrl_1786437645.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1786437645.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 94 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1596493356.pdb -s /var/tmp/to_scwrl_1596493356.seq -o /var/tmp/from_scwrl_1596493356.pdb > /var/tmp/scwrl_1596493356.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1596493356.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 190 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_2133045454.pdb -s /var/tmp/to_scwrl_2133045454.seq -o /var/tmp/from_scwrl_2133045454.pdb > /var/tmp/scwrl_2133045454.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2133045454.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 133 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_124589828.pdb -s /var/tmp/to_scwrl_124589828.seq -o /var/tmp/from_scwrl_124589828.pdb > /var/tmp/scwrl_124589828.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_124589828.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 181 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_645663468.pdb -s /var/tmp/to_scwrl_645663468.seq -o /var/tmp/from_scwrl_645663468.pdb > /var/tmp/scwrl_645663468.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_645663468.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 206 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_407849652.pdb -s /var/tmp/to_scwrl_407849652.seq -o /var/tmp/from_scwrl_407849652.pdb > /var/tmp/scwrl_407849652.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_407849652.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 159 # copying to AlignedFragments data structure # naming current conformation ROBETTA_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_523071862.pdb -s /var/tmp/to_scwrl_523071862.seq -o /var/tmp/from_scwrl_523071862.pdb > /var/tmp/scwrl_523071862.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_523071862.pdb # conformation set from SCWRL output # naming current conformation ROBETTA_TS1-scwrl # ReadConformPDB reading from PDB file servers/ROBETTA_TS2.pdb.gz looking for model 1 # Found a chain break before 224 # copying to AlignedFragments data structure # naming current conformation ROBETTA_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_519952158.pdb -s /var/tmp/to_scwrl_519952158.seq -o /var/tmp/from_scwrl_519952158.pdb > /var/tmp/scwrl_519952158.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_519952158.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 194 # copying to AlignedFragments data structure # naming current conformation ROBETTA_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_384960182.pdb -s /var/tmp/to_scwrl_384960182.seq -o /var/tmp/from_scwrl_384960182.pdb > /var/tmp/scwrl_384960182.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_384960182.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 228 # copying to AlignedFragments data structure # naming current conformation ROBETTA_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_853549047.pdb -s /var/tmp/to_scwrl_853549047.seq -o /var/tmp/from_scwrl_853549047.pdb > /var/tmp/scwrl_853549047.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_853549047.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 190 # copying to AlignedFragments data structure # naming current conformation ROBETTA_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1243237583.pdb -s /var/tmp/to_scwrl_1243237583.seq -o /var/tmp/from_scwrl_1243237583.pdb > /var/tmp/scwrl_1243237583.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1243237583.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 130 # copying to AlignedFragments data structure # naming current conformation ROKKY_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_2007130338.pdb -s /var/tmp/to_scwrl_2007130338.seq -o /var/tmp/from_scwrl_2007130338.pdb > /var/tmp/scwrl_2007130338.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2007130338.pdb # conformation set from SCWRL output # naming current conformation ROKKY_TS1-scwrl # ReadConformPDB reading from PDB file servers/SAM-T02_AL1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1318300394.pdb -s /var/tmp/to_scwrl_1318300394.seq -o /var/tmp/from_scwrl_1318300394.pdb > /var/tmp/scwrl_1318300394.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1318300394.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 T0378 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1473739552.pdb -s /var/tmp/to_scwrl_1473739552.seq -o /var/tmp/from_scwrl_1473739552.pdb > /var/tmp/scwrl_1473739552.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1473739552.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 T0378 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_463604940.pdb -s /var/tmp/to_scwrl_463604940.seq -o /var/tmp/from_scwrl_463604940.pdb > /var/tmp/scwrl_463604940.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_463604940.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 T0378 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1358993994.pdb -s /var/tmp/to_scwrl_1358993994.seq -o /var/tmp/from_scwrl_1358993994.pdb > /var/tmp/scwrl_1358993994.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1358993994.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 T0378 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_2006179311.pdb -s /var/tmp/to_scwrl_2006179311.seq -o /var/tmp/from_scwrl_2006179311.pdb > /var/tmp/scwrl_2006179311.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2006179311.pdb # conformation set from SCWRL output # naming current conformation SAM-T02_AL5-scwrl # ReadConformPDB reading from PDB file servers/SAM-T99_AL1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # naming current conformation SAM-T99_AL1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_147752776.pdb -s /var/tmp/to_scwrl_147752776.seq -o /var/tmp/from_scwrl_147752776.pdb > /var/tmp/scwrl_147752776.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_147752776.pdb # conformation set from SCWRL output # naming current conformation SAM-T99_AL1-scwrl # ReadConformPDB reading from PDB file servers/SAM-T99_AL2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # naming current conformation SAM-T99_AL2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1591283477.pdb -s /var/tmp/to_scwrl_1591283477.seq -o /var/tmp/from_scwrl_1591283477.pdb > /var/tmp/scwrl_1591283477.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1591283477.pdb # conformation set from SCWRL output # naming current conformation SAM-T99_AL2-scwrl # ReadConformPDB reading from PDB file servers/SAM-T99_AL3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # naming current conformation SAM-T99_AL3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_748104296.pdb -s /var/tmp/to_scwrl_748104296.seq -o /var/tmp/from_scwrl_748104296.pdb > /var/tmp/scwrl_748104296.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_748104296.pdb # conformation set from SCWRL output # naming current conformation SAM-T99_AL3-scwrl # ReadConformPDB reading from PDB file servers/SAM-T99_AL4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # naming current conformation SAM-T99_AL4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1660657837.pdb -s /var/tmp/to_scwrl_1660657837.seq -o /var/tmp/from_scwrl_1660657837.pdb > /var/tmp/scwrl_1660657837.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1660657837.pdb # conformation set from SCWRL output # naming current conformation SAM-T99_AL4-scwrl # ReadConformPDB reading from PDB file servers/SAM-T99_AL5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # naming current conformation SAM-T99_AL5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_768286107.pdb -s /var/tmp/to_scwrl_768286107.seq -o /var/tmp/from_scwrl_768286107.pdb > /var/tmp/scwrl_768286107.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_768286107.pdb # conformation set from SCWRL output # naming current conformation SAM-T99_AL5-scwrl # ReadConformPDB reading from PDB file servers/SAM_T06_server_TS1.pdb.gz looking for model 1 # Found a chain break before 238 # copying to AlignedFragments data structure # naming current conformation SAM_T06_server_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1089915777.pdb -s /var/tmp/to_scwrl_1089915777.seq -o /var/tmp/from_scwrl_1089915777.pdb > /var/tmp/scwrl_1089915777.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1089915777.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 T0378 can't currently be optimized by undertaker # naming current conformation SAM_T06_server_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_140351421.pdb -s /var/tmp/to_scwrl_140351421.seq -o /var/tmp/from_scwrl_140351421.pdb > /var/tmp/scwrl_140351421.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_140351421.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 T0378 can't currently be optimized by undertaker # naming current conformation SAM_T06_server_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_487064639.pdb -s /var/tmp/to_scwrl_487064639.seq -o /var/tmp/from_scwrl_487064639.pdb > /var/tmp/scwrl_487064639.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_487064639.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 T0378 can't currently be optimized by undertaker # naming current conformation SAM_T06_server_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_2144641652.pdb -s /var/tmp/to_scwrl_2144641652.seq -o /var/tmp/from_scwrl_2144641652.pdb > /var/tmp/scwrl_2144641652.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2144641652.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 T0378 can't currently be optimized by undertaker # naming current conformation SAM_T06_server_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_511665930.pdb -s /var/tmp/to_scwrl_511665930.seq -o /var/tmp/from_scwrl_511665930.pdb > /var/tmp/scwrl_511665930.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_511665930.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 234 # copying to AlignedFragments data structure # naming current conformation SP3_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1692731001.pdb -s /var/tmp/to_scwrl_1692731001.seq -o /var/tmp/from_scwrl_1692731001.pdb > /var/tmp/scwrl_1692731001.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1692731001.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 133 # copying to AlignedFragments data structure # naming current conformation SP3_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_235920133.pdb -s /var/tmp/to_scwrl_235920133.seq -o /var/tmp/from_scwrl_235920133.pdb > /var/tmp/scwrl_235920133.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_235920133.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 202 # copying to AlignedFragments data structure # naming current conformation SP3_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_558523488.pdb -s /var/tmp/to_scwrl_558523488.seq -o /var/tmp/from_scwrl_558523488.pdb > /var/tmp/scwrl_558523488.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_558523488.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 187 # copying to AlignedFragments data structure # naming current conformation SP3_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1917650671.pdb -s /var/tmp/to_scwrl_1917650671.seq -o /var/tmp/from_scwrl_1917650671.pdb > /var/tmp/scwrl_1917650671.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1917650671.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 143 # copying to AlignedFragments data structure # naming current conformation SP3_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_2022357779.pdb -s /var/tmp/to_scwrl_2022357779.seq -o /var/tmp/from_scwrl_2022357779.pdb > /var/tmp/scwrl_2022357779.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2022357779.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 187 # copying to AlignedFragments data structure # naming current conformation SP4_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_7533197.pdb -s /var/tmp/to_scwrl_7533197.seq -o /var/tmp/from_scwrl_7533197.pdb > /var/tmp/scwrl_7533197.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_7533197.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 133 # copying to AlignedFragments data structure # naming current conformation SP4_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1903212479.pdb -s /var/tmp/to_scwrl_1903212479.seq -o /var/tmp/from_scwrl_1903212479.pdb > /var/tmp/scwrl_1903212479.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1903212479.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 202 # copying to AlignedFragments data structure # naming current conformation SP4_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_2146947607.pdb -s /var/tmp/to_scwrl_2146947607.seq -o /var/tmp/from_scwrl_2146947607.pdb > /var/tmp/scwrl_2146947607.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2146947607.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 # naming current conformation SP4_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_653196666.pdb -s /var/tmp/to_scwrl_653196666.seq -o /var/tmp/from_scwrl_653196666.pdb > /var/tmp/scwrl_653196666.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_653196666.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 111 # copying to AlignedFragments data structure # naming current conformation SP4_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_163578484.pdb -s /var/tmp/to_scwrl_163578484.seq -o /var/tmp/from_scwrl_163578484.pdb > /var/tmp/scwrl_163578484.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_163578484.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 76 # copying to AlignedFragments data structure # naming current conformation SPARKS2_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_522535822.pdb -s /var/tmp/to_scwrl_522535822.seq -o /var/tmp/from_scwrl_522535822.pdb > /var/tmp/scwrl_522535822.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_522535822.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 133 # copying to AlignedFragments data structure # naming current conformation SPARKS2_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1173148823.pdb -s /var/tmp/to_scwrl_1173148823.seq -o /var/tmp/from_scwrl_1173148823.pdb > /var/tmp/scwrl_1173148823.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1173148823.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 208 # copying to AlignedFragments data structure # naming current conformation SPARKS2_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_548538666.pdb -s /var/tmp/to_scwrl_548538666.seq -o /var/tmp/from_scwrl_548538666.pdb > /var/tmp/scwrl_548538666.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_548538666.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 196 # copying to AlignedFragments data structure # naming current conformation SPARKS2_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1376084869.pdb -s /var/tmp/to_scwrl_1376084869.seq -o /var/tmp/from_scwrl_1376084869.pdb > /var/tmp/scwrl_1376084869.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1376084869.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 143 # copying to AlignedFragments data structure # naming current conformation SPARKS2_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_268902760.pdb -s /var/tmp/to_scwrl_268902760.seq -o /var/tmp/from_scwrl_268902760.pdb > /var/tmp/scwrl_268902760.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_268902760.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 T0378 can't currently be optimized by undertaker # naming current conformation UNI-EID_bnmx_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_408185358.pdb -s /var/tmp/to_scwrl_408185358.seq -o /var/tmp/from_scwrl_408185358.pdb > /var/tmp/scwrl_408185358.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_408185358.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 T0378 can't currently be optimized by undertaker # naming current conformation UNI-EID_bnmx_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_546901617.pdb -s /var/tmp/to_scwrl_546901617.seq -o /var/tmp/from_scwrl_546901617.pdb > /var/tmp/scwrl_546901617.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_546901617.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 T0378 can't currently be optimized by undertaker # naming current conformation UNI-EID_bnmx_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1742642313.pdb -s /var/tmp/to_scwrl_1742642313.seq -o /var/tmp/from_scwrl_1742642313.pdb > /var/tmp/scwrl_1742642313.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1742642313.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 T0378 can't currently be optimized by undertaker # naming current conformation UNI-EID_bnmx_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_871790298.pdb -s /var/tmp/to_scwrl_871790298.seq -o /var/tmp/from_scwrl_871790298.pdb > /var/tmp/scwrl_871790298.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_871790298.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 T0378 can't currently be optimized by undertaker # naming current conformation UNI-EID_bnmx_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1905895611.pdb -s /var/tmp/to_scwrl_1905895611.seq -o /var/tmp/from_scwrl_1905895611.pdb > /var/tmp/scwrl_1905895611.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1905895611.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 T0378 can't currently be optimized by undertaker # naming current conformation UNI-EID_expm_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1601337977.pdb -s /var/tmp/to_scwrl_1601337977.seq -o /var/tmp/from_scwrl_1601337977.pdb > /var/tmp/scwrl_1601337977.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1601337977.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 T0378 can't currently be optimized by undertaker # naming current conformation UNI-EID_sfst_AL1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1019543075.pdb -s /var/tmp/to_scwrl_1019543075.seq -o /var/tmp/from_scwrl_1019543075.pdb > /var/tmp/scwrl_1019543075.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1019543075.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 T0378 can't currently be optimized by undertaker # naming current conformation UNI-EID_sfst_AL2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1349695441.pdb -s /var/tmp/to_scwrl_1349695441.seq -o /var/tmp/from_scwrl_1349695441.pdb > /var/tmp/scwrl_1349695441.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1349695441.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 T0378 can't currently be optimized by undertaker # naming current conformation UNI-EID_sfst_AL3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_201958626.pdb -s /var/tmp/to_scwrl_201958626.seq -o /var/tmp/from_scwrl_201958626.pdb > /var/tmp/scwrl_201958626.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_201958626.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 T0378 can't currently be optimized by undertaker # naming current conformation UNI-EID_sfst_AL4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_532717265.pdb -s /var/tmp/to_scwrl_532717265.seq -o /var/tmp/from_scwrl_532717265.pdb > /var/tmp/scwrl_532717265.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_532717265.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 T0378 can't currently be optimized by undertaker # naming current conformation UNI-EID_sfst_AL5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_2117981548.pdb -s /var/tmp/to_scwrl_2117981548.seq -o /var/tmp/from_scwrl_2117981548.pdb > /var/tmp/scwrl_2117981548.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2117981548.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 135 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1291874404.pdb -s /var/tmp/to_scwrl_1291874404.seq -o /var/tmp/from_scwrl_1291874404.pdb > /var/tmp/scwrl_1291874404.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1291874404.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 229 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_673068687.pdb -s /var/tmp/to_scwrl_673068687.seq -o /var/tmp/from_scwrl_673068687.pdb > /var/tmp/scwrl_673068687.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_673068687.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 232 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_457562540.pdb -s /var/tmp/to_scwrl_457562540.seq -o /var/tmp/from_scwrl_457562540.pdb > /var/tmp/scwrl_457562540.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_457562540.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 224 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1289032409.pdb -s /var/tmp/to_scwrl_1289032409.seq -o /var/tmp/from_scwrl_1289032409.pdb > /var/tmp/scwrl_1289032409.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1289032409.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 229 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1184734616.pdb -s /var/tmp/to_scwrl_1184734616.seq -o /var/tmp/from_scwrl_1184734616.pdb > /var/tmp/scwrl_1184734616.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1184734616.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 253 # copying to AlignedFragments data structure # naming current conformation beautshot_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_2809895.pdb -s /var/tmp/to_scwrl_2809895.seq -o /var/tmp/from_scwrl_2809895.pdb > /var/tmp/scwrl_2809895.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_2809895.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 # Found a chain break before 253 # copying to AlignedFragments data structure # naming current conformation beautshotbase_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1524952542.pdb -s /var/tmp/to_scwrl_1524952542.seq -o /var/tmp/from_scwrl_1524952542.pdb > /var/tmp/scwrl_1524952542.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1524952542.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 T0378 can't currently be optimized by undertaker # naming current conformation forecast-s_AL1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1743258104.pdb -s /var/tmp/to_scwrl_1743258104.seq -o /var/tmp/from_scwrl_1743258104.pdb > /var/tmp/scwrl_1743258104.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1743258104.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 T0378 can't currently be optimized by undertaker # naming current conformation forecast-s_AL2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1920460566.pdb -s /var/tmp/to_scwrl_1920460566.seq -o /var/tmp/from_scwrl_1920460566.pdb > /var/tmp/scwrl_1920460566.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1920460566.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 T0378 can't currently be optimized by undertaker # naming current conformation forecast-s_AL3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1399826674.pdb -s /var/tmp/to_scwrl_1399826674.seq -o /var/tmp/from_scwrl_1399826674.pdb > /var/tmp/scwrl_1399826674.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1399826674.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 Skipped atom 498, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 500, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 502, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 504, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 506, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 508, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 510, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 512, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 514, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 516, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 518, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 520, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 522, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 524, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 526, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 528, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 530, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 532, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 534, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 536, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # naming current conformation forecast-s_AL4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1750791302.pdb -s /var/tmp/to_scwrl_1750791302.seq -o /var/tmp/from_scwrl_1750791302.pdb > /var/tmp/scwrl_1750791302.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1750791302.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 T0378 can't currently be optimized by undertaker # naming current conformation forecast-s_AL5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1676189398.pdb -s /var/tmp/to_scwrl_1676189398.seq -o /var/tmp/from_scwrl_1676189398.pdb > /var/tmp/scwrl_1676189398.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1676189398.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 188 # copying to AlignedFragments data structure # naming current conformation karypis.srv.2_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1399290634.pdb -s /var/tmp/to_scwrl_1399290634.seq -o /var/tmp/from_scwrl_1399290634.pdb > /var/tmp/scwrl_1399290634.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1399290634.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 189 # copying to AlignedFragments data structure # naming current conformation karypis.srv.2_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_256504321.pdb -s /var/tmp/to_scwrl_256504321.seq -o /var/tmp/from_scwrl_256504321.pdb > /var/tmp/scwrl_256504321.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_256504321.pdb # conformation set from SCWRL output # naming current conformation karypis.srv.2_TS2-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv.2_TS3.pdb.gz looking for model 1 # naming current conformation karypis.srv.2_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1839767882.pdb -s /var/tmp/to_scwrl_1839767882.seq -o /var/tmp/from_scwrl_1839767882.pdb > /var/tmp/scwrl_1839767882.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1839767882.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 186 # copying to AlignedFragments data structure # naming current conformation karypis.srv.2_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1921826457.pdb -s /var/tmp/to_scwrl_1921826457.seq -o /var/tmp/from_scwrl_1921826457.pdb > /var/tmp/scwrl_1921826457.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1921826457.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 189 # copying to AlignedFragments data structure # naming current conformation karypis.srv.2_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1429653144.pdb -s /var/tmp/to_scwrl_1429653144.seq -o /var/tmp/from_scwrl_1429653144.pdb > /var/tmp/scwrl_1429653144.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1429653144.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 WARNING: atoms too close: (T0378)T157.O and (T0378)P158.N only 0.000 apart, marking (T0378)P158.N as missing # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation karypis.srv.4_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_240822902.pdb -s /var/tmp/to_scwrl_240822902.seq -o /var/tmp/from_scwrl_240822902.pdb > /var/tmp/scwrl_240822902.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_240822902.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: atoms too close: (T0378)G100.O and (T0378)L101.N only 0.000 apart, marking (T0378)L101.N as missing WARNING: atoms too close: (T0378)G115.O and (T0378)T116.N only 0.000 apart, marking (T0378)T116.N as missing WARNING: atoms too close: (T0378)T157.O and (T0378)P158.N only 0.000 apart, marking (T0378)P158.N as missing WARNING: atoms too close: (T0378)F180.O and (T0378)L181.N only 0.000 apart, marking (T0378)L181.N as missing WARNING: atoms too close: (T0378)F194.O and (T0378)T195.N only 0.000 apart, marking (T0378)T195.N as missing # WARNING: incomplete conformation T0378 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 229 ; scwrl3 -i /var/tmp/to_scwrl_1150427679.pdb -s /var/tmp/to_scwrl_1150427679.seq -o /var/tmp/from_scwrl_1150427679.pdb > /var/tmp/scwrl_1150427679.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1150427679.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 248 # copying to AlignedFragments data structure # naming current conformation karypis.srv.4_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1698555904.pdb -s /var/tmp/to_scwrl_1698555904.seq -o /var/tmp/from_scwrl_1698555904.pdb > /var/tmp/scwrl_1698555904.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1698555904.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 # Found a chain break before 251 # copying to AlignedFragments data structure # naming current conformation karypis.srv.4_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_649008260.pdb -s /var/tmp/to_scwrl_649008260.seq -o /var/tmp/from_scwrl_649008260.pdb > /var/tmp/scwrl_649008260.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_649008260.pdb # conformation set from SCWRL output # naming current conformation karypis.srv.4_TS4-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv.4_TS5.pdb.gz looking for model 1 WARNING: atoms too close: (T0378)A189.O and (T0378)P190.N only 0.000 apart, marking (T0378)P190.N as missing WARNING: atoms too close: (T0378)T243.O and (T0378)A244.N only 0.000 apart, marking (T0378)A244.N as missing # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation karypis.srv.4_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1697329296.pdb -s /var/tmp/to_scwrl_1697329296.seq -o /var/tmp/from_scwrl_1697329296.pdb > /var/tmp/scwrl_1697329296.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1697329296.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 T0378 can't currently be optimized by undertaker # naming current conformation karypis.srv_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1293714570.pdb -s /var/tmp/to_scwrl_1293714570.seq -o /var/tmp/from_scwrl_1293714570.pdb > /var/tmp/scwrl_1293714570.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1293714570.pdb # conformation set from SCWRL output # naming current conformation karypis.srv_TS1-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # naming current conformation karypis.srv_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1520798557.pdb -s /var/tmp/to_scwrl_1520798557.seq -o /var/tmp/from_scwrl_1520798557.pdb > /var/tmp/scwrl_1520798557.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1520798557.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 T0378 can't currently be optimized by undertaker # naming current conformation karypis.srv_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1455741260.pdb -s /var/tmp/to_scwrl_1455741260.seq -o /var/tmp/from_scwrl_1455741260.pdb > /var/tmp/scwrl_1455741260.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1455741260.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 T0378 can't currently be optimized by undertaker # naming current conformation karypis.srv_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_747568901.pdb -s /var/tmp/to_scwrl_747568901.seq -o /var/tmp/from_scwrl_747568901.pdb > /var/tmp/scwrl_747568901.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_747568901.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 T0378 can't currently be optimized by undertaker # naming current conformation karypis.srv_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_392857985.pdb -s /var/tmp/to_scwrl_392857985.seq -o /var/tmp/from_scwrl_392857985.pdb > /var/tmp/scwrl_392857985.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_392857985.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 229 ; scwrl3 -i /var/tmp/to_scwrl_657953055.pdb -s /var/tmp/to_scwrl_657953055.seq -o /var/tmp/from_scwrl_657953055.pdb > /var/tmp/scwrl_657953055.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_657953055.pdb # conformation set from SCWRL output # naming current conformation keasar-server_TS1-scwrl # ReadConformPDB reading from PDB file servers/keasar-server_TS2.pdb.gz looking for model 1 # Found a chain break before 104 # copying to AlignedFragments data structure # naming current conformation keasar-server_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_949527528.pdb -s /var/tmp/to_scwrl_949527528.seq -o /var/tmp/from_scwrl_949527528.pdb > /var/tmp/scwrl_949527528.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_949527528.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 229 ; scwrl3 -i /var/tmp/to_scwrl_925575251.pdb -s /var/tmp/to_scwrl_925575251.seq -o /var/tmp/from_scwrl_925575251.pdb > /var/tmp/scwrl_925575251.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_925575251.pdb # conformation set from SCWRL output # naming current conformation keasar-server_TS3-scwrl # ReadConformPDB reading from PDB file servers/keasar-server_TS4.pdb.gz looking for model 1 # Found a chain break before 86 # copying to AlignedFragments data structure # naming current conformation keasar-server_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_628450956.pdb -s /var/tmp/to_scwrl_628450956.seq -o /var/tmp/from_scwrl_628450956.pdb > /var/tmp/scwrl_628450956.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_628450956.pdb # conformation set from SCWRL output # naming current conformation keasar-server_TS4-scwrl # ReadConformPDB reading from PDB file servers/keasar-server_TS5.pdb.gz looking for model 1 # Found a chain break before 198 # copying to AlignedFragments data structure # naming current conformation keasar-server_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_93918285.pdb -s /var/tmp/to_scwrl_93918285.seq -o /var/tmp/from_scwrl_93918285.pdb > /var/tmp/scwrl_93918285.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_93918285.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 T0378 can't currently be optimized by undertaker # naming current conformation mGen-3D_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1598643937.pdb -s /var/tmp/to_scwrl_1598643937.seq -o /var/tmp/from_scwrl_1598643937.pdb > /var/tmp/scwrl_1598643937.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1598643937.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 T0378 can't currently be optimized by undertaker # naming current conformation nFOLD_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1086013496.pdb -s /var/tmp/to_scwrl_1086013496.seq -o /var/tmp/from_scwrl_1086013496.pdb > /var/tmp/scwrl_1086013496.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1086013496.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 T0378 can't currently be optimized by undertaker # naming current conformation nFOLD_TS2 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1382950694.pdb -s /var/tmp/to_scwrl_1382950694.seq -o /var/tmp/from_scwrl_1382950694.pdb > /var/tmp/scwrl_1382950694.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1382950694.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: atom 1 has residue number 1 < previous residue 254 in servers/nFOLD_TS3.pdb.gz # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # naming current conformation nFOLD_TS3 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_635894907.pdb -s /var/tmp/to_scwrl_635894907.seq -o /var/tmp/from_scwrl_635894907.pdb > /var/tmp/scwrl_635894907.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_635894907.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: atom 1 has residue number 1 < previous residue 254 in servers/nFOLD_TS4.pdb.gz # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # naming current conformation nFOLD_TS4 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_1088823391.pdb -s /var/tmp/to_scwrl_1088823391.seq -o /var/tmp/from_scwrl_1088823391.pdb > /var/tmp/scwrl_1088823391.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_1088823391.pdb # conformation set from SCWRL output # naming current conformation nFOLD_TS4-scwrl # ReadConformPDB reading from PDB file servers/nFOLD_TS5.pdb.gz looking for model 1 WARNING: atom 1 has residue number 1 < previous residue 254 in servers/nFOLD_TS5.pdb.gz # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # naming current conformation nFOLD_TS5 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_760419590.pdb -s /var/tmp/to_scwrl_760419590.seq -o /var/tmp/from_scwrl_760419590.pdb > /var/tmp/scwrl_760419590.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_760419590.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: atoms too close: (T0378)V64.N and (T0378)E65.N only 0.000 apart, marking (T0378)E65.N as missing WARNING: atoms too close: (T0378)V64.CA and (T0378)E65.CA only 0.000 apart, marking (T0378)E65.CA as missing WARNING: atoms too close: (T0378)V64.CB and (T0378)E65.CB only 0.000 apart, marking (T0378)E65.CB as missing WARNING: atoms too close: (T0378)V64.CG1 and (T0378)E65.CG only 0.000 apart, marking (T0378)E65.CG as missing WARNING: atoms too close: (T0378)V64.O and (T0378)E65.O only 0.000 apart, marking (T0378)E65.O as missing WARNING: atoms too close: (T0378)V64.C and (T0378)E65.C only 0.000 apart, marking (T0378)E65.C as missing WARNING: atoms too close: (T0378)E65.N and (T0378)L66.N only 0.000 apart, marking (T0378)E65.N as missing WARNING: atoms too close: (T0378)V64.N and (T0378)L66.N only 0.000 apart, marking (T0378)L66.N as missing WARNING: atoms too close: (T0378)E65.CA and (T0378)L66.CA only 0.000 apart, marking (T0378)L66.CA as missing WARNING: atoms too close: (T0378)V64.CA and (T0378)L66.CA only 0.000 apart, marking (T0378)L66.CA as missing WARNING: atoms too close: (T0378)E65.CB and (T0378)L66.CB only 0.000 apart, marking (T0378)L66.CB as missing WARNING: atoms too close: (T0378)V64.CB and (T0378)L66.CB only 0.000 apart, marking (T0378)L66.CB as missing WARNING: atoms too close: (T0378)E65.CG and (T0378)L66.CG only 0.000 apart, marking (T0378)L66.CG as missing WARNING: atoms too close: (T0378)V64.CG1 and (T0378)L66.CG only 0.000 apart, marking (T0378)L66.CG as missing WARNING: atoms too close: (T0378)E65.CD and (T0378)L66.CD1 only 0.000 apart, marking (T0378)L66.CD1 as missing WARNING: atoms too close: (T0378)E65.O and (T0378)L66.O only 0.000 apart, marking (T0378)L66.O as missing WARNING: atoms too close: (T0378)V64.O and (T0378)L66.O only 0.000 apart, marking (T0378)L66.O as missing WARNING: atoms too close: (T0378)E65.C and (T0378)L66.C only 0.000 apart, marking (T0378)L66.C as missing WARNING: atoms too close: (T0378)V64.C and (T0378)L66.C only 0.000 apart, marking (T0378)L66.C as missing WARNING: atoms too close: (T0378)L66.N and (T0378)P67.N only 0.000 apart, marking (T0378)L66.N as missing WARNING: atoms too close: (T0378)E65.N and (T0378)P67.N only 0.000 apart, marking (T0378)E65.N as missing WARNING: atoms too close: (T0378)V64.N and (T0378)P67.N only 0.000 apart, marking (T0378)P67.N as missing WARNING: atoms too close: (T0378)L66.CA and (T0378)P67.CA only 0.000 apart, marking (T0378)P67.CA as missing WARNING: atoms too close: (T0378)E65.CA and (T0378)P67.CA only 0.000 apart, marking (T0378)P67.CA as missing WARNING: atoms too close: (T0378)V64.CA and (T0378)P67.CA only 0.000 apart, marking (T0378)P67.CA as missing WARNING: atoms too close: (T0378)L66.CB and (T0378)P67.CB only 0.000 apart, marking (T0378)P67.CB as missing WARNING: atoms too close: (T0378)E65.CB and (T0378)P67.CB only 0.000 apart, marking (T0378)P67.CB as missing WARNING: atoms too close: (T0378)V64.CB and (T0378)P67.CB only 0.000 apart, marking (T0378)P67.CB as missing WARNING: atoms too close: (T0378)L66.O and (T0378)P67.O only 0.000 apart, marking (T0378)P67.O as missing WARNING: atoms too close: (T0378)E65.O and (T0378)P67.O only 0.000 apart, marking (T0378)P67.O as missing WARNING: atoms too close: (T0378)V64.O and (T0378)P67.O only 0.000 apart, marking (T0378)P67.O as missing WARNING: atoms too close: (T0378)L66.C and (T0378)P67.C only 0.000 apart, marking (T0378)P67.C as missing WARNING: atoms too close: (T0378)E65.C and (T0378)P67.C only 0.000 apart, marking (T0378)P67.C as missing WARNING: atoms too close: (T0378)V64.C and (T0378)P67.C only 0.000 apart, marking (T0378)P67.C as missing WARNING: atoms too close: (T0378)P67.N and (T0378)E68.N only 0.000 apart, marking (T0378)P67.N as missing WARNING: atoms too close: (T0378)L66.N and (T0378)E68.N only 0.000 apart, marking (T0378)L66.N as missing WARNING: atoms too close: (T0378)E65.N and (T0378)E68.N only 0.000 apart, marking (T0378)E65.N as missing WARNING: atoms too close: (T0378)V64.N and (T0378)E68.N only 0.000 apart, marking (T0378)E68.N as missing WARNING: atoms too close: (T0378)P67.CA and (T0378)E68.CA only 0.000 apart, marking (T0378)E68.CA as missing WARNING: atoms too close: (T0378)L66.CA and (T0378)E68.CA only 0.000 apart, marking (T0378)E68.CA as missing WARNING: atoms too close: (T0378)E65.CA and (T0378)E68.CA only 0.000 apart, marking (T0378)E68.CA as missing WARNING: atoms too close: (T0378)V64.CA and (T0378)E68.CA only 0.000 apart, marking (T0378)E68.CA as missing WARNING: atoms too close: (T0378)P67.CB and (T0378)E68.CB only 0.000 apart, marking (T0378)E68.CB as missing WARNING: atoms too close: (T0378)L66.CB and (T0378)E68.CB only 0.000 apart, marking (T0378)E68.CB as missing WARNING: atoms too close: (T0378)E65.CB and (T0378)E68.CB only 0.000 apart, marking (T0378)E68.CB as missing WARNING: atoms too close: (T0378)V64.CB and (T0378)E68.CB only 0.000 apart, marking (T0378)E68.CB as missing WARNING: atoms too close: (T0378)L66.CG and (T0378)E68.CG only 0.000 apart, marking (T0378)E68.CG as missing WARNING: atoms too close: (T0378)E65.CG and (T0378)E68.CG only 0.000 apart, marking (T0378)E68.CG as missing WARNING: atoms too close: (T0378)V64.CG1 and (T0378)E68.CG only 0.000 apart, marking (T0378)E68.CG as missing WARNING: atoms too close: (T0378)L66.CD1 and (T0378)E68.CD only 0.000 apart, marking (T0378)E68.CD as missing WARNING: atoms too close: (T0378)E65.CD and (T0378)E68.CD only 0.000 apart, marking (T0378)E68.CD as missing WARNING: atoms too close: (T0378)P67.O and (T0378)E68.O only 0.000 apart, marking (T0378)E68.O as missing WARNING: atoms too close: (T0378)L66.O and (T0378)E68.O only 0.000 apart, marking (T0378)E68.O as missing WARNING: atoms too close: (T0378)E65.O and (T0378)E68.O only 0.000 apart, marking (T0378)E68.O as missing WARNING: atoms too close: (T0378)V64.O and (T0378)E68.O only 0.000 apart, marking (T0378)E68.O as missing WARNING: atoms too close: (T0378)P67.C and (T0378)E68.C only 0.000 apart, marking (T0378)E68.C as missing WARNING: atoms too close: (T0378)L66.C and (T0378)E68.C only 0.000 apart, marking (T0378)E68.C as missing WARNING: atoms too close: (T0378)E65.C and (T0378)E68.C only 0.000 apart, marking (T0378)E68.C as missing WARNING: atoms too close: (T0378)V64.C and (T0378)E68.C only 0.000 apart, marking (T0378)E68.C as missing WARNING: atoms too close: (T0378)E68.N and (T0378)S69.N only 0.000 apart, marking (T0378)E68.N as missing WARNING: atoms too close: (T0378)P67.N and (T0378)S69.N only 0.000 apart, marking (T0378)P67.N as missing WARNING: atoms too close: (T0378)L66.N and (T0378)S69.N only 0.000 apart, marking (T0378)L66.N as missing WARNING: atoms too close: (T0378)E65.N and (T0378)S69.N only 0.000 apart, marking (T0378)E65.N as missing WARNING: atoms too close: (T0378)V64.N and (T0378)S69.N only 0.000 apart, marking (T0378)S69.N as missing WARNING: atoms too close: (T0378)E68.CA and (T0378)S69.CA only 0.000 apart, marking (T0378)S69.CA as missing WARNING: atoms too close: (T0378)P67.CA and (T0378)S69.CA only 0.000 apart, marking (T0378)S69.CA as missing WARNING: atoms too close: (T0378)L66.CA and (T0378)S69.CA only 0.000 apart, marking (T0378)S69.CA as missing WARNING: atoms too close: (T0378)E65.CA and (T0378)S69.CA only 0.000 apart, marking (T0378)S69.CA as missing WARNING: atoms too close: (T0378)V64.CA and (T0378)S69.CA only 0.000 apart, marking (T0378)S69.CA as missing WARNING: atoms too close: (T0378)E68.CB and (T0378)S69.CB only 0.000 apart, marking (T0378)S69.CB as missing WARNING: atoms too close: (T0378)P67.CB and (T0378)S69.CB only 0.000 apart, marking (T0378)S69.CB as missing WARNING: atoms too close: (T0378)L66.CB and (T0378)S69.CB only 0.000 apart, marking (T0378)S69.CB as missing WARNING: atoms too close: (T0378)E65.CB and (T0378)S69.CB only 0.000 apart, marking (T0378)S69.CB as missing WARNING: atoms too close: (T0378)V64.CB and (T0378)S69.CB only 0.000 apart, marking (T0378)S69.CB as missing WARNING: atoms too close: (T0378)E68.O and (T0378)S69.O only 0.000 apart, marking (T0378)S69.O as missing WARNING: atoms too close: (T0378)P67.O and (T0378)S69.O only 0.000 apart, marking (T0378)S69.O as missing WARNING: atoms too close: (T0378)L66.O and (T0378)S69.O only 0.000 apart, marking (T0378)S69.O as missing WARNING: atoms too close: (T0378)E65.O and (T0378)S69.O only 0.000 apart, marking (T0378)S69.O as missing WARNING: atoms too close: (T0378)V64.O and (T0378)S69.O only 0.000 apart, marking (T0378)S69.O as missing WARNING: atoms too close: (T0378)E68.C and (T0378)S69.C only 0.000 apart, marking (T0378)S69.C as missing WARNING: atoms too close: (T0378)P67.C and (T0378)S69.C only 0.000 apart, marking (T0378)S69.C as missing WARNING: atoms too close: (T0378)L66.C and (T0378)S69.C only 0.000 apart, marking (T0378)S69.C as missing WARNING: atoms too close: (T0378)E65.C and (T0378)S69.C only 0.000 apart, marking (T0378)S69.C as missing WARNING: atoms too close: (T0378)V64.C and (T0378)S69.C only 0.000 apart, marking (T0378)S69.C as missing WARNING: atoms too close: (T0378)S69.N and (T0378)F70.N only 0.000 apart, marking (T0378)S69.N as missing WARNING: atoms too close: (T0378)E68.N and (T0378)F70.N only 0.000 apart, marking (T0378)E68.N as missing WARNING: atoms too close: (T0378)P67.N and (T0378)F70.N only 0.000 apart, marking (T0378)P67.N as missing WARNING: atoms too close: (T0378)L66.N and (T0378)F70.N only 0.000 apart, marking (T0378)L66.N as missing WARNING: atoms too close: (T0378)E65.N and (T0378)F70.N only 0.000 apart, marking (T0378)E65.N as missing WARNING: atoms too close: (T0378)V64.N and (T0378)F70.N only 0.000 apart, marking (T0378)F70.N as missing WARNING: atoms too close: (T0378)S69.CA and (T0378)F70.CA only 0.000 apart, marking (T0378)F70.CA as missing WARNING: atoms too close: (T0378)E68.CA and (T0378)F70.CA only 0.000 apart, marking (T0378)F70.CA as missing WARNING: atoms too close: (T0378)P67.CA and (T0378)F70.CA only 0.000 apart, marking (T0378)F70.CA as missing WARNING: atoms too close: (T0378)L66.CA and (T0378)F70.CA only 0.000 apart, marking (T0378)F70.CA as missing WARNING: atoms too close: (T0378)E65.CA and (T0378)F70.CA only 0.000 apart, marking (T0378)F70.CA as missing WARNING: atoms too close: (T0378)V64.CA and (T0378)F70.CA only 0.000 apart, marking (T0378)F70.CA as missing WARNING: atoms too close: (T0378)S69.CB and (T0378)F70.CB only 0.000 apart, marking (T0378)F70.CB as missing WARNING: atoms too close: (T0378)E68.CB and (T0378)F70.CB only 0.000 apart, marking (T0378)F70.CB as missing WARNING: atoms too close: (T0378)P67.CB and (T0378)F70.CB only 0.000 apart, marking (T0378)F70.CB as missing WARNING: atoms too close: (T0378)L66.CB and (T0378)F70.CB only 0.000 apart, marking (T0378)F70.CB as missing WARNING: atoms too close: (T0378)E65.CB and (T0378)F70.CB only 0.000 apart, marking (T0378)F70.CB as missing WARNING: atoms too close: (T0378)V64.CB and (T0378)F70.CB only 0.000 apart, marking (T0378)F70.CB as missing WARNING: atoms too close: (T0378)E68.CG and (T0378)F70.CG only 0.000 apart, marking (T0378)F70.CG as missing WARNING: atoms too close: (T0378)L66.CG and (T0378)F70.CG only 0.000 apart, marking (T0378)F70.CG as missing WARNING: atoms too close: (T0378)E65.CG and (T0378)F70.CG only 0.000 apart, marking (T0378)F70.CG as missing WARNING: atoms too close: (T0378)V64.CG1 and (T0378)F70.CG only 0.000 apart, marking (T0378)F70.CG as missing WARNING: atoms too close: (T0378)S69.O and (T0378)F70.O only 0.000 apart, marking (T0378)F70.O as missing WARNING: atoms too close: (T0378)E68.O and (T0378)F70.O only 0.000 apart, marking (T0378)F70.O as missing WARNING: atoms too close: (T0378)P67.O and (T0378)F70.O only 0.000 apart, marking (T0378)F70.O as missing WARNING: atoms too close: (T0378)L66.O and (T0378)F70.O only 0.000 apart, marking (T0378)F70.O as missing WARNING: atoms too close: (T0378)E65.O and (T0378)F70.O only 0.000 apart, marking (T0378)F70.O as missing WARNING: atoms too close: (T0378)V64.O and (T0378)F70.O only 0.000 apart, marking (T0378)F70.O as missing WARNING: atoms too close: (T0378)S69.C and (T0378)F70.C only 0.000 apart, marking (T0378)F70.C as missing WARNING: atoms too close: (T0378)E68.C and (T0378)F70.C only 0.000 apart, marking (T0378)F70.C as missing WARNING: atoms too close: (T0378)P67.C and (T0378)F70.C only 0.000 apart, marking (T0378)F70.C as missing WARNING: atoms too close: (T0378)L66.C and (T0378)F70.C only 0.000 apart, marking (T0378)F70.C as missing WARNING: atoms too close: (T0378)E65.C and (T0378)F70.C only 0.000 apart, marking (T0378)F70.C as missing WARNING: atoms too close: (T0378)V64.C and (T0378)F70.C only 0.000 apart, marking (T0378)F70.C as missing WARNING: atoms too close: (T0378)F70.N and (T0378)D71.N only 0.000 apart, marking (T0378)F70.N as missing WARNING: atoms too close: (T0378)S69.N and (T0378)D71.N only 0.000 apart, marking (T0378)S69.N as missing WARNING: atoms too close: (T0378)E68.N and (T0378)D71.N only 0.000 apart, marking (T0378)E68.N as missing WARNING: atoms too close: (T0378)P67.N and (T0378)D71.N only 0.000 apart, marking (T0378)P67.N as missing WARNING: atoms too close: (T0378)L66.N and (T0378)D71.N only 0.000 apart, marking (T0378)L66.N as missing WARNING: atoms too close: (T0378)E65.N and (T0378)D71.N only 0.000 apart, marking (T0378)E65.N as missing WARNING: atoms too close: (T0378)V64.N and (T0378)D71.N only 0.000 apart, marking (T0378)D71.N as missing WARNING: atoms too close: (T0378)F70.CA and (T0378)D71.CA only 0.000 apart, marking (T0378)D71.CA as missing WARNING: atoms too close: (T0378)S69.CA and (T0378)D71.CA only 0.000 apart, marking (T0378)D71.CA as missing WARNING: atoms too close: (T0378)E68.CA and (T0378)D71.CA only 0.000 apart, marking (T0378)D71.CA as missing WARNING: atoms too close: (T0378)P67.CA and (T0378)D71.CA only 0.000 apart, marking (T0378)D71.CA as missing WARNING: atoms too close: (T0378)L66.CA and (T0378)D71.CA only 0.000 apart, marking (T0378)D71.CA as missing WARNING: atoms too close: (T0378)E65.CA and (T0378)D71.CA only 0.000 apart, marking (T0378)D71.CA as missing WARNING: atoms too close: (T0378)V64.CA and (T0378)D71.CA only 0.000 apart, marking (T0378)D71.CA as missing WARNING: atoms too close: (T0378)F70.CB and (T0378)D71.CB only 0.000 apart, marking (T0378)D71.CB as missing WARNING: atoms too close: (T0378)S69.CB and (T0378)D71.CB only 0.000 apart, marking (T0378)D71.CB as missing WARNING: atoms too close: (T0378)E68.CB and (T0378)D71.CB only 0.000 apart, marking (T0378)D71.CB as missing WARNING: atoms too close: (T0378)P67.CB and (T0378)D71.CB only 0.000 apart, marking (T0378)D71.CB as missing WARNING: atoms too close: (T0378)L66.CB and (T0378)D71.CB only 0.000 apart, marking (T0378)D71.CB as missing WARNING: atoms too close: (T0378)E65.CB and (T0378)D71.CB only 0.000 apart, marking (T0378)D71.CB as missing WARNING: atoms too close: (T0378)V64.CB and (T0378)D71.CB only 0.000 apart, marking (T0378)D71.CB as missing WARNING: atoms too close: (T0378)F70.CG and (T0378)D71.CG only 0.000 apart, marking (T0378)D71.CG as missing WARNING: atoms too close: (T0378)E68.CG and (T0378)D71.CG only 0.000 apart, marking (T0378)D71.CG as missing WARNING: atoms too close: (T0378)L66.CG and (T0378)D71.CG only 0.000 apart, marking (T0378)D71.CG as missing WARNING: atoms too close: (T0378)E65.CG and (T0378)D71.CG only 0.000 apart, marking (T0378)D71.CG as missing WARNING: atoms too close: (T0378)V64.CG1 and (T0378)D71.CG only 0.000 apart, marking (T0378)D71.CG as missing WARNING: atoms too close: (T0378)F70.O and (T0378)D71.O only 0.000 apart, marking (T0378)D71.O as missing WARNING: atoms too close: (T0378)S69.O and (T0378)D71.O only 0.000 apart, marking (T0378)D71.O as missing WARNING: atoms too close: (T0378)E68.O and (T0378)D71.O only 0.000 apart, marking (T0378)D71.O as missing WARNING: atoms too close: (T0378)P67.O and (T0378)D71.O only 0.000 apart, marking (T0378)D71.O as missing WARNING: atoms too close: (T0378)L66.O and (T0378)D71.O only 0.000 apart, marking (T0378)D71.O as missing WARNING: atoms too close: (T0378)E65.O and (T0378)D71.O only 0.000 apart, marking (T0378)D71.O as missing WARNING: atoms too close: (T0378)V64.O and (T0378)D71.O only 0.000 apart, marking (T0378)D71.O as missing WARNING: atoms too close: (T0378)F70.C and (T0378)D71.C only 0.000 apart, marking (T0378)D71.C as missing WARNING: atoms too close: (T0378)S69.C and (T0378)D71.C only 0.000 apart, marking (T0378)D71.C as missing WARNING: atoms too close: (T0378)E68.C and (T0378)D71.C only 0.000 apart, marking (T0378)D71.C as missing WARNING: atoms too close: (T0378)P67.C and (T0378)D71.C only 0.000 apart, marking (T0378)D71.C as missing WARNING: atoms too close: (T0378)L66.C and (T0378)D71.C only 0.000 apart, marking (T0378)D71.C as missing WARNING: atoms too close: (T0378)E65.C and (T0378)D71.C only 0.000 apart, marking (T0378)D71.C as missing WARNING: atoms too close: (T0378)V64.C and (T0378)D71.C only 0.000 apart, marking (T0378)D71.C as missing WARNING: atoms too close: (T0378)D71.N and (T0378)L181.N only 0.000 apart, marking (T0378)D71.N as missing WARNING: atoms too close: (T0378)F70.N and (T0378)L181.N only 0.000 apart, marking (T0378)F70.N as missing WARNING: atoms too close: (T0378)S69.N and (T0378)L181.N only 0.000 apart, marking (T0378)S69.N as missing WARNING: atoms too close: (T0378)E68.N and (T0378)L181.N only 0.000 apart, marking (T0378)E68.N as missing WARNING: atoms too close: (T0378)P67.N and (T0378)L181.N only 0.000 apart, marking (T0378)P67.N as missing WARNING: atoms too close: (T0378)L66.N and (T0378)L181.N only 0.000 apart, marking (T0378)L66.N as missing WARNING: atoms too close: (T0378)E65.N and (T0378)L181.N only 0.000 apart, marking (T0378)E65.N as missing WARNING: atoms too close: (T0378)V64.N and (T0378)L181.N only 0.000 apart, marking (T0378)L181.N as missing WARNING: atoms too close: (T0378)D71.CA and (T0378)L181.CA only 0.000 apart, marking (T0378)L181.CA as missing WARNING: atoms too close: (T0378)F70.CA and (T0378)L181.CA only 0.000 apart, marking (T0378)L181.CA as missing WARNING: atoms too close: (T0378)S69.CA and (T0378)L181.CA only 0.000 apart, marking (T0378)L181.CA as missing WARNING: atoms too close: (T0378)E68.CA and (T0378)L181.CA only 0.000 apart, marking (T0378)L181.CA as missing WARNING: atoms too close: (T0378)P67.CA and (T0378)L181.CA only 0.000 apart, marking (T0378)L181.CA as missing WARNING: atoms too close: (T0378)L66.CA and (T0378)L181.CA only 0.000 apart, marking (T0378)L181.CA as missing WARNING: atoms too close: (T0378)E65.CA and (T0378)L181.CA only 0.000 apart, marking (T0378)L181.CA as missing WARNING: atoms too close: (T0378)V64.CA and (T0378)L181.CA only 0.000 apart, marking (T0378)L181.CA as missing WARNING: atoms too close: (T0378)D71.CB and (T0378)L181.CB only 0.000 apart, marking (T0378)L181.CB as missing WARNING: atoms too close: (T0378)F70.CB and (T0378)L181.CB only 0.000 apart, marking (T0378)L181.CB as missing WARNING: atoms too close: (T0378)S69.CB and (T0378)L181.CB only 0.000 apart, marking (T0378)L181.CB as missing WARNING: atoms too close: (T0378)E68.CB and (T0378)L181.CB only 0.000 apart, marking (T0378)L181.CB as missing WARNING: atoms too close: (T0378)P67.CB and (T0378)L181.CB only 0.000 apart, marking (T0378)L181.CB as missing WARNING: atoms too close: (T0378)L66.CB and (T0378)L181.CB only 0.000 apart, marking (T0378)L181.CB as missing WARNING: atoms too close: (T0378)E65.CB and (T0378)L181.CB only 0.000 apart, marking (T0378)L181.CB as missing WARNING: atoms too close: (T0378)V64.CB and (T0378)L181.CB only 0.000 apart, marking (T0378)L181.CB as missing WARNING: atoms too close: (T0378)D71.CG and (T0378)L181.CG only 0.000 apart, marking (T0378)L181.CG as missing WARNING: atoms too close: (T0378)F70.CG and (T0378)L181.CG only 0.000 apart, marking (T0378)L181.CG as missing WARNING: atoms too close: (T0378)E68.CG and (T0378)L181.CG only 0.000 apart, marking (T0378)L181.CG as missing WARNING: atoms too close: (T0378)L66.CG and (T0378)L181.CG only 0.000 apart, marking (T0378)L181.CG as missing WARNING: atoms too close: (T0378)E65.CG and (T0378)L181.CG only 0.000 apart, marking (T0378)L181.CG as missing WARNING: atoms too close: (T0378)V64.CG1 and (T0378)L181.CG only 0.000 apart, marking (T0378)L181.CG as missing WARNING: atoms too close: (T0378)E68.CD and (T0378)L181.CD1 only 0.000 apart, marking (T0378)L181.CD1 as missing WARNING: atoms too close: (T0378)L66.CD1 and (T0378)L181.CD1 only 0.000 apart, marking (T0378)L181.CD1 as missing WARNING: atoms too close: (T0378)E65.CD and (T0378)L181.CD1 only 0.000 apart, marking (T0378)L181.CD1 as missing WARNING: atoms too close: (T0378)L66.CD2 and (T0378)L181.CD2 only 0.000 apart, marking (T0378)L181.CD2 as missing WARNING: atoms too close: (T0378)D71.O and (T0378)L181.O only 0.000 apart, marking (T0378)L181.O as missing WARNING: atoms too close: (T0378)F70.O and (T0378)L181.O only 0.000 apart, marking (T0378)L181.O as missing WARNING: atoms too close: (T0378)S69.O and (T0378)L181.O only 0.000 apart, marking (T0378)L181.O as missing WARNING: atoms too close: (T0378)E68.O and (T0378)L181.O only 0.000 apart, marking (T0378)L181.O as missing WARNING: atoms too close: (T0378)P67.O and (T0378)L181.O only 0.000 apart, marking (T0378)L181.O as missing WARNING: atoms too close: (T0378)L66.O and (T0378)L181.O only 0.000 apart, marking (T0378)L181.O as missing WARNING: atoms too close: (T0378)E65.O and (T0378)L181.O only 0.000 apart, marking (T0378)L181.O as missing WARNING: atoms too close: (T0378)V64.O and (T0378)L181.O only 0.000 apart, marking (T0378)L181.O as missing WARNING: atoms too close: (T0378)D71.C and (T0378)L181.C only 0.000 apart, marking (T0378)L181.C as missing WARNING: atoms too close: (T0378)F70.C and (T0378)L181.C only 0.000 apart, marking (T0378)L181.C as missing WARNING: atoms too close: (T0378)S69.C and (T0378)L181.C only 0.000 apart, marking (T0378)L181.C as missing WARNING: atoms too close: (T0378)E68.C and (T0378)L181.C only 0.000 apart, marking (T0378)L181.C as missing WARNING: atoms too close: (T0378)P67.C and (T0378)L181.C only 0.000 apart, marking (T0378)L181.C as missing WARNING: atoms too close: (T0378)L66.C and (T0378)L181.C only 0.000 apart, marking (T0378)L181.C as missing WARNING: atoms too close: (T0378)E65.C and (T0378)L181.C only 0.000 apart, marking (T0378)L181.C as missing WARNING: atoms too close: (T0378)V64.C and (T0378)L181.C only 0.000 apart, marking (T0378)L181.C as missing WARNING: atoms too close: (T0378)L181.N and (T0378)D182.N only 0.000 apart, marking (T0378)L181.N as missing WARNING: atoms too close: (T0378)D71.N and (T0378)D182.N only 0.000 apart, marking (T0378)D71.N as missing WARNING: atoms too close: (T0378)F70.N and (T0378)D182.N only 0.000 apart, marking (T0378)F70.N as missing WARNING: atoms too close: (T0378)S69.N and (T0378)D182.N only 0.000 apart, marking (T0378)S69.N as missing WARNING: atoms too close: (T0378)E68.N and (T0378)D182.N only 0.000 apart, marking (T0378)E68.N as missing WARNING: atoms too close: (T0378)P67.N and (T0378)D182.N only 0.000 apart, marking (T0378)P67.N as missing WARNING: atoms too close: (T0378)L66.N and (T0378)D182.N only 0.000 apart, marking (T0378)L66.N as missing WARNING: atoms too close: (T0378)E65.N and (T0378)D182.N only 0.000 apart, marking (T0378)E65.N as missing WARNING: atoms too close: (T0378)V64.N and (T0378)D182.N only 0.000 apart, marking (T0378)D182.N as missing WARNING: atoms too close: (T0378)L181.CA and (T0378)D182.CA only 0.000 apart, marking (T0378)D182.CA as missing WARNING: atoms too close: (T0378)D71.CA and (T0378)D182.CA only 0.000 apart, marking (T0378)D182.CA as missing WARNING: atoms too close: (T0378)F70.CA and (T0378)D182.CA only 0.000 apart, marking (T0378)D182.CA as missing WARNING: atoms too close: (T0378)S69.CA and (T0378)D182.CA only 0.000 apart, marking (T0378)D182.CA as missing WARNING: atoms too close: (T0378)E68.CA and (T0378)D182.CA only 0.000 apart, marking (T0378)D182.CA as missing WARNING: atoms too close: (T0378)P67.CA and (T0378)D182.CA only 0.000 apart, marking (T0378)D182.CA as missing WARNING: atoms too close: (T0378)L66.CA and (T0378)D182.CA only 0.000 apart, marking (T0378)D182.CA as missing WARNING: atoms too close: (T0378)E65.CA and (T0378)D182.CA only 0.000 apart, marking (T0378)D182.CA as missing WARNING: atoms too close: (T0378)V64.CA and (T0378)D182.CA only 0.000 apart, marking (T0378)D182.CA as missing WARNING: atoms too close: (T0378)L181.CB and (T0378)D182.CB only 0.000 apart, marking (T0378)D182.CB as missing WARNING: atoms too close: (T0378)D71.CB and (T0378)D182.CB only 0.000 apart, marking (T0378)D182.CB as missing WARNING: atoms too close: (T0378)F70.CB and (T0378)D182.CB only 0.000 apart, marking (T0378)D182.CB as missing WARNING: atoms too close: (T0378)S69.CB and (T0378)D182.CB only 0.000 apart, marking (T0378)D182.CB as missing WARNING: atoms too close: (T0378)E68.CB and (T0378)D182.CB only 0.000 apart, marking (T0378)D182.CB as missing WARNING: atoms too close: (T0378)P67.CB and (T0378)D182.CB only 0.000 apart, marking (T0378)D182.CB as missing WARNING: atoms too close: (T0378)L66.CB and (T0378)D182.CB only 0.000 apart, marking (T0378)D182.CB as missing WARNING: atoms too close: (T0378)E65.CB and (T0378)D182.CB only 0.000 apart, marking (T0378)D182.CB as missing WARNING: atoms too close: (T0378)V64.CB and (T0378)D182.CB only 0.000 apart, marking (T0378)D182.CB as missing WARNING: atoms too close: (T0378)L181.CG and (T0378)D182.CG only 0.000 apart, marking (T0378)D182.CG as missing WARNING: atoms too close: (T0378)D71.CG and (T0378)D182.CG only 0.000 apart, marking (T0378)D182.CG as missing WARNING: atoms too close: (T0378)F70.CG and (T0378)D182.CG only 0.000 apart, marking (T0378)D182.CG as missing WARNING: atoms too close: (T0378)E68.CG and (T0378)D182.CG only 0.000 apart, marking (T0378)D182.CG as missing WARNING: atoms too close: (T0378)L66.CG and (T0378)D182.CG only 0.000 apart, marking (T0378)D182.CG as missing WARNING: atoms too close: (T0378)E65.CG and (T0378)D182.CG only 0.000 apart, marking (T0378)D182.CG as missing WARNING: atoms too close: (T0378)V64.CG1 and (T0378)D182.CG only 0.000 apart, marking (T0378)D182.CG as missing WARNING: atoms too close: (T0378)L181.O and (T0378)D182.O only 0.000 apart, marking (T0378)D182.O as missing WARNING: atoms too close: (T0378)D71.O and (T0378)D182.O only 0.000 apart, marking (T0378)D182.O as missing WARNING: atoms too close: (T0378)F70.O and (T0378)D182.O only 0.000 apart, marking (T0378)D182.O as missing WARNING: atoms too close: (T0378)S69.O and (T0378)D182.O only 0.000 apart, marking (T0378)D182.O as missing WARNING: atoms too close: (T0378)E68.O and (T0378)D182.O only 0.000 apart, marking (T0378)D182.O as missing WARNING: atoms too close: (T0378)P67.O and (T0378)D182.O only 0.000 apart, marking (T0378)D182.O as missing WARNING: atoms too close: (T0378)L66.O and (T0378)D182.O only 0.000 apart, marking (T0378)D182.O as missing WARNING: atoms too close: (T0378)E65.O and (T0378)D182.O only 0.000 apart, marking (T0378)D182.O as missing WARNING: atoms too close: (T0378)V64.O and (T0378)D182.O only 0.000 apart, marking (T0378)D182.O as missing WARNING: atoms too close: (T0378)L181.C and (T0378)D182.C only 0.000 apart, marking (T0378)D182.C as missing WARNING: atoms too close: (T0378)D71.C and (T0378)D182.C only 0.000 apart, marking (T0378)D182.C as missing WARNING: atoms too close: (T0378)F70.C and (T0378)D182.C only 0.000 apart, marking (T0378)D182.C as missing WARNING: atoms too close: (T0378)S69.C and (T0378)D182.C only 0.000 apart, marking (T0378)D182.C as missing WARNING: atoms too close: (T0378)E68.C and (T0378)D182.C only 0.000 apart, marking (T0378)D182.C as missing WARNING: atoms too close: (T0378)P67.C and (T0378)D182.C only 0.000 apart, marking (T0378)D182.C as missing WARNING: atoms too close: (T0378)L66.C and (T0378)D182.C only 0.000 apart, marking (T0378)D182.C as missing WARNING: atoms too close: (T0378)E65.C and (T0378)D182.C only 0.000 apart, marking (T0378)D182.C as missing WARNING: atoms too close: (T0378)V64.C and (T0378)D182.C only 0.000 apart, marking (T0378)D182.C as missing WARNING: atoms too close: (T0378)D182.N and (T0378)G227.N only 0.000 apart, marking (T0378)D182.N as missing WARNING: atoms too close: (T0378)L181.N and (T0378)G227.N only 0.000 apart, marking (T0378)L181.N as missing WARNING: atoms too close: (T0378)D71.N and (T0378)G227.N only 0.000 apart, marking (T0378)D71.N as missing WARNING: atoms too close: (T0378)F70.N and (T0378)G227.N only 0.000 apart, marking (T0378)F70.N as missing WARNING: atoms too close: (T0378)S69.N and (T0378)G227.N only 0.000 apart, marking (T0378)S69.N as missing WARNING: atoms too close: (T0378)E68.N and (T0378)G227.N only 0.000 apart, marking (T0378)E68.N as missing WARNING: atoms too close: (T0378)P67.N and (T0378)G227.N only 0.000 apart, marking (T0378)P67.N as missing WARNING: atoms too close: (T0378)L66.N and (T0378)G227.N only 0.000 apart, marking (T0378)L66.N as missing WARNING: atoms too close: (T0378)E65.N and (T0378)G227.N only 0.000 apart, marking (T0378)E65.N as missing WARNING: atoms too close: (T0378)V64.N and (T0378)G227.N only 0.000 apart, marking (T0378)G227.N as missing WARNING: atoms too close: (T0378)D182.CA and (T0378)G227.CA only 0.000 apart, marking (T0378)G227.CA as missing WARNING: atoms too close: (T0378)L181.CA and (T0378)G227.CA only 0.000 apart, marking (T0378)G227.CA as missing WARNING: atoms too close: (T0378)D71.CA and (T0378)G227.CA only 0.000 apart, marking (T0378)G227.CA as missing WARNING: atoms too close: (T0378)F70.CA and (T0378)G227.CA only 0.000 apart, marking (T0378)G227.CA as missing WARNING: atoms too close: (T0378)S69.CA and (T0378)G227.CA only 0.000 apart, marking (T0378)G227.CA as missing WARNING: atoms too close: (T0378)E68.CA and (T0378)G227.CA only 0.000 apart, marking (T0378)G227.CA as missing WARNING: atoms too close: (T0378)P67.CA and (T0378)G227.CA only 0.000 apart, marking (T0378)G227.CA as missing WARNING: atoms too close: (T0378)L66.CA and (T0378)G227.CA only 0.000 apart, marking (T0378)G227.CA as missing WARNING: atoms too close: (T0378)E65.CA and (T0378)G227.CA only 0.000 apart, marking (T0378)G227.CA as missing WARNING: atoms too close: (T0378)V64.CA and (T0378)G227.CA only 0.000 apart, marking (T0378)G227.CA as missing WARNING: atoms too close: (T0378)D182.O and (T0378)G227.O only 0.000 apart, marking (T0378)G227.O as missing WARNING: atoms too close: (T0378)L181.O and (T0378)G227.O only 0.000 apart, marking (T0378)G227.O as missing WARNING: atoms too close: (T0378)D71.O and (T0378)G227.O only 0.000 apart, marking (T0378)G227.O as missing WARNING: atoms too close: (T0378)F70.O and (T0378)G227.O only 0.000 apart, marking (T0378)G227.O as missing WARNING: atoms too close: (T0378)S69.O and (T0378)G227.O only 0.000 apart, marking (T0378)G227.O as missing WARNING: atoms too close: (T0378)E68.O and (T0378)G227.O only 0.000 apart, marking (T0378)G227.O as missing WARNING: atoms too close: (T0378)P67.O and (T0378)G227.O only 0.000 apart, marking (T0378)G227.O as missing WARNING: atoms too close: (T0378)L66.O and (T0378)G227.O only 0.000 apart, marking (T0378)G227.O as missing WARNING: atoms too close: (T0378)E65.O and (T0378)G227.O only 0.000 apart, marking (T0378)G227.O as missing WARNING: atoms too close: (T0378)V64.O and (T0378)G227.O only 0.000 apart, marking (T0378)G227.O as missing WARNING: atoms too close: (T0378)D182.C and (T0378)G227.C only 0.000 apart, marking (T0378)G227.C as missing WARNING: atoms too close: (T0378)L181.C and (T0378)G227.C only 0.000 apart, marking (T0378)G227.C as missing WARNING: atoms too close: (T0378)D71.C and (T0378)G227.C only 0.000 apart, marking (T0378)G227.C as missing WARNING: atoms too close: (T0378)F70.C and (T0378)G227.C only 0.000 apart, marking (T0378)G227.C as missing WARNING: atoms too close: (T0378)S69.C and (T0378)G227.C only 0.000 apart, marking (T0378)G227.C as missing WARNING: atoms too close: (T0378)E68.C and (T0378)G227.C only 0.000 apart, marking (T0378)G227.C as missing WARNING: atoms too close: (T0378)P67.C and (T0378)G227.C only 0.000 apart, marking (T0378)G227.C as missing WARNING: atoms too close: (T0378)L66.C and (T0378)G227.C only 0.000 apart, marking (T0378)G227.C as missing WARNING: atoms too close: (T0378)E65.C and (T0378)G227.C only 0.000 apart, marking (T0378)G227.C as missing WARNING: atoms too close: (T0378)V64.C and (T0378)G227.C only 0.000 apart, marking (T0378)G227.C as missing WARNING: atoms too close: (T0378)G227.N and (T0378)L228.N only 0.000 apart, marking (T0378)G227.N as missing WARNING: atoms too close: (T0378)D182.N and (T0378)L228.N only 0.000 apart, marking (T0378)D182.N as missing WARNING: atoms too close: (T0378)L181.N and (T0378)L228.N only 0.000 apart, marking (T0378)L181.N as missing WARNING: atoms too close: (T0378)D71.N and (T0378)L228.N only 0.000 apart, marking (T0378)D71.N as missing WARNING: atoms too close: (T0378)F70.N and (T0378)L228.N only 0.000 apart, marking (T0378)F70.N as missing WARNING: atoms too close: (T0378)S69.N and (T0378)L228.N only 0.000 apart, marking (T0378)S69.N as missing WARNING: atoms too close: (T0378)E68.N and (T0378)L228.N only 0.000 apart, marking (T0378)E68.N as missing WARNING: atoms too close: (T0378)P67.N and (T0378)L228.N only 0.000 apart, marking (T0378)P67.N as missing WARNING: atoms too close: (T0378)L66.N and (T0378)L228.N only 0.000 apart, marking (T0378)L66.N as missing WARNING: atoms too close: (T0378)E65.N and (T0378)L228.N only 0.000 apart, marking (T0378)E65.N as missing WARNING: atoms too close: (T0378)V64.N and (T0378)L228.N only 0.000 apart, marking (T0378)L228.N as missing WARNING: atoms too close: (T0378)G227.CA and (T0378)L228.CA only 0.000 apart, marking (T0378)L228.CA as missing WARNING: atoms too close: (T0378)D182.CA and (T0378)L228.CA only 0.000 apart, marking (T0378)L228.CA as missing WARNING: atoms too close: (T0378)L181.CA and (T0378)L228.CA only 0.000 apart, marking (T0378)L228.CA as missing WARNING: atoms too close: (T0378)D71.CA and (T0378)L228.CA only 0.000 apart, marking (T0378)L228.CA as missing WARNING: atoms too close: (T0378)F70.CA and (T0378)L228.CA only 0.000 apart, marking (T0378)L228.CA as missing WARNING: atoms too close: (T0378)S69.CA and (T0378)L228.CA only 0.000 apart, marking (T0378)L228.CA as missing WARNING: atoms too close: (T0378)E68.CA and (T0378)L228.CA only 0.000 apart, marking (T0378)L228.CA as missing WARNING: atoms too close: (T0378)P67.CA and (T0378)L228.CA only 0.000 apart, marking (T0378)L228.CA as missing WARNING: atoms too close: (T0378)L66.CA and (T0378)L228.CA only 0.000 apart, marking (T0378)L228.CA as missing WARNING: atoms too close: (T0378)E65.CA and (T0378)L228.CA only 0.000 apart, marking (T0378)L228.CA as missing WARNING: atoms too close: (T0378)V64.CA and (T0378)L228.CA only 0.000 apart, marking (T0378)L228.CA as missing WARNING: atoms too close: (T0378)D182.CB and (T0378)L228.CB only 0.000 apart, marking (T0378)L228.CB as missing WARNING: atoms too close: (T0378)L181.CB and (T0378)L228.CB only 0.000 apart, marking (T0378)L228.CB as missing WARNING: atoms too close: (T0378)D71.CB and (T0378)L228.CB only 0.000 apart, marking (T0378)L228.CB as missing WARNING: atoms too close: (T0378)F70.CB and (T0378)L228.CB only 0.000 apart, marking (T0378)L228.CB as missing WARNING: atoms too close: (T0378)S69.CB and (T0378)L228.CB only 0.000 apart, marking (T0378)L228.CB as missing WARNING: atoms too close: (T0378)E68.CB and (T0378)L228.CB only 0.000 apart, marking (T0378)L228.CB as missing WARNING: atoms too close: (T0378)P67.CB and (T0378)L228.CB only 0.000 apart, marking (T0378)L228.CB as missing WARNING: atoms too close: (T0378)L66.CB and (T0378)L228.CB only 0.000 apart, marking (T0378)L228.CB as missing WARNING: atoms too close: (T0378)E65.CB and (T0378)L228.CB only 0.000 apart, marking (T0378)L228.CB as missing WARNING: atoms too close: (T0378)V64.CB and (T0378)L228.CB only 0.000 apart, marking (T0378)L228.CB as missing WARNING: atoms too close: (T0378)D182.CG and (T0378)L228.CG only 0.000 apart, marking (T0378)L228.CG as missing WARNING: atoms too close: (T0378)L181.CG and (T0378)L228.CG only 0.000 apart, marking (T0378)L228.CG as missing WARNING: atoms too close: (T0378)D71.CG and (T0378)L228.CG only 0.000 apart, marking (T0378)L228.CG as missing WARNING: atoms too close: (T0378)F70.CG and (T0378)L228.CG only 0.000 apart, marking (T0378)L228.CG as missing WARNING: atoms too close: (T0378)E68.CG and (T0378)L228.CG only 0.000 apart, marking (T0378)L228.CG as missing WARNING: atoms too close: (T0378)L66.CG and (T0378)L228.CG only 0.000 apart, marking (T0378)L228.CG as missing WARNING: atoms too close: (T0378)E65.CG and (T0378)L228.CG only 0.000 apart, marking (T0378)L228.CG as missing WARNING: atoms too close: (T0378)V64.CG1 and (T0378)L228.CG only 0.000 apart, marking (T0378)L228.CG as missing WARNING: atoms too close: (T0378)L181.CD1 and (T0378)L228.CD1 only 0.000 apart, marking (T0378)L228.CD1 as missing WARNING: atoms too close: (T0378)E68.CD and (T0378)L228.CD1 only 0.000 apart, marking (T0378)L228.CD1 as missing WARNING: atoms too close: (T0378)L66.CD1 and (T0378)L228.CD1 only 0.000 apart, marking (T0378)L228.CD1 as missing WARNING: atoms too close: (T0378)E65.CD and (T0378)L228.CD1 only 0.000 apart, marking (T0378)L228.CD1 as missing WARNING: atoms too close: (T0378)L181.CD2 and (T0378)L228.CD2 only 0.000 apart, marking (T0378)L228.CD2 as missing WARNING: atoms too close: (T0378)L66.CD2 and (T0378)L228.CD2 only 0.000 apart, marking (T0378)L228.CD2 as missing WARNING: atoms too close: (T0378)G227.O and (T0378)L228.O only 0.000 apart, marking (T0378)L228.O as missing WARNING: atoms too close: (T0378)D182.O and (T0378)L228.O only 0.000 apart, marking (T0378)L228.O as missing WARNING: atoms too close: (T0378)L181.O and (T0378)L228.O only 0.000 apart, marking (T0378)L228.O as missing WARNING: atoms too close: (T0378)D71.O and (T0378)L228.O only 0.000 apart, marking (T0378)L228.O as missing WARNING: atoms too close: (T0378)F70.O and (T0378)L228.O only 0.000 apart, marking (T0378)L228.O as missing WARNING: atoms too close: (T0378)S69.O and (T0378)L228.O only 0.000 apart, marking (T0378)L228.O as missing WARNING: atoms too close: (T0378)E68.O and (T0378)L228.O only 0.000 apart, marking (T0378)L228.O as missing WARNING: atoms too close: (T0378)P67.O and (T0378)L228.O only 0.000 apart, marking (T0378)L228.O as missing WARNING: atoms too close: (T0378)L66.O and (T0378)L228.O only 0.000 apart, marking (T0378)L228.O as missing WARNING: atoms too close: (T0378)E65.O and (T0378)L228.O only 0.000 apart, marking (T0378)L228.O as missing WARNING: atoms too close: (T0378)V64.O and (T0378)L228.O only 0.000 apart, marking (T0378)L228.O as missing WARNING: atoms too close: (T0378)G227.C and (T0378)L228.C only 0.000 apart, marking (T0378)L228.C as missing WARNING: atoms too close: (T0378)D182.C and (T0378)L228.C only 0.000 apart, marking (T0378)L228.C as missing WARNING: atoms too close: (T0378)L181.C and (T0378)L228.C only 0.000 apart, marking (T0378)L228.C as missing WARNING: atoms too close: (T0378)D71.C and (T0378)L228.C only 0.000 apart, marking (T0378)L228.C as missing WARNING: atoms too close: (T0378)F70.C and (T0378)L228.C only 0.000 apart, marking (T0378)L228.C as missing WARNING: atoms too close: (T0378)S69.C and (T0378)L228.C only 0.000 apart, marking (T0378)L228.C as missing WARNING: atoms too close: (T0378)E68.C and (T0378)L228.C only 0.000 apart, marking (T0378)L228.C as missing WARNING: atoms too close: (T0378)P67.C and (T0378)L228.C only 0.000 apart, marking (T0378)L228.C as missing WARNING: atoms too close: (T0378)L66.C and (T0378)L228.C only 0.000 apart, marking (T0378)L228.C as missing WARNING: atoms too close: (T0378)E65.C and (T0378)L228.C only 0.000 apart, marking (T0378)L228.C as missing WARNING: atoms too close: (T0378)V64.C and (T0378)L228.C only 0.000 apart, marking (T0378)L228.C as missing WARNING: atoms too close: (T0378)L228.N and (T0378)S229.N only 0.000 apart, marking (T0378)L228.N as missing WARNING: atoms too close: (T0378)G227.N and (T0378)S229.N only 0.000 apart, marking (T0378)G227.N as missing WARNING: atoms too close: (T0378)D182.N and (T0378)S229.N only 0.000 apart, marking (T0378)D182.N as missing WARNING: atoms too close: (T0378)L181.N and (T0378)S229.N only 0.000 apart, marking (T0378)L181.N as missing WARNING: atoms too close: (T0378)D71.N and (T0378)S229.N only 0.000 apart, marking (T0378)D71.N as missing WARNING: atoms too close: (T0378)F70.N and (T0378)S229.N only 0.000 apart, marking (T0378)F70.N as missing WARNING: atoms too close: (T0378)S69.N and (T0378)S229.N only 0.000 apart, marking (T0378)S69.N as missing WARNING: atoms too close: (T0378)E68.N and (T0378)S229.N only 0.000 apart, marking (T0378)E68.N as missing WARNING: atoms too close: (T0378)P67.N and (T0378)S229.N only 0.000 apart, marking (T0378)P67.N as missing WARNING: atoms too close: (T0378)L66.N and (T0378)S229.N only 0.000 apart, marking (T0378)L66.N as missing WARNING: atoms too close: (T0378)E65.N and (T0378)S229.N only 0.000 apart, marking (T0378)E65.N as missing WARNING: atoms too close: (T0378)V64.N and (T0378)S229.N only 0.000 apart, marking (T0378)S229.N as missing WARNING: atoms too close: (T0378)L228.CA and (T0378)S229.CA only 0.000 apart, marking (T0378)S229.CA as missing WARNING: atoms too close: (T0378)G227.CA and (T0378)S229.CA only 0.000 apart, marking (T0378)S229.CA as missing WARNING: atoms too close: (T0378)D182.CA and (T0378)S229.CA only 0.000 apart, marking (T0378)S229.CA as missing WARNING: atoms too close: (T0378)L181.CA and (T0378)S229.CA only 0.000 apart, marking (T0378)S229.CA as missing WARNING: atoms too close: (T0378)D71.CA and (T0378)S229.CA only 0.000 apart, marking (T0378)S229.CA as missing WARNING: atoms too close: (T0378)F70.CA and (T0378)S229.CA only 0.000 apart, marking (T0378)S229.CA as missing WARNING: atoms too close: (T0378)S69.CA and (T0378)S229.CA only 0.000 apart, marking (T0378)S229.CA as missing WARNING: atoms too close: (T0378)E68.CA and (T0378)S229.CA only 0.000 apart, marking (T0378)S229.CA as missing WARNING: atoms too close: (T0378)P67.CA and (T0378)S229.CA only 0.000 apart, marking (T0378)S229.CA as missing WARNING: atoms too close: (T0378)L66.CA and (T0378)S229.CA only 0.000 apart, marking (T0378)S229.CA as missing WARNING: atoms too close: (T0378)E65.CA and (T0378)S229.CA only 0.000 apart, marking (T0378)S229.CA as missing WARNING: atoms too close: (T0378)V64.CA and (T0378)S229.CA only 0.000 apart, marking (T0378)S229.CA as missing WARNING: atoms too close: (T0378)L228.CB and (T0378)S229.CB only 0.000 apart, marking (T0378)S229.CB as missing WARNING: atoms too close: (T0378)D182.CB and (T0378)S229.CB only 0.000 apart, marking (T0378)S229.CB as missing WARNING: atoms too close: (T0378)L181.CB and (T0378)S229.CB only 0.000 apart, marking (T0378)S229.CB as missing WARNING: atoms too close: (T0378)D71.CB and (T0378)S229.CB only 0.000 apart, marking (T0378)S229.CB as missing WARNING: atoms too close: (T0378)F70.CB and (T0378)S229.CB only 0.000 apart, marking (T0378)S229.CB as missing WARNING: atoms too close: (T0378)S69.CB and (T0378)S229.CB only 0.000 apart, marking (T0378)S229.CB as missing WARNING: atoms too close: (T0378)E68.CB and (T0378)S229.CB only 0.000 apart, marking (T0378)S229.CB as missing WARNING: atoms too close: (T0378)P67.CB and (T0378)S229.CB only 0.000 apart, marking (T0378)S229.CB as missing WARNING: atoms too close: (T0378)L66.CB and (T0378)S229.CB only 0.000 apart, marking (T0378)S229.CB as missing WARNING: atoms too close: (T0378)E65.CB and (T0378)S229.CB only 0.000 apart, marking (T0378)S229.CB as missing WARNING: atoms too close: (T0378)V64.CB and (T0378)S229.CB only 0.000 apart, marking (T0378)S229.CB as missing WARNING: atoms too close: (T0378)L228.O and (T0378)S229.O only 0.000 apart, marking (T0378)S229.O as missing WARNING: atoms too close: (T0378)G227.O and (T0378)S229.O only 0.000 apart, marking (T0378)S229.O as missing WARNING: atoms too close: (T0378)D182.O and (T0378)S229.O only 0.000 apart, marking (T0378)S229.O as missing WARNING: atoms too close: (T0378)L181.O and (T0378)S229.O only 0.000 apart, marking (T0378)S229.O as missing WARNING: atoms too close: (T0378)D71.O and (T0378)S229.O only 0.000 apart, marking (T0378)S229.O as missing WARNING: atoms too close: (T0378)F70.O and (T0378)S229.O only 0.000 apart, marking (T0378)S229.O as missing WARNING: atoms too close: (T0378)S69.O and (T0378)S229.O only 0.000 apart, marking (T0378)S229.O as missing WARNING: atoms too close: (T0378)E68.O and (T0378)S229.O only 0.000 apart, marking (T0378)S229.O as missing WARNING: atoms too close: (T0378)P67.O and (T0378)S229.O only 0.000 apart, marking (T0378)S229.O as missing WARNING: atoms too close: (T0378)L66.O and (T0378)S229.O only 0.000 apart, marking (T0378)S229.O as missing WARNING: atoms too close: (T0378)E65.O and (T0378)S229.O only 0.000 apart, marking (T0378)S229.O as missing WARNING: atoms too close: (T0378)V64.O and (T0378)S229.O only 0.000 apart, marking (T0378)S229.O as missing WARNING: atoms too close: (T0378)L228.C and (T0378)S229.C only 0.000 apart, marking (T0378)S229.C as missing WARNING: atoms too close: (T0378)G227.C and (T0378)S229.C only 0.000 apart, marking (T0378)S229.C as missing WARNING: atoms too close: (T0378)D182.C and (T0378)S229.C only 0.000 apart, marking (T0378)S229.C as missing WARNING: atoms too close: (T0378)L181.C and (T0378)S229.C only 0.000 apart, marking (T0378)S229.C as missing WARNING: atoms too close: (T0378)D71.C and (T0378)S229.C only 0.000 apart, marking (T0378)S229.C as missing WARNING: atoms too close: (T0378)F70.C and (T0378)S229.C only 0.000 apart, marking (T0378)S229.C as missing WARNING: atoms too close: (T0378)S69.C and (T0378)S229.C only 0.000 apart, marking (T0378)S229.C as missing WARNING: atoms too close: (T0378)E68.C and (T0378)S229.C only 0.000 apart, marking (T0378)S229.C as missing WARNING: atoms too close: (T0378)P67.C and (T0378)S229.C only 0.000 apart, marking (T0378)S229.C as missing WARNING: atoms too close: (T0378)L66.C and (T0378)S229.C only 0.000 apart, marking (T0378)S229.C as missing WARNING: atoms too close: (T0378)E65.C and (T0378)S229.C only 0.000 apart, marking (T0378)S229.C as missing WARNING: atoms too close: (T0378)V64.C and (T0378)S229.C only 0.000 apart, marking (T0378)S229.C as missing WARNING: atoms too close: (T0378)S229.N and (T0378)V230.N only 0.000 apart, marking (T0378)S229.N as missing WARNING: atoms too close: (T0378)L228.N and (T0378)V230.N only 0.000 apart, marking (T0378)L228.N as missing WARNING: atoms too close: (T0378)G227.N and (T0378)V230.N only 0.000 apart, marking (T0378)G227.N as missing WARNING: atoms too close: (T0378)D182.N and (T0378)V230.N only 0.000 apart, marking (T0378)D182.N as missing WARNING: atoms too close: (T0378)L181.N and (T0378)V230.N only 0.000 apart, marking (T0378)L181.N as missing WARNING: atoms too close: (T0378)D71.N and (T0378)V230.N only 0.000 apart, marking (T0378)D71.N as missing WARNING: atoms too close: (T0378)F70.N and (T0378)V230.N only 0.000 apart, marking (T0378)F70.N as missing WARNING: atoms too close: (T0378)S69.N and (T0378)V230.N only 0.000 apart, marking (T0378)S69.N as missing WARNING: atoms too close: (T0378)E68.N and (T0378)V230.N only 0.000 apart, marking (T0378)E68.N as missing WARNING: atoms too close: (T0378)P67.N and (T0378)V230.N only 0.000 apart, marking (T0378)P67.N as missing WARNING: atoms too close: (T0378)L66.N and (T0378)V230.N only 0.000 apart, marking (T0378)L66.N as missing WARNING: atoms too close: (T0378)E65.N and (T0378)V230.N only 0.000 apart, marking (T0378)E65.N as missing WARNING: atoms too close: (T0378)V64.N and (T0378)V230.N only 0.000 apart, marking (T0378)V230.N as missing WARNING: atoms too close: (T0378)S229.CA and (T0378)V230.CA only 0.000 apart, marking (T0378)V230.CA as missing WARNING: atoms too close: (T0378)L228.CA and (T0378)V230.CA only 0.000 apart, marking (T0378)V230.CA as missing WARNING: atoms too close: (T0378)G227.CA and (T0378)V230.CA only 0.000 apart, marking (T0378)V230.CA as missing WARNING: atoms too close: (T0378)D182.CA and (T0378)V230.CA only 0.000 apart, marking (T0378)V230.CA as missing WARNING: atoms too close: (T0378)L181.CA and (T0378)V230.CA only 0.000 apart, marking (T0378)V230.CA as missing WARNING: atoms too close: (T0378)D71.CA and (T0378)V230.CA only 0.000 apart, marking (T0378)V230.CA as missing WARNING: atoms too close: (T0378)F70.CA and (T0378)V230.CA only 0.000 apart, marking (T0378)V230.CA as missing WARNING: atoms too close: (T0378)S69.CA and (T0378)V230.CA only 0.000 apart, marking (T0378)V230.CA as missing WARNING: atoms too close: (T0378)E68.CA and (T0378)V230.CA only 0.000 apart, marking (T0378)V230.CA as missing WARNING: atoms too close: (T0378)P67.CA and (T0378)V230.CA only 0.000 apart, marking (T0378)V230.CA as missing WARNING: atoms too close: (T0378)L66.CA and (T0378)V230.CA only 0.000 apart, marking (T0378)V230.CA as missing WARNING: atoms too close: (T0378)E65.CA and (T0378)V230.CA only 0.000 apart, marking (T0378)V230.CA as missing WARNING: atoms too close: (T0378)V64.CA and (T0378)V230.CA only 0.000 apart, marking (T0378)V230.CA as missing WARNING: atoms too close: (T0378)S229.CB and (T0378)V230.CB only 0.000 apart, marking (T0378)V230.CB as missing WARNING: atoms too close: (T0378)L228.CB and (T0378)V230.CB only 0.000 apart, marking (T0378)V230.CB as missing WARNING: atoms too close: (T0378)D182.CB and (T0378)V230.CB only 0.000 apart, marking (T0378)V230.CB as missing WARNING: atoms too close: (T0378)L181.CB and (T0378)V230.CB only 0.000 apart, marking (T0378)V230.CB as missing WARNING: atoms too close: (T0378)D71.CB and (T0378)V230.CB only 0.000 apart, marking (T0378)V230.CB as missing WARNING: atoms too close: (T0378)F70.CB and (T0378)V230.CB only 0.000 apart, marking (T0378)V230.CB as missing WARNING: atoms too close: (T0378)S69.CB and (T0378)V230.CB only 0.000 apart, marking (T0378)V230.CB as missing WARNING: atoms too close: (T0378)E68.CB and (T0378)V230.CB only 0.000 apart, marking (T0378)V230.CB as missing WARNING: atoms too close: (T0378)P67.CB and (T0378)V230.CB only 0.000 apart, marking (T0378)V230.CB as missing WARNING: atoms too close: (T0378)L66.CB and (T0378)V230.CB only 0.000 apart, marking (T0378)V230.CB as missing WARNING: atoms too close: (T0378)E65.CB and (T0378)V230.CB only 0.000 apart, marking (T0378)V230.CB as missing WARNING: atoms too close: (T0378)V64.CB and (T0378)V230.CB only 0.000 apart, marking (T0378)V230.CB as missing WARNING: atoms too close: (T0378)L228.CG and (T0378)V230.CG1 only 0.000 apart, marking (T0378)V230.CG1 as missing WARNING: atoms too close: (T0378)D182.CG and (T0378)V230.CG1 only 0.000 apart, marking (T0378)V230.CG1 as missing WARNING: atoms too close: (T0378)L181.CG and (T0378)V230.CG1 only 0.000 apart, marking (T0378)V230.CG1 as missing WARNING: atoms too close: (T0378)D71.CG and (T0378)V230.CG1 only 0.000 apart, marking (T0378)V230.CG1 as missing WARNING: atoms too close: (T0378)F70.CG and (T0378)V230.CG1 only 0.000 apart, marking (T0378)V230.CG1 as missing WARNING: atoms too close: (T0378)E68.CG and (T0378)V230.CG1 only 0.000 apart, marking (T0378)V230.CG1 as missing WARNING: atoms too close: (T0378)L66.CG and (T0378)V230.CG1 only 0.000 apart, marking (T0378)V230.CG1 as missing WARNING: atoms too close: (T0378)E65.CG and (T0378)V230.CG1 only 0.000 apart, marking (T0378)V230.CG1 as missing WARNING: atoms too close: (T0378)V64.CG1 and (T0378)V230.CG1 only 0.000 apart, marking (T0378)V230.CG1 as missing WARNING: atoms too close: (T0378)S229.O and (T0378)V230.O only 0.000 apart, marking (T0378)V230.O as missing WARNING: atoms too close: (T0378)L228.O and (T0378)V230.O only 0.000 apart, marking (T0378)V230.O as missing WARNING: atoms too close: (T0378)G227.O and (T0378)V230.O only 0.000 apart, marking (T0378)V230.O as missing WARNING: atoms too close: (T0378)D182.O and (T0378)V230.O only 0.000 apart, marking (T0378)V230.O as missing WARNING: atoms too close: (T0378)L181.O and (T0378)V230.O only 0.000 apart, marking (T0378)V230.O as missing WARNING: atoms too close: (T0378)D71.O and (T0378)V230.O only 0.000 apart, marking (T0378)V230.O as missing WARNING: atoms too close: (T0378)F70.O and (T0378)V230.O only 0.000 apart, marking (T0378)V230.O as missing WARNING: atoms too close: (T0378)S69.O and (T0378)V230.O only 0.000 apart, marking (T0378)V230.O as missing WARNING: atoms too close: (T0378)E68.O and (T0378)V230.O only 0.000 apart, marking (T0378)V230.O as missing WARNING: atoms too close: (T0378)P67.O and (T0378)V230.O only 0.000 apart, marking (T0378)V230.O as missing WARNING: atoms too close: (T0378)L66.O and (T0378)V230.O only 0.000 apart, marking (T0378)V230.O as missing WARNING: atoms too close: (T0378)E65.O and (T0378)V230.O only 0.000 apart, marking (T0378)V230.O as missing WARNING: atoms too close: (T0378)V64.O and (T0378)V230.O only 0.000 apart, marking (T0378)V230.O as missing WARNING: atoms too close: (T0378)S229.C and (T0378)V230.C only 0.000 apart, marking (T0378)V230.C as missing WARNING: atoms too close: (T0378)L228.C and (T0378)V230.C only 0.000 apart, marking (T0378)V230.C as missing WARNING: atoms too close: (T0378)G227.C and (T0378)V230.C only 0.000 apart, marking (T0378)V230.C as missing WARNING: atoms too close: (T0378)D182.C and (T0378)V230.C only 0.000 apart, marking (T0378)V230.C as missing WARNING: atoms too close: (T0378)L181.C and (T0378)V230.C only 0.000 apart, marking (T0378)V230.C as missing WARNING: atoms too close: (T0378)D71.C and (T0378)V230.C only 0.000 apart, marking (T0378)V230.C as missing WARNING: atoms too close: (T0378)F70.C and (T0378)V230.C only 0.000 apart, marking (T0378)V230.C as missing WARNING: atoms too close: (T0378)S69.C and (T0378)V230.C only 0.000 apart, marking (T0378)V230.C as missing WARNING: atoms too close: (T0378)E68.C and (T0378)V230.C only 0.000 apart, marking (T0378)V230.C as missing WARNING: atoms too close: (T0378)P67.C and (T0378)V230.C only 0.000 apart, marking (T0378)V230.C as missing WARNING: atoms too close: (T0378)L66.C and (T0378)V230.C only 0.000 apart, marking (T0378)V230.C as missing WARNING: atoms too close: (T0378)E65.C and (T0378)V230.C only 0.000 apart, marking (T0378)V230.C as missing WARNING: atoms too close: (T0378)V64.C and (T0378)V230.C only 0.000 apart, marking (T0378)V230.C as missing WARNING: atoms too close: (T0378)V230.N and (T0378)K231.N only 0.000 apart, marking (T0378)V230.N as missing WARNING: atoms too close: (T0378)S229.N and (T0378)K231.N only 0.000 apart, marking (T0378)S229.N as missing WARNING: atoms too close: (T0378)L228.N and (T0378)K231.N only 0.000 apart, marking (T0378)L228.N as missing WARNING: atoms too close: (T0378)G227.N and (T0378)K231.N only 0.000 apart, marking (T0378)G227.N as missing WARNING: atoms too close: (T0378)D182.N and (T0378)K231.N only 0.000 apart, marking (T0378)D182.N as missing WARNING: atoms too close: (T0378)L181.N and (T0378)K231.N only 0.000 apart, marking (T0378)L181.N as missing WARNING: atoms too close: (T0378)D71.N and (T0378)K231.N only 0.000 apart, marking (T0378)D71.N as missing WARNING: atoms too close: (T0378)F70.N and (T0378)K231.N only 0.000 apart, marking (T0378)F70.N as missing WARNING: atoms too close: (T0378)S69.N and (T0378)K231.N only 0.000 apart, marking (T0378)S69.N as missing WARNING: atoms too close: (T0378)E68.N and (T0378)K231.N only 0.000 apart, marking (T0378)E68.N as missing WARNING: atoms too close: (T0378)P67.N and (T0378)K231.N only 0.000 apart, marking (T0378)P67.N as missing WARNING: atoms too close: (T0378)L66.N and (T0378)K231.N only 0.000 apart, marking (T0378)L66.N as missing WARNING: atoms too close: (T0378)E65.N and (T0378)K231.N only 0.000 apart, marking (T0378)E65.N as missing WARNING: atoms too close: (T0378)V64.N and (T0378)K231.N only 0.000 apart, marking (T0378)K231.N as missing WARNING: atoms too close: (T0378)V230.CA and (T0378)K231.CA only 0.000 apart, marking (T0378)K231.CA as missing WARNING: atoms too close: (T0378)S229.CA and (T0378)K231.CA only 0.000 apart, marking (T0378)K231.CA as missing WARNING: atoms too close: (T0378)L228.CA and (T0378)K231.CA only 0.000 apart, marking (T0378)K231.CA as missing WARNING: atoms too close: (T0378)G227.CA and (T0378)K231.CA only 0.000 apart, marking (T0378)K231.CA as missing WARNING: atoms too close: (T0378)D182.CA and (T0378)K231.CA only 0.000 apart, marking (T0378)K231.CA as missing WARNING: atoms too close: (T0378)L181.CA and (T0378)K231.CA only 0.000 apart, marking (T0378)K231.CA as missing WARNING: atoms too close: (T0378)D71.CA and (T0378)K231.CA only 0.000 apart, marking (T0378)K231.CA as missing WARNING: atoms too close: (T0378)F70.CA and (T0378)K231.CA only 0.000 apart, marking (T0378)K231.CA as missing WARNING: atoms too close: (T0378)S69.CA and (T0378)K231.CA only 0.000 apart, marking (T0378)K231.CA as missing WARNING: atoms too close: (T0378)E68.CA and (T0378)K231.CA only 0.000 apart, marking (T0378)K231.CA as missing WARNING: atoms too close: (T0378)P67.CA and (T0378)K231.CA only 0.000 apart, marking (T0378)K231.CA as missing WARNING: atoms too close: (T0378)L66.CA and (T0378)K231.CA only 0.000 apart, marking (T0378)K231.CA as missing WARNING: atoms too close: (T0378)E65.CA and (T0378)K231.CA only 0.000 apart, marking (T0378)K231.CA as missing WARNING: atoms too close: (T0378)V64.CA and (T0378)K231.CA only 0.000 apart, marking (T0378)K231.CA as missing WARNING: atoms too close: (T0378)V230.CB and (T0378)K231.CB only 0.000 apart, marking (T0378)K231.CB as missing WARNING: atoms too close: (T0378)S229.CB and (T0378)K231.CB only 0.000 apart, marking (T0378)K231.CB as missing WARNING: atoms too close: (T0378)L228.CB and (T0378)K231.CB only 0.000 apart, marking (T0378)K231.CB as missing WARNING: atoms too close: (T0378)D182.CB and (T0378)K231.CB only 0.000 apart, marking (T0378)K231.CB as missing WARNING: atoms too close: (T0378)L181.CB and (T0378)K231.CB only 0.000 apart, marking (T0378)K231.CB as missing WARNING: atoms too close: (T0378)D71.CB and (T0378)K231.CB only 0.000 apart, marking (T0378)K231.CB as missing WARNING: atoms too close: (T0378)F70.CB and (T0378)K231.CB only 0.000 apart, marking (T0378)K231.CB as missing WARNING: atoms too close: (T0378)S69.CB and (T0378)K231.CB only 0.000 apart, marking (T0378)K231.CB as missing WARNING: atoms too close: (T0378)E68.CB and (T0378)K231.CB only 0.000 apart, marking (T0378)K231.CB as missing WARNING: atoms too close: (T0378)P67.CB and (T0378)K231.CB only 0.000 apart, marking (T0378)K231.CB as missing WARNING: atoms too close: (T0378)L66.CB and (T0378)K231.CB only 0.000 apart, marking (T0378)K231.CB as missing WARNING: atoms too close: (T0378)E65.CB and (T0378)K231.CB only 0.000 apart, marking (T0378)K231.CB as missing WARNING: atoms too close: (T0378)V64.CB and (T0378)K231.CB only 0.000 apart, marking (T0378)K231.CB as missing WARNING: atoms too close: (T0378)V230.CG1 and (T0378)K231.CG only 0.000 apart, marking (T0378)K231.CG as missing WARNING: atoms too close: (T0378)L228.CG and (T0378)K231.CG only 0.000 apart, marking (T0378)K231.CG as missing WARNING: atoms too close: (T0378)D182.CG and (T0378)K231.CG only 0.000 apart, marking (T0378)K231.CG as missing WARNING: atoms too close: (T0378)L181.CG and (T0378)K231.CG only 0.000 apart, marking (T0378)K231.CG as missing WARNING: atoms too close: (T0378)D71.CG and (T0378)K231.CG only 0.000 apart, marking (T0378)K231.CG as missing WARNING: atoms too close: (T0378)F70.CG and (T0378)K231.CG only 0.000 apart, marking (T0378)K231.CG as missing WARNING: atoms too close: (T0378)E68.CG and (T0378)K231.CG only 0.000 apart, marking (T0378)K231.CG as missing WARNING: atoms too close: (T0378)L66.CG and (T0378)K231.CG only 0.000 apart, marking (T0378)K231.CG as missing WARNING: atoms too close: (T0378)E65.CG and (T0378)K231.CG only 0.000 apart, marking (T0378)K231.CG as missing WARNING: atoms too close: (T0378)V64.CG1 and (T0378)K231.CG only 0.000 apart, marking (T0378)K231.CG as missing WARNING: atoms too close: (T0378)L228.CD1 and (T0378)K231.CD only 0.000 apart, marking (T0378)K231.CD as missing WARNING: atoms too close: (T0378)L181.CD1 and (T0378)K231.CD only 0.000 apart, marking (T0378)K231.CD as missing WARNING: atoms too close: (T0378)E68.CD and (T0378)K231.CD only 0.000 apart, marking (T0378)K231.CD as missing WARNING: atoms too close: (T0378)L66.CD1 and (T0378)K231.CD only 0.000 apart, marking (T0378)K231.CD as missing WARNING: atoms too close: (T0378)E65.CD and (T0378)K231.CD only 0.000 apart, marking (T0378)K231.CD as missing WARNING: atoms too close: (T0378)V230.O and (T0378)K231.O only 0.000 apart, marking (T0378)K231.O as missing WARNING: atoms too close: (T0378)S229.O and (T0378)K231.O only 0.000 apart, marking (T0378)K231.O as missing WARNING: atoms too close: (T0378)L228.O and (T0378)K231.O only 0.000 apart, marking (T0378)K231.O as missing WARNING: atoms too close: (T0378)G227.O and (T0378)K231.O only 0.000 apart, marking (T0378)K231.O as missing WARNING: atoms too close: (T0378)D182.O and (T0378)K231.O only 0.000 apart, marking (T0378)K231.O as missing WARNING: atoms too close: (T0378)L181.O and (T0378)K231.O only 0.000 apart, marking (T0378)K231.O as missing WARNING: atoms too close: (T0378)D71.O and (T0378)K231.O only 0.000 apart, marking (T0378)K231.O as missing WARNING: atoms too close: (T0378)F70.O and (T0378)K231.O only 0.000 apart, marking (T0378)K231.O as missing WARNING: atoms too close: (T0378)S69.O and (T0378)K231.O only 0.000 apart, marking (T0378)K231.O as missing WARNING: atoms too close: (T0378)E68.O and (T0378)K231.O only 0.000 apart, marking (T0378)K231.O as missing WARNING: atoms too close: (T0378)P67.O and (T0378)K231.O only 0.000 apart, marking (T0378)K231.O as missing WARNING: atoms too close: (T0378)L66.O and (T0378)K231.O only 0.000 apart, marking (T0378)K231.O as missing WARNING: atoms too close: (T0378)E65.O and (T0378)K231.O only 0.000 apart, marking (T0378)K231.O as missing WARNING: atoms too close: (T0378)V64.O and (T0378)K231.O only 0.000 apart, marking (T0378)K231.O as missing WARNING: atoms too close: (T0378)V230.C and (T0378)K231.C only 0.000 apart, marking (T0378)K231.C as missing WARNING: atoms too close: (T0378)S229.C and (T0378)K231.C only 0.000 apart, marking (T0378)K231.C as missing WARNING: atoms too close: (T0378)L228.C and (T0378)K231.C only 0.000 apart, marking (T0378)K231.C as missing WARNING: atoms too close: (T0378)G227.C and (T0378)K231.C only 0.000 apart, marking (T0378)K231.C as missing WARNING: atoms too close: (T0378)D182.C and (T0378)K231.C only 0.000 apart, marking (T0378)K231.C as missing WARNING: atoms too close: (T0378)L181.C and (T0378)K231.C only 0.000 apart, marking (T0378)K231.C as missing WARNING: atoms too close: (T0378)D71.C and (T0378)K231.C only 0.000 apart, marking (T0378)K231.C as missing WARNING: atoms too close: (T0378)F70.C and (T0378)K231.C only 0.000 apart, marking (T0378)K231.C as missing WARNING: atoms too close: (T0378)S69.C and (T0378)K231.C only 0.000 apart, marking (T0378)K231.C as missing WARNING: atoms too close: (T0378)E68.C and (T0378)K231.C only 0.000 apart, marking (T0378)K231.C as missing WARNING: atoms too close: (T0378)P67.C and (T0378)K231.C only 0.000 apart, marking (T0378)K231.C as missing WARNING: atoms too close: (T0378)L66.C and (T0378)K231.C only 0.000 apart, marking (T0378)K231.C as missing WARNING: atoms too close: (T0378)E65.C and (T0378)K231.C only 0.000 apart, marking (T0378)K231.C as missing WARNING: atoms too close: (T0378)V64.C and (T0378)K231.C only 0.000 apart, marking (T0378)K231.C as missing # WARNING: incomplete conformation T0378 can't currently be optimized by undertaker # naming current conformation panther2_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_231669365.pdb -s /var/tmp/to_scwrl_231669365.seq -o /var/tmp/from_scwrl_231669365.pdb > /var/tmp/scwrl_231669365.log Error: Couldn't open file /var/tmp/from_scwrl_231669365.pdb or /var/tmp/from_scwrl_231669365.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_231669365_b.pdb or decoys//var/tmp/from_scwrl_231669365_b.pdb.gz for input Trying /var/tmp/from_scwrl_231669365_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_231669365_b.pdb or /var/tmp/from_scwrl_231669365_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_231669365_a.pdb or decoys//var/tmp/from_scwrl_231669365_a.pdb.gz for input Trying /var/tmp/from_scwrl_231669365_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_231669365_a.pdb or /var/tmp/from_scwrl_231669365_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_231669365.pdb or /var/tmp/from_scwrl_231669365_b.pdb or /var/tmp/from_scwrl_231669365_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 # Found a chain break before 253 # copying to AlignedFragments data structure # naming current conformation shub_TS1 # request to SCWRL produces command: ulimit -t 229 ; scwrl3 -i /var/tmp/to_scwrl_861800311.pdb -s /var/tmp/to_scwrl_861800311.seq -o /var/tmp/from_scwrl_861800311.pdb > /var/tmp/scwrl_861800311.log # Trying to read SCWRLed conformation from /var/tmp/from_scwrl_861800311.pdb # conformation set from SCWRL output # naming current conformation shub_TS1-scwrl # command:CPU_time= 97.788 sec, elapsed time= 1113.204 sec. # command:# Prefix for output files set to decoys/ # command:# Will now start reporting costs to decoys/evaluate.anglevector.rdb # command:# CostConform Warning: Couldn't open file decoys//projects/compbio/experiments/undertaker/spots/near-backbone-center.spot or decoys//projects/compbio/experiments/undertaker/spots/near-backbone-center.spot.gz for input Trying /projects/compbio/experiments/undertaker/spots/near-backbone-center.spot # Reading spots from /projects/compbio/experiments/undertaker/spots/near-backbone-center.spot shub_TS1-scwrl costs 74.079 real_cost = -38.432 shub_TS1 costs 74.079 real_cost = -37.946 panther2_TS1-scwrl costs 83.327 real_cost = 121.892 nFOLD_TS5-scwrl costs 88.720 real_cost = 220.216 nFOLD_TS5 costs 88.723 real_cost = 278.305 nFOLD_TS4-scwrl costs 74.921 real_cost = 182.667 nFOLD_TS4 costs 74.999 real_cost = 248.694 nFOLD_TS3-scwrl costs 63.146 real_cost = 26.883 nFOLD_TS3 costs 63.121 real_cost = 122.174 nFOLD_TS2-scwrl costs 62.753 real_cost = -33.709 nFOLD_TS2 costs 62.769 real_cost = 84.725 nFOLD_TS1-scwrl costs 56.708 real_cost = -32.762 nFOLD_TS1 costs 56.597 real_cost = 76.754 mGen-3D_TS1-scwrl costs 57.596 real_cost = -59.169 mGen-3D_TS1 costs 57.607 real_cost = 63.159 keasar-server_TS5-scwrl costs 63.846 real_cost = 19.381 keasar-server_TS5 costs 63.846 real_cost = 22.317 keasar-server_TS4-scwrl costs 68.378 real_cost = 8.435 keasar-server_TS4 costs 68.378 real_cost = 19.995 keasar-server_TS3-scwrl costs 65.074 real_cost = -5.971 keasar-server_TS3 costs 65.074 real_cost = 5.926 keasar-server_TS2-scwrl costs 63.392 real_cost = -17.748 keasar-server_TS2 costs 63.392 real_cost = -6.038 keasar-server_TS1-scwrl costs 62.652 real_cost = 5.821 keasar-server_TS1 costs 62.652 real_cost = 3.533 karypis.srv_TS5-scwrl costs 105.062 real_cost = 308.798 karypis.srv_TS5 costs 105.057 real_cost = 306.677 karypis.srv_TS4-scwrl costs 83.391 real_cost = 363.258 karypis.srv_TS4 costs 83.396 real_cost = 361.540 karypis.srv_TS3-scwrl costs 84.598 real_cost = 230.024 karypis.srv_TS3 costs 84.581 real_cost = 223.361 karypis.srv_TS2-scwrl costs 73.442 real_cost = 177.144 karypis.srv_TS2 costs 73.443 real_cost = 172.016 karypis.srv_TS1-scwrl costs 64.108 real_cost = 194.210 karypis.srv_TS1 costs 64.110 real_cost = 194.319 karypis.srv.4_TS5-scwrl costs 136.658 real_cost = 347.110 karypis.srv.4_TS5 costs 136.658 real_cost = 347.560 karypis.srv.4_TS4-scwrl costs 157.498 real_cost = 378.683 karypis.srv.4_TS4 costs 157.498 real_cost = 378.682 karypis.srv.4_TS3-scwrl costs 147.511 real_cost = 315.095 karypis.srv.4_TS3 costs 147.511 real_cost = 315.122 karypis.srv.4_TS2-scwrl costs 163.766 real_cost = 379.320 karypis.srv.4_TS2 costs 163.766 real_cost = 379.385 karypis.srv.4_TS1-scwrl costs 134.897 real_cost = 295.686 karypis.srv.4_TS1 costs 134.897 real_cost = 295.683 karypis.srv.2_TS5-scwrl costs 80.198 real_cost = 148.675 karypis.srv.2_TS5 costs 80.198 real_cost = 148.102 karypis.srv.2_TS4-scwrl costs 74.085 real_cost = 153.455 karypis.srv.2_TS4 costs 74.085 real_cost = 153.456 karypis.srv.2_TS3-scwrl costs 78.070 real_cost = 158.833 karypis.srv.2_TS3 costs 78.070 real_cost = 158.833 karypis.srv.2_TS2-scwrl costs 75.456 real_cost = 154.144 karypis.srv.2_TS2 costs 75.456 real_cost = 153.899 karypis.srv.2_TS1-scwrl costs 76.626 real_cost = 157.092 karypis.srv.2_TS1 costs 76.626 real_cost = 157.092 forecast-s_AL5-scwrl costs 93.815 real_cost = 407.809 forecast-s_AL5 costs 93.831 real_cost = 453.040 forecast-s_AL4-scwrl costs 90.060 real_cost = 263.798 forecast-s_AL4 costs 90.093 real_cost = 362.624 forecast-s_AL3-scwrl costs 82.276 real_cost = 191.914 forecast-s_AL3 costs 82.290 real_cost = 300.184 forecast-s_AL2-scwrl costs 74.752 real_cost = 180.534 forecast-s_AL2 costs 74.679 real_cost = 269.149 forecast-s_AL1-scwrl costs 86.346 real_cost = 202.086 forecast-s_AL1 costs 86.378 real_cost = 267.469 beautshotbase_TS1-scwrl costs 57.836 real_cost = -44.169 beautshotbase_TS1 costs 57.836 real_cost = -38.200 beautshot_TS1-scwrl costs 64.542 real_cost = -46.819 beautshot_TS1 costs 64.542 real_cost = -40.802 Zhang-Server_TS5-scwrl costs 49.970 real_cost = -70.812 Zhang-Server_TS5 costs 49.970 real_cost = -70.812 Zhang-Server_TS4-scwrl costs 53.069 real_cost = -65.007 Zhang-Server_TS4 costs 53.069 real_cost = -64.879 Zhang-Server_TS3-scwrl costs 49.789 real_cost = -68.648 Zhang-Server_TS3 costs 49.789 real_cost = -68.648 Zhang-Server_TS2-scwrl costs 55.425 real_cost = -54.118 Zhang-Server_TS2 costs 55.425 real_cost = -54.109 Zhang-Server_TS1-scwrl costs 48.062 real_cost = -69.699 Zhang-Server_TS1 costs 48.062 real_cost = -69.699 UNI-EID_sfst_AL5-scwrl costs 79.678 real_cost = 194.640 UNI-EID_sfst_AL5 costs 79.780 real_cost = 294.283 UNI-EID_sfst_AL4-scwrl costs 81.763 real_cost = 196.416 UNI-EID_sfst_AL4 costs 81.854 real_cost = 293.819 UNI-EID_sfst_AL3-scwrl costs 55.586 real_cost = -51.798 UNI-EID_sfst_AL3 costs 55.609 real_cost = 111.113 UNI-EID_sfst_AL2-scwrl costs 64.057 real_cost = 37.674 UNI-EID_sfst_AL2 costs 64.050 real_cost = 176.369 UNI-EID_sfst_AL1-scwrl costs 58.053 real_cost = -31.034 UNI-EID_sfst_AL1 costs 58.306 real_cost = 109.560 UNI-EID_expm_TS1-scwrl costs 85.516 real_cost = -44.715 UNI-EID_expm_TS1 costs 85.570 real_cost = 80.220 UNI-EID_bnmx_TS5-scwrl costs 80.093 real_cost = 192.778 UNI-EID_bnmx_TS5 costs 80.183 real_cost = 294.404 UNI-EID_bnmx_TS4-scwrl costs 82.070 real_cost = 198.805 UNI-EID_bnmx_TS4 costs 82.161 real_cost = 298.080 UNI-EID_bnmx_TS3-scwrl costs 55.091 real_cost = -52.908 UNI-EID_bnmx_TS3 costs 55.114 real_cost = 110.257 UNI-EID_bnmx_TS2-scwrl costs 64.057 real_cost = 37.674 UNI-EID_bnmx_TS2 costs 64.050 real_cost = 176.369 UNI-EID_bnmx_TS1-scwrl costs 56.843 real_cost = -29.822 UNI-EID_bnmx_TS1 costs 57.098 real_cost = 109.398 SPARKS2_TS5-scwrl costs 82.869 real_cost = 164.369 SPARKS2_TS5 costs 82.869 real_cost = 169.503 SPARKS2_TS4-scwrl costs 67.898 real_cost = 162.666 SPARKS2_TS4 costs 67.898 real_cost = 162.569 SPARKS2_TS3-scwrl costs 74.943 real_cost = 73.429 SPARKS2_TS3 costs 74.943 real_cost = 80.306 SPARKS2_TS2-scwrl costs 56.490 real_cost = -6.087 SPARKS2_TS2 costs 56.490 real_cost = -2.214 SPARKS2_TS1-scwrl costs 48.682 real_cost = -74.824 SPARKS2_TS1 costs 48.682 real_cost = -75.715 SP4_TS5-scwrl costs 83.079 real_cost = 150.746 SP4_TS5 costs 83.079 real_cost = 165.204 SP4_TS4-scwrl costs 68.450 real_cost = 162.924 SP4_TS4 costs 68.450 real_cost = 164.315 SP4_TS3-scwrl costs 72.838 real_cost = 54.968 SP4_TS3 costs 72.838 real_cost = 62.349 SP4_TS2-scwrl costs 58.120 real_cost = -11.576 SP4_TS2 costs 58.120 real_cost = -5.088 SP4_TS1-scwrl costs 46.700 real_cost = -71.765 SP4_TS1 costs 46.700 real_cost = -67.081 SP3_TS5-scwrl costs 82.869 real_cost = 164.369 SP3_TS5 costs 82.869 real_cost = 169.503 SP3_TS4-scwrl costs 69.998 real_cost = 157.860 SP3_TS4 costs 69.998 real_cost = 156.740 SP3_TS3-scwrl costs 72.411 real_cost = 36.657 SP3_TS3 costs 72.411 real_cost = 39.402 SP3_TS2-scwrl costs 58.120 real_cost = -11.576 SP3_TS2 costs 58.120 real_cost = -5.088 SP3_TS1-scwrl costs 45.249 real_cost = -80.863 SP3_TS1 costs 45.249 real_cost = -80.020 SAM_T06_server_TS5-scwrl costs 73.150 real_cost = 203.364 SAM_T06_server_TS5 costs 73.093 real_cost = 186.289 SAM_T06_server_TS4-scwrl costs 73.423 real_cost = 226.888 SAM_T06_server_TS4 costs 73.357 real_cost = 211.423 SAM_T06_server_TS3-scwrl costs 70.911 real_cost = 8.058 SAM_T06_server_TS3 costs 70.808 real_cost = -30.622 SAM_T06_server_TS2-scwrl costs 61.079 real_cost = 47.155 SAM_T06_server_TS2 costs 61.008 real_cost = 30.943 SAM_T06_server_TS1-scwrl costs 64.746 real_cost = 39.004 SAM_T06_server_TS1 costs 64.746 real_cost = 42.169 SAM-T99_AL5-scwrl costs 63.121 real_cost = 31.845 SAM-T99_AL5 costs 63.221 real_cost = 178.182 SAM-T99_AL4-scwrl costs 71.518 real_cost = 128.785 SAM-T99_AL4 costs 71.544 real_cost = 224.166 SAM-T99_AL3-scwrl costs 60.762 real_cost = 52.315 SAM-T99_AL3 costs 60.793 real_cost = 194.537 SAM-T99_AL2-scwrl costs 61.790 real_cost = 47.105 SAM-T99_AL2 costs 61.813 real_cost = 178.699 SAM-T99_AL1-scwrl costs 64.992 real_cost = 51.511 SAM-T99_AL1 costs 65.046 real_cost = 194.283 SAM-T02_AL5-scwrl costs 73.599 real_cost = 161.576 SAM-T02_AL5 costs 73.575 real_cost = 252.071 SAM-T02_AL4-scwrl costs 76.298 real_cost = 158.054 SAM-T02_AL4 costs 76.230 real_cost = 252.057 SAM-T02_AL3-scwrl costs 59.547 real_cost = -9.264 SAM-T02_AL3 costs 59.501 real_cost = 130.092 SAM-T02_AL2-scwrl costs 59.046 real_cost = -45.298 SAM-T02_AL2 costs 58.953 real_cost = 108.892 SAM-T02_AL1-scwrl costs 62.286 real_cost = 46.566 SAM-T02_AL1 costs 62.193 real_cost = 184.123 ROKKY_TS1-scwrl costs 51.559 real_cost = -28.669 ROKKY_TS1 costs 51.559 real_cost = -31.873 ROBETTA_TS5-scwrl costs 52.566 real_cost = 77.131 ROBETTA_TS5 costs 52.566 real_cost = 76.955 ROBETTA_TS4-scwrl costs 55.362 real_cost = -36.729 ROBETTA_TS4 costs 55.362 real_cost = -39.170 ROBETTA_TS3-scwrl costs 52.945 real_cost = -69.685 ROBETTA_TS3 costs 52.945 real_cost = -70.612 ROBETTA_TS2-scwrl costs 57.382 real_cost = -35.328 ROBETTA_TS2 costs 57.382 real_cost = -34.166 ROBETTA_TS1-scwrl costs 56.061 real_cost = -38.007 ROBETTA_TS1 costs 56.061 real_cost = -38.411 RAPTOR_TS5-scwrl costs 76.734 real_cost = 154.815 RAPTOR_TS5 costs 76.734 real_cost = 161.656 RAPTOR_TS4-scwrl costs 74.219 real_cost = 147.702 RAPTOR_TS4 costs 74.219 real_cost = 157.145 RAPTOR_TS3-scwrl costs 55.154 real_cost = -45.481 RAPTOR_TS3 costs 55.154 real_cost = -47.306 RAPTOR_TS2-scwrl costs 69.824 real_cost = 34.018 RAPTOR_TS2 costs 69.824 real_cost = 45.030 RAPTOR_TS1-scwrl costs 46.112 real_cost = -65.370 RAPTOR_TS1 costs 46.112 real_cost = -64.139 RAPTORESS_TS5-scwrl costs 98.130 real_cost = 182.170 RAPTORESS_TS5 costs 98.130 real_cost = 188.068 RAPTORESS_TS4-scwrl costs 119.741 real_cost = 256.138 RAPTORESS_TS4 costs 119.741 real_cost = 268.555 RAPTORESS_TS3-scwrl costs 60.605 real_cost = -35.184 RAPTORESS_TS3 costs 60.605 real_cost = -37.162 RAPTORESS_TS2-scwrl costs 72.562 real_cost = 37.366 RAPTORESS_TS2 costs 72.562 real_cost = 44.999 RAPTORESS_TS1-scwrl costs 54.130 real_cost = -68.314 RAPTORESS_TS1 costs 54.130 real_cost = -68.949 RAPTOR-ACE_TS5-scwrl costs 48.297 real_cost = -68.292 RAPTOR-ACE_TS5 costs 48.297 real_cost = -64.995 RAPTOR-ACE_TS4-scwrl costs 45.249 real_cost = -80.863 RAPTOR-ACE_TS4 costs 45.249 real_cost = -80.020 RAPTOR-ACE_TS3-scwrl costs 47.292 real_cost = -71.326 RAPTOR-ACE_TS3 costs 47.292 real_cost = -72.733 RAPTOR-ACE_TS2-scwrl costs 52.077 real_cost = -46.593 RAPTOR-ACE_TS2 costs 52.077 real_cost = -42.020 RAPTOR-ACE_TS1-scwrl costs 50.761 real_cost = -53.027 RAPTOR-ACE_TS1 costs 50.761 real_cost = -49.900 Pmodeller6_TS5-scwrl costs 48.686 real_cost = -51.035 Pmodeller6_TS5 costs 48.686 real_cost = -50.819 Pmodeller6_TS4-scwrl costs 52.005 real_cost = 120.288 Pmodeller6_TS4 costs 52.005 real_cost = 121.100 Pmodeller6_TS3-scwrl costs 54.372 real_cost = 117.655 Pmodeller6_TS3 costs 54.372 real_cost = 118.436 Pmodeller6_TS2-scwrl costs 54.480 real_cost = 115.047 Pmodeller6_TS2 costs 54.480 real_cost = 115.867 Pmodeller6_TS1-scwrl costs 50.346 real_cost = 108.298 Pmodeller6_TS1 costs 50.346 real_cost = 108.635 Phyre-2_TS5-scwrl costs 68.042 real_cost = 13.322 Phyre-2_TS5 costs 67.988 real_cost = -21.540 Phyre-2_TS4-scwrl costs 71.161 real_cost = 25.749 Phyre-2_TS4 costs 71.167 real_cost = -11.698 Phyre-2_TS3-scwrl costs 65.574 real_cost = -10.074 Phyre-2_TS3 costs 65.463 real_cost = -40.901 Phyre-2_TS2-scwrl costs 65.348 real_cost = -15.235 Phyre-2_TS2 costs 65.237 real_cost = -45.799 Phyre-2_TS1-scwrl costs 67.522 real_cost = -4.289 Phyre-2_TS1 costs 67.416 real_cost = -40.573 Phyre-1_TS1-scwrl costs 73.984 real_cost = 58.223 Phyre-1_TS1 costs 73.994 real_cost = 41.057 Pcons6_TS5-scwrl costs 58.356 real_cost = 41.533 Pcons6_TS5 costs 58.356 real_cost = 41.577 Pcons6_TS4-scwrl costs 55.501 real_cost = 62.986 Pcons6_TS4 costs 55.501 real_cost = 63.021 Pcons6_TS3-scwrl costs 51.710 real_cost = -41.546 Pcons6_TS3 costs 51.710 real_cost = -41.546 Pcons6_TS2-scwrl costs 64.647 real_cost = 54.563 Pcons6_TS2 costs 64.647 real_cost = 54.643 Pcons6_TS1-scwrl costs 53.988 real_cost = -4.735 Pcons6_TS1 costs 53.988 real_cost = -4.258 PROTINFO_TS5-scwrl costs 113.741 real_cost = 245.992 PROTINFO_TS5 costs 113.741 real_cost = 252.876 PROTINFO_TS4-scwrl costs 111.344 real_cost = 230.914 PROTINFO_TS4 costs 111.344 real_cost = 232.826 PROTINFO_TS3-scwrl costs 111.877 real_cost = 214.082 PROTINFO_TS3 costs 111.877 real_cost = 217.838 PROTINFO_TS2-scwrl costs 127.408 real_cost = 285.839 PROTINFO_TS2 costs 127.408 real_cost = 287.564 PROTINFO_TS1-scwrl costs 109.699 real_cost = 233.262 PROTINFO_TS1 costs 109.699 real_cost = 236.658 PROTINFO-AB_TS5-scwrl costs 113.805 real_cost = 232.051 PROTINFO-AB_TS5 costs 113.805 real_cost = 229.415 PROTINFO-AB_TS4-scwrl costs 110.101 real_cost = 225.192 PROTINFO-AB_TS4 costs 110.101 real_cost = 231.010 PROTINFO-AB_TS3-scwrl costs 109.985 real_cost = 232.374 PROTINFO-AB_TS3 costs 109.985 real_cost = 231.410 PROTINFO-AB_TS2-scwrl costs 109.442 real_cost = 230.620 PROTINFO-AB_TS2 costs 109.442 real_cost = 239.489 PROTINFO-AB_TS1-scwrl costs 108.579 real_cost = 237.683 PROTINFO-AB_TS1 costs 108.579 real_cost = 237.501 NN_PUT_lab_TS1-scwrl costs 47.193 real_cost = -58.622 NN_PUT_lab_TS1 costs 47.193 real_cost = -53.655 MetaTasser_TS5-scwrl costs 96.042 real_cost = 118.120 MetaTasser_TS5 costs 96.042 real_cost = 124.095 MetaTasser_TS4-scwrl costs 83.430 real_cost = 42.055 MetaTasser_TS4 costs 83.430 real_cost = 38.675 MetaTasser_TS3-scwrl costs 78.326 real_cost = 30.683 MetaTasser_TS3 costs 78.326 real_cost = 37.068 MetaTasser_TS2-scwrl costs 84.348 real_cost = -38.614 MetaTasser_TS2 costs 84.348 real_cost = -31.109 MetaTasser_TS1-scwrl costs 74.319 real_cost = -63.905 MetaTasser_TS1 costs 74.319 real_cost = -65.116 Ma-OPUS-server_TS5-scwrl costs 51.631 real_cost = -60.839 Ma-OPUS-server_TS5 costs 51.631 real_cost = -54.100 Ma-OPUS-server_TS4-scwrl costs 51.821 real_cost = -58.673 Ma-OPUS-server_TS4 costs 51.821 real_cost = -52.259 Ma-OPUS-server_TS3-scwrl costs 46.123 real_cost = -68.674 Ma-OPUS-server_TS3 costs 46.123 real_cost = -66.714 Ma-OPUS-server_TS2-scwrl costs 68.288 real_cost = 34.899 Ma-OPUS-server_TS2 costs 68.288 real_cost = 41.697 Ma-OPUS-server_TS1-scwrl costs 73.947 real_cost = 54.187 Ma-OPUS-server_TS1 costs 73.947 real_cost = 59.793 Ma-OPUS-server2_TS5-scwrl costs 68.288 real_cost = 34.899 Ma-OPUS-server2_TS5 costs 68.288 real_cost = 41.697 Ma-OPUS-server2_TS4-scwrl costs 49.092 real_cost = -71.686 Ma-OPUS-server2_TS4 costs 49.092 real_cost = -69.117 Ma-OPUS-server2_TS3-scwrl costs 51.631 real_cost = -60.839 Ma-OPUS-server2_TS3 costs 51.631 real_cost = -54.100 Ma-OPUS-server2_TS2-scwrl costs 50.067 real_cost = -61.654 Ma-OPUS-server2_TS2 costs 50.067 real_cost = -66.005 Ma-OPUS-server2_TS1-scwrl costs 47.767 real_cost = -61.970 Ma-OPUS-server2_TS1 costs 47.767 real_cost = -64.907 MIG_FROST_AL1-scwrl costs 58.665 real_cost = -12.137 MIG_FROST_AL1 costs 58.684 real_cost = 159.866 LOOPP_TS5-scwrl costs 74.217 real_cost = 164.296 LOOPP_TS5 costs 74.219 real_cost = 168.656 LOOPP_TS4-scwrl costs 53.676 real_cost = 30.366 LOOPP_TS4 costs 53.670 real_cost = 29.255 LOOPP_TS3-scwrl costs 55.602 real_cost = 38.717 LOOPP_TS3 costs 55.602 real_cost = 47.982 LOOPP_TS2-scwrl costs 49.062 real_cost = 8.097 LOOPP_TS2 costs 49.063 real_cost = 7.402 LOOPP_TS1-scwrl costs 47.193 real_cost = -58.622 LOOPP_TS1 costs 47.193 real_cost = -53.655 Huber-Torda-Server_TS5-scwrl costs 77.576 real_cost = 185.830 Huber-Torda-Server_TS5 costs 77.584 real_cost = 248.319 Huber-Torda-Server_TS4-scwrl costs 82.799 real_cost = 214.717 Huber-Torda-Server_TS4 costs 82.767 real_cost = 281.265 Huber-Torda-Server_TS3-scwrl costs 76.918 real_cost = 93.167 Huber-Torda-Server_TS3 costs 77.110 real_cost = 192.299 Huber-Torda-Server_TS2-scwrl costs 63.553 real_cost = -30.433 Huber-Torda-Server_TS2 costs 63.512 real_cost = 80.816 Huber-Torda-Server_TS1-scwrl costs 63.562 real_cost = -17.542 Huber-Torda-Server_TS1 costs 63.729 real_cost = 81.547 HHpred3_TS1-scwrl costs 44.475 real_cost = -102.527 HHpred3_TS1 costs 44.475 real_cost = -113.031 HHpred2_TS1-scwrl costs 46.497 real_cost = -112.008 HHpred2_TS1 costs 46.497 real_cost = -109.326 HHpred1_TS1-scwrl costs 47.213 real_cost = -95.951 HHpred1_TS1 costs 47.213 real_cost = -92.091 GeneSilicoMetaServer_TS5-scwrl costs 53.120 real_cost = -55.911 GeneSilicoMetaServer_TS5 costs 53.120 real_cost = -52.003 GeneSilicoMetaServer_TS4-scwrl costs 47.435 real_cost = -71.696 GeneSilicoMetaServer_TS4 costs 47.435 real_cost = -67.679 GeneSilicoMetaServer_TS3-scwrl costs 48.972 real_cost = -69.551 GeneSilicoMetaServer_TS3 costs 48.972 real_cost = -67.827 GeneSilicoMetaServer_TS2-scwrl costs 51.844 real_cost = -59.687 GeneSilicoMetaServer_TS2 costs 51.834 real_cost = -66.071 GeneSilicoMetaServer_TS1-scwrl costs 53.735 real_cost = -64.843 GeneSilicoMetaServer_TS1 costs 53.735 real_cost = -64.388 Frankenstein_TS5-scwrl costs 73.661 real_cost = 93.915 Frankenstein_TS5 costs 73.661 real_cost = 102.945 Frankenstein_TS4-scwrl costs 76.371 real_cost = 104.097 Frankenstein_TS4 costs 76.371 real_cost = 110.861 Frankenstein_TS3-scwrl costs 55.767 real_cost = 3.884 Frankenstein_TS3 costs 55.767 real_cost = 7.923 Frankenstein_TS2-scwrl costs 55.961 real_cost = -5.848 Frankenstein_TS2 costs 55.961 real_cost = 4.277 Frankenstein_TS1-scwrl costs 48.133 real_cost = -76.441 Frankenstein_TS1 costs 48.133 real_cost = -65.092 FUNCTION_TS5-scwrl costs 71.540 real_cost = 26.741 FUNCTION_TS5 costs 71.540 real_cost = 28.442 FUNCTION_TS4-scwrl costs 72.562 real_cost = -2.122 FUNCTION_TS4 costs 72.562 real_cost = -4.001 FUNCTION_TS3-scwrl costs 79.378 real_cost = 1.602 FUNCTION_TS3 costs 79.378 real_cost = 4.079 FUNCTION_TS2-scwrl costs 69.247 real_cost = -23.851 FUNCTION_TS2 costs 69.247 real_cost = -26.978 FUNCTION_TS1-scwrl costs 75.842 real_cost = -15.443 FUNCTION_TS1 costs 75.842 real_cost = -9.429 FUGUE_AL5-scwrl costs 88.577 real_cost = 295.428 FUGUE_AL5 costs 88.571 real_cost = 447.686 FUGUE_AL4-scwrl costs 94.497 real_cost = 401.635 FUGUE_AL4 costs 94.477 real_cost = 443.054 FUGUE_AL3-scwrl costs 89.759 real_cost = 204.589 FUGUE_AL3 costs 89.805 real_cost = 270.991 FUGUE_AL2-scwrl costs 58.350 real_cost = -18.895 FUGUE_AL2 costs 58.350 real_cost = 136.825 FUGUE_AL1-scwrl costs 65.996 real_cost = 9.444 FUGUE_AL1 costs 65.969 real_cost = 150.458 FPSOLVER-SERVER_TS5-scwrl costs 147.423 real_cost = 373.932 FPSOLVER-SERVER_TS5 costs 147.423 real_cost = 374.431 FPSOLVER-SERVER_TS4-scwrl costs 151.843 real_cost = 366.227 FPSOLVER-SERVER_TS4 costs 151.843 real_cost = 370.212 FPSOLVER-SERVER_TS3-scwrl costs 151.863 real_cost = 351.572 FPSOLVER-SERVER_TS3 costs 151.863 real_cost = 353.453 FPSOLVER-SERVER_TS2-scwrl costs 145.492 real_cost = 361.775 FPSOLVER-SERVER_TS2 costs 145.492 real_cost = 362.782 FPSOLVER-SERVER_TS1-scwrl costs 155.012 real_cost = 359.026 FPSOLVER-SERVER_TS1 costs 155.012 real_cost = 361.211 FORTE2_AL5-scwrl costs 82.583 real_cost = 182.570 FORTE2_AL5 costs 82.602 real_cost = 292.624 FORTE2_AL4-scwrl costs 80.111 real_cost = 219.364 FORTE2_AL4 costs 80.088 real_cost = 306.509 FORTE2_AL3-scwrl costs 68.617 real_cost = 166.171 FORTE2_AL3 costs 68.624 real_cost = 271.931 FORTE2_AL2-scwrl costs 66.035 real_cost = 31.489 FORTE2_AL2 costs 66.028 real_cost = 176.134 FORTE2_AL1-scwrl costs 61.546 real_cost = -17.838 FORTE2_AL1 costs 61.549 real_cost = 132.094 FORTE1_AL5-scwrl costs 88.485 real_cost = 240.281 FORTE1_AL5 costs 88.474 real_cost = 328.747 FORTE1_AL4-scwrl costs 72.188 real_cost = 191.122 FORTE1_AL4 costs 72.206 real_cost = 295.812 FORTE1_AL3-scwrl costs 68.555 real_cost = 167.225 FORTE1_AL3 costs 68.586 real_cost = 272.966 FORTE1_AL2-scwrl costs 66.035 real_cost = 31.489 FORTE1_AL2 costs 66.028 real_cost = 176.134 FORTE1_AL1-scwrl costs 61.546 real_cost = -17.838 FORTE1_AL1 costs 61.549 real_cost = 132.094 FOLDpro_TS5-scwrl costs 57.717 real_cost = -65.845 FOLDpro_TS5 costs 57.717 real_cost = -60.216 FOLDpro_TS4-scwrl costs 57.041 real_cost = -80.048 FOLDpro_TS4 costs 57.041 real_cost = -81.074 FOLDpro_TS3-scwrl costs 51.904 real_cost = -94.595 FOLDpro_TS3 costs 51.904 real_cost = -94.604 FOLDpro_TS2-scwrl costs 51.996 real_cost = -84.045 FOLDpro_TS2 costs 51.996 real_cost = -82.796 FOLDpro_TS1-scwrl costs 51.520 real_cost = -89.101 FOLDpro_TS1 costs 51.520 real_cost = -86.559 FAMS_TS5-scwrl costs 70.408 real_cost = -50.602 FAMS_TS5 costs 70.398 real_cost = -51.135 FAMS_TS4-scwrl costs 66.374 real_cost = -38.308 FAMS_TS4 costs 66.374 real_cost = -41.219 FAMS_TS3-scwrl costs 62.304 real_cost = 2.298 FAMS_TS3 costs 62.294 real_cost = 5.176 FAMS_TS2-scwrl costs 71.133 real_cost = 18.104 FAMS_TS2 costs 71.124 real_cost = 15.307 FAMS_TS1-scwrl costs 61.431 real_cost = -86.119 FAMS_TS1 costs 61.431 real_cost = -80.260 FAMSD_TS5-scwrl costs 62.519 real_cost = 10.125 FAMSD_TS5 costs 62.509 real_cost = 12.044 FAMSD_TS4-scwrl costs 62.304 real_cost = 2.298 FAMSD_TS4 costs 62.294 real_cost = 5.176 FAMSD_TS3-scwrl costs 69.265 real_cost = 5.964 FAMSD_TS3 costs 69.261 real_cost = 9.475 FAMSD_TS2-scwrl costs 63.240 real_cost = -21.690 FAMSD_TS2 costs 63.240 real_cost = -18.172 FAMSD_TS1-scwrl costs 67.611 real_cost = -71.576 FAMSD_TS1 costs 67.611 real_cost = -63.217 Distill_TS5-scwrl costs 232.457 real_cost = 434.570 Distill_TS4-scwrl costs 233.400 real_cost = 433.868 Distill_TS3-scwrl costs 233.267 real_cost = 430.032 Distill_TS2-scwrl costs 234.258 real_cost = 429.320 Distill_TS1-scwrl costs 230.510 real_cost = 423.501 CaspIta-FOX_TS5-scwrl costs 88.215 real_cost = 223.640 CaspIta-FOX_TS5 costs 88.295 real_cost = 216.217 CaspIta-FOX_TS4-scwrl costs 72.375 real_cost = 178.026 CaspIta-FOX_TS4 costs 72.300 real_cost = 173.716 CaspIta-FOX_TS3-scwrl costs 79.046 real_cost = 174.000 CaspIta-FOX_TS3 costs 78.959 real_cost = 172.883 CaspIta-FOX_TS2-scwrl costs 73.078 real_cost = 25.322 CaspIta-FOX_TS2 costs 73.078 real_cost = 23.900 CaspIta-FOX_TS1-scwrl costs 60.595 real_cost = -27.941 CaspIta-FOX_TS1 costs 60.595 real_cost = -31.883 CPHmodels_TS1-scwrl costs 67.736 real_cost = 12.761 CPHmodels_TS1 costs 67.733 real_cost = 12.058 CIRCLE_TS5-scwrl costs 71.133 real_cost = 18.104 CIRCLE_TS5 costs 71.124 real_cost = 15.307 CIRCLE_TS4-scwrl costs 63.338 real_cost = -47.801 CIRCLE_TS4 costs 63.338 real_cost = -37.646 CIRCLE_TS3-scwrl costs 58.501 real_cost = -73.049 CIRCLE_TS3 costs 58.501 real_cost = -70.013 CIRCLE_TS2-scwrl costs 70.278 real_cost = 5.424 CIRCLE_TS2 costs 70.268 real_cost = 8.059 CIRCLE_TS1-scwrl costs 66.374 real_cost = -38.308 CIRCLE_TS1 costs 66.374 real_cost = -41.219 Bilab-ENABLE_TS5-scwrl costs 63.574 real_cost = -28.941 Bilab-ENABLE_TS5 costs 63.574 real_cost = -28.941 Bilab-ENABLE_TS4-scwrl costs 56.129 real_cost = -23.371 Bilab-ENABLE_TS4 costs 56.129 real_cost = -23.364 Bilab-ENABLE_TS3-scwrl costs 49.445 real_cost = -64.250 Bilab-ENABLE_TS3 costs 49.445 real_cost = -64.497 Bilab-ENABLE_TS2-scwrl costs 61.495 real_cost = -40.725 Bilab-ENABLE_TS2 costs 61.495 real_cost = -40.725 Bilab-ENABLE_TS1-scwrl costs 54.647 real_cost = -10.567 Bilab-ENABLE_TS1 costs 54.647 real_cost = -10.566 BayesHH_TS1-scwrl costs 60.756 real_cost = -99.791 BayesHH_TS1 costs 60.756 real_cost = -89.789 ABIpro_TS5-scwrl costs 74.412 real_cost = 273.599 ABIpro_TS5 costs 74.412 real_cost = 273.749 ABIpro_TS4-scwrl costs 79.729 real_cost = 287.279 ABIpro_TS4 costs 79.729 real_cost = 287.279 ABIpro_TS3-scwrl costs 82.156 real_cost = 262.888 ABIpro_TS3 costs 82.156 real_cost = 262.885 ABIpro_TS2-scwrl costs 81.110 real_cost = 292.377 ABIpro_TS2 costs 81.110 real_cost = 292.377 ABIpro_TS1-scwrl costs 81.074 real_cost = 285.613 ABIpro_TS1 costs 81.074 real_cost = 285.232 3Dpro_TS5-scwrl costs 54.295 real_cost = -40.139 3Dpro_TS5 costs 54.295 real_cost = -43.895 3Dpro_TS4-scwrl costs 56.712 real_cost = -50.630 3Dpro_TS4 costs 56.712 real_cost = -44.274 3Dpro_TS3-scwrl costs 48.968 real_cost = -60.981 3Dpro_TS3 costs 48.968 real_cost = -59.362 3Dpro_TS2-scwrl costs 47.558 real_cost = -95.317 3Dpro_TS2 costs 47.558 real_cost = -89.813 3Dpro_TS1-scwrl costs 54.422 real_cost = -57.931 3Dpro_TS1 costs 54.422 real_cost = -53.292 3D-JIGSAW_TS5-scwrl costs 83.036 real_cost = 188.994 3D-JIGSAW_TS5 costs 83.034 real_cost = 199.301 3D-JIGSAW_TS4-scwrl costs 78.847 real_cost = 164.277 3D-JIGSAW_TS4 costs 78.853 real_cost = 174.556 3D-JIGSAW_TS3-scwrl costs 84.420 real_cost = 201.332 3D-JIGSAW_TS3 costs 84.465 real_cost = 210.512 3D-JIGSAW_TS2-scwrl costs 78.343 real_cost = 159.851 3D-JIGSAW_TS2 costs 78.341 real_cost = 169.968 3D-JIGSAW_TS1-scwrl costs 90.976 real_cost = 235.160 3D-JIGSAW_TS1 costs 90.958 real_cost = 232.835 3D-JIGSAW_RECOM_TS5-scwrl costs 73.531 real_cost = 126.334 3D-JIGSAW_RECOM_TS5 costs 73.518 real_cost = 131.213 3D-JIGSAW_RECOM_TS4-scwrl costs 75.945 real_cost = 149.350 3D-JIGSAW_RECOM_TS4 costs 75.932 real_cost = 155.485 3D-JIGSAW_RECOM_TS3-scwrl costs 74.133 real_cost = 279.846 3D-JIGSAW_RECOM_TS3 costs 74.268 real_cost = 281.670 3D-JIGSAW_RECOM_TS2-scwrl costs 75.884 real_cost = 122.031 3D-JIGSAW_RECOM_TS2 costs 75.871 real_cost = 116.464 3D-JIGSAW_RECOM_TS1-scwrl costs 76.232 real_cost = 118.554 3D-JIGSAW_RECOM_TS1 costs 76.398 real_cost = 124.571 3D-JIGSAW_POPULUS_TS5-scwrl costs 72.936 real_cost = 148.538 3D-JIGSAW_POPULUS_TS5 costs 72.937 real_cost = 150.038 3D-JIGSAW_POPULUS_TS4-scwrl costs 79.926 real_cost = 178.023 3D-JIGSAW_POPULUS_TS4 costs 79.924 real_cost = 179.066 3D-JIGSAW_POPULUS_TS3-scwrl costs 75.593 real_cost = 157.324 3D-JIGSAW_POPULUS_TS3 costs 75.593 real_cost = 158.396 3D-JIGSAW_POPULUS_TS2-scwrl costs 74.836 real_cost = 160.234 3D-JIGSAW_POPULUS_TS2 costs 74.836 real_cost = 161.969 3D-JIGSAW_POPULUS_TS1-scwrl costs 75.357 real_cost = 153.493 3D-JIGSAW_POPULUS_TS1 costs 75.358 real_cost = 154.652 T0378.try9-opt2.repack-nonPC.pdb.gz costs 65.319 real_cost = 60.820 T0378.try9-opt2.pdb.gz costs 65.319 real_cost = 64.321 T0378.try9-opt2.gromacs0.repack-nonPC.pdb.gz costs 57.120 real_cost = 59.024 T0378.try9-opt2.gromacs0.pdb.gz costs 57.120 real_cost = 63.585 T0378.try9-opt1.pdb.gz costs 64.952 real_cost = 64.014 T0378.try9-opt1-scwrl.pdb.gz costs 64.952 real_cost = 55.028 T0378.try8-opt2.repack-nonPC.pdb.gz costs 66.680 real_cost = 124.711 T0378.try8-opt2.pdb.gz costs 66.680 real_cost = 123.167 T0378.try8-opt2.gromacs0.repack-nonPC.pdb.gz costs 56.127 real_cost = 125.337 T0378.try8-opt2.gromacs0.pdb.gz costs 56.127 real_cost = 123.308 T0378.try8-opt1.pdb.gz costs 60.876 real_cost = 121.754 T0378.try8-opt1-scwrl.pdb.gz costs 60.876 real_cost = 122.479 T0378.try7-opt2.repack-nonPC.pdb.gz costs 63.535 real_cost = 57.986 T0378.try7-opt2.pdb.gz costs 69.927 real_cost = 70.972 T0378.try7-opt2.gromacs0.repack-nonPC.pdb.gz costs 57.776 real_cost = 58.848 T0378.try7-opt2.gromacs0.pdb.gz costs 57.776 real_cost = 60.567 T0378.try7-opt1.pdb.gz costs 66.548 real_cost = 68.330 T0378.try7-opt1-scwrl.pdb.gz costs 66.548 real_cost = 66.018 T0378.try6-opt2.repack-nonPC.pdb.gz costs 84.652 real_cost = 286.312 T0378.try6-opt2.pdb.gz costs 84.652 real_cost = 288.399 T0378.try6-opt2.gromacs0.repack-nonPC.pdb.gz costs 82.910 real_cost = 283.923 T0378.try6-opt2.gromacs0.pdb.gz costs 82.910 real_cost = 284.384 T0378.try6-opt1.pdb.gz costs 83.652 real_cost = 284.695 T0378.try6-opt1-scwrl.pdb.gz costs 83.652 real_cost = 283.669 T0378.try5-opt2.repack-nonPC.pdb.gz costs 72.747 real_cost = 284.599 T0378.try5-opt2.pdb.gz costs 72.747 real_cost = 285.153 T0378.try5-opt2.gromacs0.repack-nonPC.pdb.gz costs 72.628 real_cost = 279.532 T0378.try5-opt2.gromacs0.pdb.gz costs 72.628 real_cost = 283.109 T0378.try5-opt1.pdb.gz costs 72.387 real_cost = 285.287 T0378.try5-opt1-scwrl.pdb.gz costs 72.387 real_cost = 285.325 T0378.try4-opt2.repack-nonPC.pdb.gz costs 64.102 real_cost = 59.601 T0378.try4-opt2.pdb.gz costs 64.102 real_cost = 63.579 T0378.try4-opt2.gromacs0.repack-nonPC.pdb.gz costs 55.658 real_cost = 59.068 T0378.try4-opt2.gromacs0.pdb.gz costs 55.658 real_cost = 62.656 T0378.try4-opt1.pdb.gz costs 64.281 real_cost = 63.207 T0378.try4-opt1-scwrl.pdb.gz costs 64.281 real_cost = 54.790 T0378.try3-opt2.repack-nonPC.pdb.gz costs 64.869 real_cost = 61.018 T0378.try3-opt2.pdb.gz costs 65.357 real_cost = 63.032 T0378.try3-opt2.gromacs0.repack-nonPC.pdb.gz costs 55.650 real_cost = 59.601 T0378.try3-opt2.gromacs0.pdb.gz costs 55.650 real_cost = 61.442 T0378.try3-opt1.pdb.gz costs 65.043 real_cost = 61.865 T0378.try3-opt1-scwrl.pdb.gz costs 65.043 real_cost = 53.946 T0378.try2-opt2.repack-nonPC.pdb.gz costs 64.912 real_cost = 57.311 T0378.try2-opt2.pdb.gz costs 64.912 real_cost = 56.736 T0378.try2-opt2.gromacs0.repack-nonPC.pdb.gz costs 55.539 real_cost = 57.441 T0378.try2-opt2.gromacs0.pdb.gz costs 55.539 real_cost = 56.814 T0378.try2-opt1.pdb.gz costs 64.696 real_cost = 59.757 T0378.try2-opt1-scwrl.pdb.gz costs 64.696 real_cost = 52.056 T0378.try10-opt2.repack-nonPC.pdb.gz costs 64.116 real_cost = 61.415 T0378.try10-opt2.pdb.gz costs 64.116 real_cost = 60.130 T0378.try10-opt2.gromacs0.repack-nonPC.pdb.gz costs 56.185 real_cost = 57.052 T0378.try10-opt2.gromacs0.pdb.gz costs 56.185 real_cost = 58.943 T0378.try10-opt1.pdb.gz costs 64.070 real_cost = 58.147 T0378.try10-opt1-scwrl.pdb.gz costs 64.070 real_cost = 54.868 T0378.try1-opt2.repack-nonPC.pdb.gz costs 70.213 real_cost = 66.916 T0378.try1-opt2.pdb.gz costs 70.213 real_cost = 63.427 T0378.try1-opt2.gromacs0.repack-nonPC.pdb.gz costs 55.893 real_cost = 62.456 T0378.try1-opt2.gromacs0.pdb.gz costs 55.893 real_cost = 61.297 T0378.try1-opt1.pdb.gz costs 64.840 real_cost = 60.468 T0378.try1-opt1-scwrl.pdb.gz costs 64.840 real_cost = 61.017 ../model5.ts-submitted costs 56.185 real_cost = 57.050 ../model4.ts-submitted costs 64.102 real_cost = 63.703 ../model3.ts-submitted costs 64.450 real_cost = 62.977 ../model2.ts-submitted costs 56.127 real_cost = 125.423 ../model1.ts-submitted costs 65.184 real_cost = 64.329 align5 costs 100.294 real_cost = 370.020 align4 costs 71.418 real_cost = 191.400 align3 costs 70.731 real_cost = 211.298 align2 costs 68.589 real_cost = -38.339 align1 costs 61.182 real_cost = 29.382 T0378.try1-opt2.pdb costs 70.213 real_cost = 63.405 model5-scwrl costs 56.185 real_cost = 55.408 model5.ts-submitted costs 56.185 real_cost = 57.050 model4-scwrl costs 64.102 real_cost = 54.598 model4.ts-submitted costs 64.102 real_cost = 63.703 model3-scwrl costs 64.450 real_cost = 54.686 model3.ts-submitted costs 64.450 real_cost = 62.977 model2-scwrl costs 56.127 real_cost = 122.731 model2.ts-submitted costs 56.127 real_cost = 125.423 model1-scwrl costs 64.754 real_cost = 55.398 model1.ts-submitted costs 65.184 real_cost = 64.329 2i6dA costs 39.747 real_cost = -879.000 # command:CPU_time= 2648.163 sec, elapsed time= 3672.623 sec. # command:rm -f sort.tmp /projects/compbio/bin/sorttbl real_cost < decoys/evaluate.anglevector.rdb > sort.tmp mv -f sort.tmp decoys/evaluate.anglevector.rdb mv -f decoys/evaluate.anglevector.pretty decoys/evaluate.anglevector.pretty.old /projects/compbio/experiments/protein-predict/casp7/scripts/prettyscore -terse -targpfx -decpoint < decoys/evaluate.anglevector.rdb > decoys/evaluate.anglevector.pretty make[1]: Leaving directory `/projects/compbio/experiments/protein-predict/casp7/T0378'