make[1]: Entering directory `/projects/compbio/experiments/protein-predict/casp7/T0316' /projects/compbio/experiments/protein-predict/casp7/starter-directory/Make.main:725: SECONDARY_TARGET = T0316.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/T0316.} ;\ 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/T0316/ -e s/START_COL/1/ \ -e s/COSTFCN/anglevector/ \ -e s/_domain// \ -e s/read-pdb/read-pdb+servers/ \ -e s/REAL_PDB/2hmaA/ \ < /projects/compbio/experiments/protein-predict/casp7/starter-directory/evaluate.under \ | nice -2 /cse/grads/jarchie/projects/cvs/karplus/undertaker/undertaker # command:# Seed set to 1183103114 # command:# Prefix for input files set to /projects/compbio/experiments/undertaker/atoms-inputs/ # command:# reading monomeric-50pc.atoms # #computed average backbone with maximum peptide_sq_deviance = 0.002 # computed average trans backbone unit from 8101 examples # computed average cis backbone unit from 20 examples # computed average trans backbone unit before proline from 332 examples # trans (non-proline) backbone unit: # CA= -2.2101 1.0129 -0.0033 # O= -0.1508 2.2440 0.0016 # C= -0.6897 1.1364 -0.0000 # N+1= 0.0000 0.0000 0.0000 # CA+1= 1.4583 -0.0000 -0.0000 # cis backbone unit: # CA= -0.1438 2.4522 0.0007 # O= -2.0283 0.9702 0.0005 # C= -0.8017 1.0759 0.0000 # N+1= 0.0000 0.0000 0.0000 # CA+1= 1.4664 -0.0000 0.0000 # trans backbone unit before proline: # CA= -2.2110 1.0636 -0.0014 # O= -0.1234 2.2469 0.0075 # C= -0.6877 1.1518 0.0000 # N+1= 0.0000 0.0000 0.0000 # CA+1= 1.4665 0.0000 0.0000 # After reading monomeric-50pc.atoms have 448 chains in training database # Count of chains,residues,atoms: 448,112605,876684 # 111048 residues have no bad marker # 665 residues lack atoms needed to compute omega # 322 residues have cis peptide # number of each bad type: # NON_STANDARD_RESIDUE 6 # HAS_OXT 325 # TOO_MANY_ATOMS 1 # TOO_FEW_ATOMS 523 # HAS_UNKNOWN_ATOMS 2 # HAS_DUPLICATE_ATOMS 0 # CHAIN_BREAK_BEFORE 208 # NON_PLANAR_PEPTIDE 143 # BAD_PEPTIDE 685 # Note: may sum to more than number of residues, # because one residue may have multiple problems # command:# Reading rotamer library from dunbrack-1332.rot # command:# Prefix for input files set to /projects/compbio/experiments/undertaker/spots/ # command:# ReadAtomType exp-pdb.types Read AtomType exp-pdb with 49 types. # command:# ReadClashTable exp-pdb-2191-2symm.clash # Read ClashTable exp-pdb-2191-2symm checking bonds symmetric at MaxSep 2 # command:# command:CPU_time= 6.867 sec, elapsed time= 6.986 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= 6.947 sec, elapsed time= 7.094 sec. # command:# Prefix for input files set to # command:# Making conformation for sequence T0316 numbered 1 through 373 Created new target T0316 from T0316.a2m # command:# command:# No conformations to remove in PopConform # command:# cleared Id set # command:# command:2hmaA expands to /projects/compbio/data/pdb/2hma.pdb.gz 2hmaA: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 358, because occupancy 0.3 <= existing 0.700 in 2hmaA Skipped atom 360, because occupancy 0.300 <= existing 0.700 in 2hmaA Skipped atom 362, because occupancy 0.300 <= existing 0.700 in 2hmaA Skipped atom 364, because occupancy 0.300 <= existing 0.700 in 2hmaA Skipped atom 366, because occupancy 0.300 <= existing 0.700 in 2hmaA Skipped atom 368, because occupancy 0.300 <= existing 0.700 in 2hmaA Skipped atom 370, because occupancy 0.300 <= existing 0.700 in 2hmaA Skipped atom 372, because occupancy 0.300 <= existing 0.700 in 2hmaA Skipped atom 374, because occupancy 0.300 <= existing 0.700 in 2hmaA Skipped atom 396, because occupancy 0.300 <= existing 0.700 in 2hmaA Skipped atom 398, because occupancy 0.300 <= existing 0.700 in 2hmaA Skipped atom 400, because occupancy 0.300 <= existing 0.700 in 2hmaA Skipped atom 402, because occupancy 0.300 <= existing 0.700 in 2hmaA Skipped atom 404, because occupancy 0.300 <= existing 0.700 in 2hmaA Skipped atom 406, because occupancy 0.300 <= existing 0.700 in 2hmaA Skipped atom 408, because occupancy 0.300 <= existing 0.700 in 2hmaA Skipped atom 410, because occupancy 0.300 <= existing 0.700 in 2hmaA Skipped atom 412, because occupancy 0.300 <= existing 0.700 in 2hmaA Skipped atom 461, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 463, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 465, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 467, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 469, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 471, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 473, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 475, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 477, because occupancy 0.400 <= existing 0.600 in 2hmaA 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 1044, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 1046, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 1048, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 1050, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 1052, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 1054, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 1056, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 1058, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 1060, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 1062, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 1064, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 1109, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1111, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1113, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1115, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1117, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1119, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1121, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1123, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1125, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1127, because occupancy 0.500 <= existing 0.500 in 2hmaA 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 1175, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1177, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1179, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1181, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1183, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1185, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1187, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1189, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1195, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1197, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1199, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1201, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1203, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1205, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1207, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1209, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1211, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1306, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1308, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1310, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1312, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1314, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1316, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1318, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1320, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1322, because occupancy 0.500 <= existing 0.500 in 2hmaA 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 1463, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1465, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1467, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1469, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1471, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1473, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1475, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1477, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1479, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1481, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1483, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 1651, because occupancy 0.200 <= existing 0.200 in 2hmaA Skipped atom 1653, because occupancy 0.300 <= existing 0.300 in 2hmaA Skipped atom 1655, because occupancy 0.200 <= existing 0.200 in 2hmaA Skipped atom 1657, because occupancy 0.300 <= existing 0.300 in 2hmaA Skipped atom 1659, because occupancy 0.200 <= existing 0.200 in 2hmaA Skipped atom 1661, because occupancy 0.300 <= existing 0.300 in 2hmaA Skipped atom 1663, because occupancy 0.200 <= existing 0.200 in 2hmaA Skipped atom 1665, because occupancy 0.300 <= existing 0.300 in 2hmaA Skipped atom 1667, because occupancy 0.200 <= existing 0.200 in 2hmaA Skipped atom 1669, because occupancy 0.300 <= existing 0.300 in 2hmaA Skipped atom 1671, because occupancy 0.200 <= existing 0.200 in 2hmaA Skipped atom 1673, because occupancy 0.300 <= existing 0.300 in 2hmaA Skipped atom 1675, because occupancy 0.200 <= existing 0.200 in 2hmaA Skipped atom 1677, because occupancy 0.300 <= existing 0.300 in 2hmaA Skipped atom 1679, because occupancy 0.200 <= existing 0.200 in 2hmaA Skipped atom 1681, because occupancy 0.300 <= existing 0.300 in 2hmaA Skipped atom 1683, because occupancy 0.200 <= existing 0.200 in 2hmaA Skipped atom 1685, because occupancy 0.300 <= existing 0.300 in 2hmaA Skipped atom 1757, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 1759, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 1761, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 1763, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 1765, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 1767, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 1769, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 1771, because occupancy 0.400 <= existing 0.600 in 2hmaA 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 1878, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 1880, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 1882, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 1884, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 1886, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 1888, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 1890, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 1892, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 1894, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 1896, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 1898, because occupancy 0.400 <= existing 0.600 in 2hmaA 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 1956, because occupancy 0.500 <= existing 0.500 in 2hmaA Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Skipped atom 1958, because occupancy 0.500 <= existing 0.500 in 2hmaA Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Skipped atom 1960, because occupancy 0.500 <= existing 0.500 in 2hmaA Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Skipped atom 1962, because occupancy 0.500 <= existing 0.500 in 2hmaA Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Skipped atom 1964, because occupancy 0.500 <= existing 0.500 in 2hmaA Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Bad short name: MSE for alphabet: ExtAA Replacing MSE with M Skipped atom 1966, because occupancy 0.500 <= existing 0.500 in 2hmaA 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 1970, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2275, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2277, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2279, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2281, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2283, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2285, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2287, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2289, because occupancy 0.500 <= existing 0.500 in 2hmaA 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 2354, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2356, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2358, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2360, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2362, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2364, because occupancy 0.500 <= existing 0.500 in 2hmaA 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 2559, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2561, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2563, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2565, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2567, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2569, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2571, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2573, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2575, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2577, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2579, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2671, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2673, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2675, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2677, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2679, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2681, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2683, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2685, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2687, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2745, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 2747, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 2749, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 2751, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 2753, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 2755, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 2757, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 2759, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 2761, because occupancy 0.400 <= existing 0.600 in 2hmaA Skipped atom 2977, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2979, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2981, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2983, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2985, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2987, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2989, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2991, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2993, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2995, because occupancy 0.500 <= existing 0.500 in 2hmaA Skipped atom 2997, because occupancy 0.500 <= existing 0.500 in 2hmaA Read 364 residues and 2867 atoms. # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # command:# Saving current conformation as real # command:# Prefix for output files set to decoys/ # command:# SetRealCost created real_cost = # ( 50.000 * real_hbond + 50.000 * real_hbond_u + 50.000 * decoy_hbond + 50.000 * decoy_hbond_u + 10.000 * real_NO_hbond + 10.000 * real_NO_hbond_u + 10.000 * decoy_NO_hbond + 10.000 * decoy_NO_hbond_u + 10.000 * knot + 200.000 * clens + 0.000 * rmsd + 35.000 * log_rmsd + 0.000 * rmsd_ca + 30.000 * log_rmsd_ca + 1.000 * GDT + 1.000 * smooth_GDT + 0.200 * missing_atoms ) # command:# SetCost created cost = # ) # command:# reading script from file anglevector.costfcn # Prefix for input files set to /projects/compbio/lib/alphabet/ # Read 2 alphabets from anglevector.alphabet # Prefix for input files set to # CreateCombinedNNet created CombinedNNet bys_t2k # CreateCombinedNNet created CombinedNNet bys_t04 # CreateCombinedNNet created CombinedNNet bys_t06 # CreateCombinedNNet created CombinedNNet bys_mean # created predicted AngleVectorPredCostFcn pred_bys_t2k # created predicted AngleVectorPredCostFcn pred_bys_t04 # created predicted AngleVectorPredCostFcn pred_bys_t06 # created predicted AngleVectorPredCostFcn pred_bys_mean # CreateCombinedNNet created CombinedNNet pb_t2k # CreateCombinedNNet created CombinedNNet pb_t04 # CreateCombinedNNet created CombinedNNet pb_t06 # CreateCombinedNNet created CombinedNNet pb_mean # created predicted AngleVectorPredCostFcn pred_pb_t2k # created predicted AngleVectorPredCostFcn pred_pb_t04 # created predicted AngleVectorPredCostFcn pred_pb_t06 # created predicted AngleVectorPredCostFcn pred_pb_mean # SetCost created cost = # ( 5.000 * bystroff + 5.000 * pred_bys_t2k + 5.000 * pred_bys_t04 + 5.000 * pred_bys_t06 + 5.000 * pred_bys_mean + 5.000 * pred_pb_t2k + 5.000 * pred_pb_t04 + 5.000 * pred_pb_t06 + 5.000 * pred_pb_mean ) # command:CPU_time= 10.041 sec, elapsed time= 10.396 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 371 # copying to AlignedFragments data structure # command:# fraction of real conformation used = 1.000 # GDT_score = -20.810 # GDT_score(maxd=8.000,maxw=2.900)= -20.794 # GDT_score(maxd=8.000,maxw=3.200)= -19.668 # GDT_score(maxd=8.000,maxw=3.500)= -18.678 # GDT_score(maxd=10.000,maxw=3.800)= -20.231 # GDT_score(maxd=10.000,maxw=4.000)= -19.587 # GDT_score(maxd=10.000,maxw=4.200)= -18.958 # GDT_score(maxd=12.000,maxw=4.300)= -20.754 # GDT_score(maxd=12.000,maxw=4.500)= -20.108 # GDT_score(maxd=12.000,maxw=4.700)= -19.501 # GDT_score(maxd=14.000,maxw=5.200)= -19.784 # GDT_score(maxd=14.000,maxw=5.500)= -18.928 # command:# Prefix for output files set to # command:Warning: Couldn't open file T0316.model1-real.pdb for output Error: Couldn't open file T0316.model1-real.pdb for output superimposing iter= 0 total_weight= 4323.000 rmsd (weighted)= 22.746 (unweighted)= 25.162 superimposing iter= 1 total_weight= 5555.537 rmsd (weighted)= 16.037 (unweighted)= 25.412 superimposing iter= 2 total_weight= 3575.248 rmsd (weighted)= 14.147 (unweighted)= 25.693 superimposing iter= 3 total_weight= 3307.666 rmsd (weighted)= 13.030 (unweighted)= 25.936 superimposing iter= 4 total_weight= 3148.302 rmsd (weighted)= 12.330 (unweighted)= 26.147 superimposing iter= 5 total_weight= 3037.636 rmsd (weighted)= 11.889 (unweighted)= 26.329 EXPDTA model1.ts-submitted MODEL 1 REMARK 44 REMARK 44 model 1 is called model1.ts-submitted ATOM 1 N MET A 1 28.976 13.855 19.542 1.00 0.00 ATOM 2 CA MET A 1 28.659 12.985 18.401 1.00 0.00 ATOM 3 CB MET A 1 29.816 12.029 18.116 1.00 0.00 ATOM 4 CG MET A 1 31.058 12.706 17.562 1.00 0.00 ATOM 5 SD MET A 1 30.759 13.523 15.983 1.00 0.00 ATOM 6 CE MET A 1 30.494 12.111 14.914 1.00 0.00 ATOM 7 O MET A 1 26.644 11.957 17.621 1.00 0.00 ATOM 8 C MET A 1 27.424 12.097 18.559 1.00 0.00 ATOM 9 N SER A 2 27.277 11.492 19.710 1.00 0.00 ATOM 10 CA SER A 2 26.125 10.611 19.941 1.00 0.00 ATOM 11 CB SER A 2 26.202 9.981 21.333 1.00 0.00 ATOM 12 OG SER A 2 26.064 10.964 22.345 1.00 0.00 ATOM 13 O SER A 2 23.811 10.781 19.260 1.00 0.00 ATOM 14 C SER A 2 24.788 11.330 19.751 1.00 0.00 ATOM 15 N ASP A 3 24.797 12.656 20.182 1.00 0.00 ATOM 16 CA ASP A 3 23.585 13.449 20.021 1.00 0.00 ATOM 17 CB ASP A 3 23.189 13.991 21.396 1.00 0.00 ATOM 18 CG ASP A 3 22.654 12.911 22.315 1.00 0.00 ATOM 19 OD1 ASP A 3 22.396 11.790 21.828 1.00 0.00 ATOM 20 OD2 ASP A 3 22.490 13.186 23.523 1.00 0.00 ATOM 21 O ASP A 3 24.816 15.334 19.199 1.00 0.00 ATOM 22 C ASP A 3 23.805 14.638 19.096 1.00 0.00 ATOM 23 N ASN A 4 22.869 14.797 18.119 1.00 0.00 ATOM 24 CA ASN A 4 22.958 15.903 17.168 1.00 0.00 ATOM 25 CB ASN A 4 21.730 15.935 16.254 1.00 0.00 ATOM 26 CG ASN A 4 21.805 17.042 15.220 1.00 0.00 ATOM 27 ND2 ASN A 4 22.701 16.888 14.254 1.00 0.00 ATOM 28 OD1 ASN A 4 21.061 18.020 15.291 1.00 0.00 ATOM 29 O ASN A 4 23.634 18.181 17.430 1.00 0.00 ATOM 30 C ASN A 4 23.049 17.222 17.927 1.00 0.00 ATOM 31 N SER A 5 22.476 17.257 19.164 1.00 0.00 ATOM 32 CA SER A 5 22.499 18.489 19.952 1.00 0.00 ATOM 33 CB SER A 5 21.420 18.379 21.032 1.00 0.00 ATOM 34 OG SER A 5 21.756 17.389 21.989 1.00 0.00 ATOM 35 O SER A 5 24.037 19.836 21.193 1.00 0.00 ATOM 36 C SER A 5 23.829 18.752 20.648 1.00 0.00 ATOM 37 N LYS A 6 24.712 17.758 20.663 1.00 0.00 ATOM 38 CA LYS A 6 26.004 17.875 21.338 1.00 0.00 ATOM 39 CB LYS A 6 26.423 16.529 21.932 1.00 0.00 ATOM 40 CG LYS A 6 25.510 16.029 23.039 1.00 0.00 ATOM 41 CD LYS A 6 25.980 14.687 23.579 1.00 0.00 ATOM 42 CE LYS A 6 25.038 14.162 24.650 1.00 0.00 ATOM 43 NZ LYS A 6 25.501 12.861 25.207 1.00 0.00 ATOM 44 O LYS A 6 28.310 18.378 20.767 1.00 0.00 ATOM 45 C LYS A 6 27.147 18.328 20.401 1.00 0.00 ATOM 46 N THR A 7 26.831 18.625 19.153 1.00 0.00 ATOM 47 CA THR A 7 27.853 19.031 18.183 1.00 0.00 ATOM 48 CB THR A 7 27.429 18.640 16.743 1.00 0.00 ATOM 49 CG2 THR A 7 28.350 19.282 15.725 1.00 0.00 ATOM 50 OG1 THR A 7 27.464 17.218 16.577 1.00 0.00 ATOM 51 O THR A 7 27.267 21.336 18.329 1.00 0.00 ATOM 52 C THR A 7 28.169 20.505 18.388 1.00 0.00 ATOM 53 N ARG A 8 29.448 20.809 18.615 1.00 0.00 ATOM 54 CA ARG A 8 29.905 22.164 18.947 1.00 0.00 ATOM 55 CB ARG A 8 30.635 22.121 20.299 1.00 0.00 ATOM 56 CG ARG A 8 29.697 21.708 21.416 1.00 0.00 ATOM 57 CD ARG A 8 30.396 21.407 22.730 1.00 0.00 ATOM 58 NE ARG A 8 29.672 22.060 23.842 1.00 0.00 ATOM 59 CZ ARG A 8 29.907 23.346 24.115 1.00 0.00 ATOM 60 NH1 ARG A 8 30.789 24.019 23.381 1.00 0.00 ATOM 61 NH2 ARG A 8 29.279 23.917 25.113 1.00 0.00 ATOM 62 O ARG A 8 31.498 22.180 17.140 1.00 0.00 ATOM 63 C ARG A 8 30.572 22.780 17.715 1.00 0.00 ATOM 64 N VAL A 9 30.113 23.965 17.317 1.00 0.00 ATOM 65 CA VAL A 9 30.781 24.707 16.238 1.00 0.00 ATOM 66 CB VAL A 9 29.829 24.969 15.057 1.00 0.00 ATOM 67 CG1 VAL A 9 30.527 25.787 13.979 1.00 0.00 ATOM 68 CG2 VAL A 9 29.368 23.656 14.442 1.00 0.00 ATOM 69 O VAL A 9 30.577 26.657 17.583 1.00 0.00 ATOM 70 C VAL A 9 31.267 26.037 16.790 1.00 0.00 ATOM 71 N VAL A 10 32.461 26.463 16.376 1.00 0.00 ATOM 72 CA VAL A 10 32.945 27.822 16.660 1.00 0.00 ATOM 73 CB VAL A 10 34.443 27.826 17.023 1.00 0.00 ATOM 74 CG1 VAL A 10 34.929 29.246 17.264 1.00 0.00 ATOM 75 CG2 VAL A 10 34.687 27.013 18.283 1.00 0.00 ATOM 76 O VAL A 10 33.209 28.250 14.308 1.00 0.00 ATOM 77 C VAL A 10 32.712 28.630 15.382 1.00 0.00 ATOM 78 N VAL A 11 31.904 29.650 15.500 1.00 0.00 ATOM 79 CA VAL A 11 31.507 30.468 14.367 1.00 0.00 ATOM 80 CB VAL A 11 29.985 30.699 14.341 1.00 0.00 ATOM 81 CG1 VAL A 11 29.598 31.586 13.169 1.00 0.00 ATOM 82 CG2 VAL A 11 29.249 29.372 14.204 1.00 0.00 ATOM 83 O VAL A 11 32.099 32.476 15.524 1.00 0.00 ATOM 84 C VAL A 11 32.204 31.818 14.496 1.00 0.00 ATOM 85 N GLY A 12 33.065 32.230 13.421 1.00 0.00 ATOM 86 CA GLY A 12 33.663 33.550 13.368 1.00 0.00 ATOM 87 O GLY A 12 31.475 34.044 12.565 1.00 0.00 ATOM 88 C GLY A 12 32.382 34.364 13.324 1.00 0.00 ATOM 89 N MET A 13 32.189 35.280 14.245 1.00 0.00 ATOM 90 CA MET A 13 30.996 36.117 14.294 1.00 0.00 ATOM 91 CB MET A 13 30.190 35.792 15.554 1.00 0.00 ATOM 92 CG MET A 13 28.896 36.576 15.683 1.00 0.00 ATOM 93 SD MET A 13 27.947 36.118 17.147 1.00 0.00 ATOM 94 CE MET A 13 27.257 34.549 16.629 1.00 0.00 ATOM 95 O MET A 13 32.046 38.060 15.204 1.00 0.00 ATOM 96 C MET A 13 31.324 37.613 14.315 1.00 0.00 ATOM 97 N SER A 14 30.829 38.353 13.333 1.00 0.00 ATOM 98 CA SER A 14 31.166 39.769 13.153 1.00 0.00 ATOM 99 CB SER A 14 31.404 40.080 11.674 1.00 0.00 ATOM 100 OG SER A 14 30.227 39.875 10.913 1.00 0.00 ATOM 101 O SER A 14 30.287 41.867 13.856 1.00 0.00 ATOM 102 C SER A 14 30.047 40.677 13.652 1.00 0.00 ATOM 103 N GLY A 15 28.847 40.133 13.786 1.00 0.00 ATOM 104 CA GLY A 15 27.681 40.924 14.243 1.00 0.00 ATOM 105 O GLY A 15 25.783 42.076 13.344 1.00 0.00 ATOM 106 C GLY A 15 26.841 41.494 13.114 1.00 0.00 ATOM 107 N GLY A 16 27.313 41.195 11.837 1.00 0.00 ATOM 108 CA GLY A 16 26.592 41.636 10.680 1.00 0.00 ATOM 109 O GLY A 16 25.319 39.626 10.944 1.00 0.00 ATOM 110 C GLY A 16 25.523 40.639 10.284 1.00 0.00 ATOM 111 N VAL A 17 24.856 40.944 9.181 1.00 0.00 ATOM 112 CA VAL A 17 23.666 40.195 8.801 1.00 0.00 ATOM 113 CB VAL A 17 22.984 40.808 7.564 1.00 0.00 ATOM 114 CG1 VAL A 17 21.860 39.908 7.077 1.00 0.00 ATOM 115 CG2 VAL A 17 22.398 42.170 7.900 1.00 0.00 ATOM 116 O VAL A 17 23.325 37.812 8.888 1.00 0.00 ATOM 117 C VAL A 17 24.009 38.749 8.456 1.00 0.00 ATOM 118 N ASP A 18 25.089 38.510 7.674 1.00 0.00 ATOM 119 CA ASP A 18 25.470 37.172 7.253 1.00 0.00 ATOM 120 CB ASP A 18 26.714 37.222 6.365 1.00 0.00 ATOM 121 CG ASP A 18 26.434 37.834 5.006 1.00 0.00 ATOM 122 OD1 ASP A 18 25.423 37.455 4.381 1.00 0.00 ATOM 123 OD2 ASP A 18 27.227 38.694 4.567 1.00 0.00 ATOM 124 O ASP A 18 25.280 35.116 8.499 1.00 0.00 ATOM 125 C ASP A 18 25.805 36.232 8.413 1.00 0.00 ATOM 126 N SER A 19 26.668 36.645 9.281 1.00 0.00 ATOM 127 CA SER A 19 27.041 35.821 10.429 1.00 0.00 ATOM 128 CB SER A 19 28.195 36.465 11.201 1.00 0.00 ATOM 129 OG SER A 19 27.793 37.688 11.793 1.00 0.00 ATOM 130 O SER A 19 25.787 34.573 12.080 1.00 0.00 ATOM 131 C SER A 19 25.892 35.624 11.419 1.00 0.00 ATOM 132 N SER A 20 25.025 36.653 11.598 1.00 0.00 ATOM 133 CA SER A 20 23.940 36.494 12.563 1.00 0.00 ATOM 134 CB SER A 20 23.164 37.803 12.716 1.00 0.00 ATOM 135 OG SER A 20 23.974 38.810 13.299 1.00 0.00 ATOM 136 O SER A 20 22.436 34.616 12.898 1.00 0.00 ATOM 137 C SER A 20 22.980 35.389 12.089 1.00 0.00 ATOM 138 N VAL A 21 22.693 35.389 10.786 1.00 0.00 ATOM 139 CA VAL A 21 21.876 34.348 10.176 1.00 0.00 ATOM 140 CB VAL A 21 21.654 34.609 8.676 1.00 0.00 ATOM 141 CG1 VAL A 21 20.960 33.421 8.024 1.00 0.00 ATOM 142 CG2 VAL A 21 20.787 35.842 8.471 1.00 0.00 ATOM 143 O VAL A 21 21.893 31.985 10.724 1.00 0.00 ATOM 144 C VAL A 21 22.528 32.988 10.349 1.00 0.00 ATOM 145 N THR A 22 23.839 32.919 10.105 1.00 0.00 ATOM 146 CA THR A 22 24.552 31.642 10.242 1.00 0.00 ATOM 147 CB THR A 22 26.027 31.745 9.815 1.00 0.00 ATOM 148 CG2 THR A 22 26.725 30.403 9.983 1.00 0.00 ATOM 149 OG1 THR A 22 26.105 32.136 8.439 1.00 0.00 ATOM 150 O THR A 22 24.392 29.903 11.885 1.00 0.00 ATOM 151 C THR A 22 24.539 31.115 11.654 1.00 0.00 ATOM 152 N ALA A 23 24.720 32.007 12.594 1.00 0.00 ATOM 153 CA ALA A 23 24.692 31.637 14.009 1.00 0.00 ATOM 154 CB ALA A 23 24.896 32.866 14.881 1.00 0.00 ATOM 155 O ALA A 23 23.262 29.934 14.920 1.00 0.00 ATOM 156 C ALA A 23 23.338 31.008 14.324 1.00 0.00 ATOM 157 N LEU A 24 22.245 31.669 13.886 1.00 0.00 ATOM 158 CA LEU A 24 20.895 31.175 14.123 1.00 0.00 ATOM 159 CB LEU A 24 19.861 32.162 13.579 1.00 0.00 ATOM 160 CG LEU A 24 18.392 31.764 13.743 1.00 0.00 ATOM 161 CD1 LEU A 24 18.032 31.630 15.216 1.00 0.00 ATOM 162 CD2 LEU A 24 17.478 32.810 13.124 1.00 0.00 ATOM 163 O LEU A 24 20.210 28.870 14.056 1.00 0.00 ATOM 164 C LEU A 24 20.668 29.829 13.431 1.00 0.00 ATOM 165 N LEU A 25 20.994 29.784 12.164 1.00 0.00 ATOM 166 CA LEU A 25 20.850 28.564 11.373 1.00 0.00 ATOM 167 CB LEU A 25 21.369 28.773 9.944 1.00 0.00 ATOM 168 CG LEU A 25 20.649 29.832 9.100 1.00 0.00 ATOM 169 CD1 LEU A 25 21.321 29.953 7.749 1.00 0.00 ATOM 170 CD2 LEU A 25 19.168 29.517 8.942 1.00 0.00 ATOM 171 O LEU A 25 21.024 26.264 12.053 1.00 0.00 ATOM 172 C LEU A 25 21.567 27.369 12.002 1.00 0.00 ATOM 173 N LEU A 26 22.782 27.591 12.474 1.00 0.00 ATOM 174 CA LEU A 26 23.549 26.515 13.093 1.00 0.00 ATOM 175 CB LEU A 26 24.973 26.920 13.344 1.00 0.00 ATOM 176 CG LEU A 26 25.740 27.160 12.044 1.00 0.00 ATOM 177 CD1 LEU A 26 27.157 27.620 12.428 1.00 0.00 ATOM 178 CD2 LEU A 26 25.851 25.901 11.234 1.00 0.00 ATOM 179 O LEU A 26 22.857 24.898 14.725 1.00 0.00 ATOM 180 C LEU A 26 22.847 26.089 14.378 1.00 0.00 ATOM 181 N LYS A 27 22.279 27.044 15.081 1.00 0.00 ATOM 182 CA LYS A 27 21.528 26.689 16.268 1.00 0.00 ATOM 183 CB LYS A 27 20.984 27.959 16.924 1.00 0.00 ATOM 184 CG LYS A 27 20.111 27.705 18.142 1.00 0.00 ATOM 185 CD LYS A 27 19.667 29.009 18.785 1.00 0.00 ATOM 186 CE LYS A 27 18.755 28.754 19.973 1.00 0.00 ATOM 187 NZ LYS A 27 18.290 30.024 20.598 1.00 0.00 ATOM 188 O LYS A 27 20.071 24.813 16.466 1.00 0.00 ATOM 189 C LYS A 27 20.322 25.832 15.847 1.00 0.00 ATOM 190 N GLU A 28 19.637 26.236 14.773 1.00 0.00 ATOM 191 CA GLU A 28 18.426 25.551 14.271 1.00 0.00 ATOM 192 CB GLU A 28 17.785 26.358 13.139 1.00 0.00 ATOM 193 CG GLU A 28 17.140 27.658 13.594 1.00 0.00 ATOM 194 CD GLU A 28 16.596 28.474 12.437 1.00 0.00 ATOM 195 OE1 GLU A 28 16.780 28.052 11.275 1.00 0.00 ATOM 196 OE2 GLU A 28 15.988 29.533 12.691 1.00 0.00 ATOM 197 O GLU A 28 17.835 23.289 13.709 1.00 0.00 ATOM 198 C GLU A 28 18.725 24.158 13.722 1.00 0.00 ATOM 199 N GLN A 29 19.963 23.953 13.257 1.00 0.00 ATOM 200 CA GLN A 29 20.450 22.626 12.829 1.00 0.00 ATOM 201 CB GLN A 29 21.593 22.774 11.823 1.00 0.00 ATOM 202 CG GLN A 29 21.171 23.366 10.487 1.00 0.00 ATOM 203 CD GLN A 29 22.346 23.616 9.564 1.00 0.00 ATOM 204 OE1 GLN A 29 23.445 23.109 9.789 1.00 0.00 ATOM 205 NE2 GLN A 29 22.119 24.406 8.520 1.00 0.00 ATOM 206 O GLN A 29 21.547 20.783 13.904 1.00 0.00 ATOM 207 C GLN A 29 20.954 21.860 14.049 1.00 0.00 ATOM 208 N GLY A 30 20.726 22.465 15.157 1.00 0.00 ATOM 209 CA GLY A 30 21.032 21.820 16.414 1.00 0.00 ATOM 210 O GLY A 30 22.747 21.036 17.873 1.00 0.00 ATOM 211 C GLY A 30 22.458 21.785 16.941 1.00 0.00 ATOM 212 N TYR A 31 23.338 22.548 16.353 1.00 0.00 ATOM 213 CA TYR A 31 24.727 22.585 16.809 1.00 0.00 ATOM 214 CB TYR A 31 25.681 22.714 15.620 1.00 0.00 ATOM 215 CG TYR A 31 25.678 21.514 14.699 1.00 0.00 ATOM 216 CD1 TYR A 31 25.339 20.256 15.173 1.00 0.00 ATOM 217 CD2 TYR A 31 26.015 21.647 13.357 1.00 0.00 ATOM 218 CE1 TYR A 31 25.333 19.154 14.337 1.00 0.00 ATOM 219 CE2 TYR A 31 26.013 20.559 12.507 1.00 0.00 ATOM 220 CZ TYR A 31 25.670 19.303 13.011 1.00 0.00 ATOM 221 OH TYR A 31 25.665 18.208 12.176 1.00 0.00 ATOM 222 O TYR A 31 24.137 24.779 17.589 1.00 0.00 ATOM 223 C TYR A 31 24.865 23.788 17.725 1.00 0.00 ATOM 224 N ASP A 32 25.786 23.685 18.675 1.00 0.00 ATOM 225 CA ASP A 32 26.052 24.777 19.601 1.00 0.00 ATOM 226 CB ASP A 32 26.862 24.277 20.798 1.00 0.00 ATOM 227 CG ASP A 32 26.080 23.313 21.669 1.00 0.00 ATOM 228 OD1 ASP A 32 24.920 23.627 22.012 1.00 0.00 ATOM 229 OD2 ASP A 32 26.627 22.242 22.009 1.00 0.00 ATOM 230 O ASP A 32 27.716 25.590 18.066 1.00 0.00 ATOM 231 C ASP A 32 26.843 25.869 18.890 1.00 0.00 ATOM 232 N VAL A 33 26.544 27.111 19.236 1.00 0.00 ATOM 233 CA VAL A 33 27.289 28.240 18.701 1.00 0.00 ATOM 234 CB VAL A 33 26.350 29.381 18.269 1.00 0.00 ATOM 235 CG1 VAL A 33 27.155 30.562 17.747 1.00 0.00 ATOM 236 CG2 VAL A 33 25.414 28.910 17.167 1.00 0.00 ATOM 237 O VAL A 33 27.896 29.489 20.642 1.00 0.00 ATOM 238 C VAL A 33 28.304 28.932 19.615 1.00 0.00 ATOM 239 N ILE A 34 29.521 28.722 19.318 1.00 0.00 ATOM 240 CA ILE A 34 30.548 29.292 20.206 1.00 0.00 ATOM 241 CB ILE A 34 31.629 28.253 20.591 1.00 0.00 ATOM 242 CG1 ILE A 34 30.960 27.113 21.371 1.00 0.00 ATOM 243 CG2 ILE A 34 32.797 28.925 21.358 1.00 0.00 ATOM 244 CD1 ILE A 34 31.861 25.878 21.624 1.00 0.00 ATOM 245 O ILE A 34 31.680 30.139 18.300 1.00 0.00 ATOM 246 C ILE A 34 30.997 30.419 19.297 1.00 0.00 ATOM 247 N GLY A 35 30.501 31.704 19.536 1.00 0.00 ATOM 248 CA GLY A 35 30.867 32.839 18.657 1.00 0.00 ATOM 249 O GLY A 35 32.372 33.847 20.236 1.00 0.00 ATOM 250 C GLY A 35 32.200 33.454 19.081 1.00 0.00 ATOM 251 N ILE A 36 33.140 33.542 18.133 1.00 0.00 ATOM 252 CA ILE A 36 34.463 34.120 18.383 1.00 0.00 ATOM 253 CB ILE A 36 35.594 33.234 17.824 1.00 0.00 ATOM 254 CG1 ILE A 36 35.746 32.001 18.717 1.00 0.00 ATOM 255 CG2 ILE A 36 36.899 34.032 17.776 1.00 0.00 ATOM 256 CD1 ILE A 36 36.744 30.974 18.188 1.00 0.00 ATOM 257 O ILE A 36 33.993 35.458 16.437 1.00 0.00 ATOM 258 C ILE A 36 34.365 35.430 17.608 1.00 0.00 ATOM 259 N PHE A 37 34.688 36.525 18.292 1.00 0.00 ATOM 260 CA PHE A 37 34.770 37.853 17.716 1.00 0.00 ATOM 261 CB PHE A 37 33.706 38.619 17.605 1.00 0.00 ATOM 262 CG PHE A 37 34.057 40.023 17.212 1.00 0.00 ATOM 263 CD1 PHE A 37 34.470 40.311 15.914 1.00 0.00 ATOM 264 CD2 PHE A 37 34.016 41.050 18.145 1.00 0.00 ATOM 265 CE1 PHE A 37 34.839 41.603 15.552 1.00 0.00 ATOM 266 CE2 PHE A 37 34.383 42.350 17.793 1.00 0.00 ATOM 267 CZ PHE A 37 34.797 42.626 16.492 1.00 0.00 ATOM 268 O PHE A 37 36.771 38.217 18.984 1.00 0.00 ATOM 269 C PHE A 37 36.230 38.221 17.879 1.00 0.00 ATOM 270 N MET A 38 36.880 38.560 16.802 1.00 0.00 ATOM 271 CA MET A 38 38.252 39.035 16.879 1.00 0.00 ATOM 272 CB MET A 38 39.070 38.339 15.788 1.00 0.00 ATOM 273 CG MET A 38 39.189 36.833 15.968 1.00 0.00 ATOM 274 SD MET A 38 40.141 36.050 14.651 1.00 0.00 ATOM 275 CE MET A 38 38.901 35.930 13.364 1.00 0.00 ATOM 276 O MET A 38 37.917 41.000 15.586 1.00 0.00 ATOM 277 C MET A 38 38.283 40.523 16.670 1.00 0.00 ATOM 278 N LYS A 39 38.772 41.241 17.667 1.00 0.00 ATOM 279 CA LYS A 39 38.995 42.659 17.593 1.00 0.00 ATOM 280 CB LYS A 39 38.827 43.301 18.971 1.00 0.00 ATOM 281 CG LYS A 39 37.419 43.198 19.539 1.00 0.00 ATOM 282 CD LYS A 39 37.340 43.796 20.934 1.00 0.00 ATOM 283 CE LYS A 39 35.922 43.740 21.478 1.00 0.00 ATOM 284 NZ LYS A 39 35.803 44.436 22.788 1.00 0.00 ATOM 285 O LYS A 39 41.381 42.696 17.845 1.00 0.00 ATOM 286 C LYS A 39 40.396 42.867 17.091 1.00 0.00 ATOM 287 N ASN A 40 40.491 43.200 15.792 1.00 0.00 ATOM 288 CA ASN A 40 41.786 43.514 15.175 1.00 0.00 ATOM 289 CB ASN A 40 41.871 42.927 13.764 1.00 0.00 ATOM 290 CG ASN A 40 41.888 41.412 13.763 1.00 0.00 ATOM 291 ND2 ASN A 40 41.463 40.816 12.655 1.00 0.00 ATOM 292 OD1 ASN A 40 42.278 40.785 14.749 1.00 0.00 ATOM 293 O ASN A 40 43.380 45.215 14.735 1.00 0.00 ATOM 294 C ASN A 40 42.205 44.954 14.969 1.00 0.00 ATOM 295 N TRP A 41 41.153 45.840 14.761 1.00 0.00 ATOM 296 CA TRP A 41 41.410 47.234 14.550 1.00 0.00 ATOM 297 CB TRP A 41 41.122 47.617 13.098 1.00 0.00 ATOM 298 CG TRP A 41 39.698 47.399 12.690 1.00 0.00 ATOM 299 CD1 TRP A 41 38.665 48.286 12.808 1.00 0.00 ATOM 300 CD2 TRP A 41 39.147 46.216 12.096 1.00 0.00 ATOM 301 CE2 TRP A 41 37.775 46.457 11.883 1.00 0.00 ATOM 302 CE3 TRP A 41 39.680 44.979 11.726 1.00 0.00 ATOM 303 NE1 TRP A 41 37.506 47.728 12.327 1.00 0.00 ATOM 304 CZ2 TRP A 41 36.930 45.506 11.316 1.00 0.00 ATOM 305 CZ3 TRP A 41 38.838 44.037 11.163 1.00 0.00 ATOM 306 CH2 TRP A 41 37.478 44.305 10.961 1.00 0.00 ATOM 307 O TRP A 41 40.990 49.537 14.820 1.00 0.00 ATOM 308 C TRP A 41 40.761 48.414 15.220 1.00 0.00 ATOM 309 N ASP A 42 39.929 48.170 16.223 1.00 0.00 ATOM 310 CA ASP A 42 39.347 49.289 16.975 1.00 0.00 ATOM 311 CB ASP A 42 38.791 48.918 18.170 1.00 0.00 ATOM 312 CG ASP A 42 38.989 47.585 18.870 1.00 0.00 ATOM 313 OD1 ASP A 42 39.901 46.823 18.483 1.00 0.00 ATOM 314 OD2 ASP A 42 38.228 47.301 19.818 1.00 0.00 ATOM 315 O ASP A 42 41.473 49.553 18.097 1.00 0.00 ATOM 316 C ASP A 42 40.449 50.089 17.696 1.00 0.00 ATOM 317 N ASP A 43 40.095 51.449 17.770 1.00 0.00 ATOM 318 CA ASP A 43 41.057 52.322 18.426 1.00 0.00 ATOM 319 CB ASP A 43 40.626 53.785 18.305 1.00 0.00 ATOM 320 CG ASP A 43 40.807 54.331 16.902 1.00 0.00 ATOM 321 OD1 ASP A 43 41.490 53.671 16.092 1.00 0.00 ATOM 322 OD2 ASP A 43 40.268 55.420 16.614 1.00 0.00 ATOM 323 O ASP A 43 42.333 52.176 20.451 1.00 0.00 ATOM 324 C ASP A 43 41.232 52.044 19.914 1.00 0.00 ATOM 325 N THR A 44 40.152 51.682 20.583 1.00 0.00 ATOM 326 CA THR A 44 40.182 51.387 22.008 1.00 0.00 ATOM 327 CB THR A 44 40.192 52.675 22.851 1.00 0.00 ATOM 328 CG2 THR A 44 38.841 53.371 22.778 1.00 0.00 ATOM 329 OG1 THR A 44 40.476 52.354 24.218 1.00 0.00 ATOM 330 O THR A 44 38.123 50.262 21.552 1.00 0.00 ATOM 331 C THR A 44 38.960 50.579 22.392 1.00 0.00 ATOM 332 N ASP A 45 38.899 50.192 23.654 1.00 0.00 ATOM 333 CA ASP A 45 37.771 49.430 24.159 1.00 0.00 ATOM 334 CB ASP A 45 38.245 48.367 25.152 1.00 0.00 ATOM 335 CG ASP A 45 39.035 47.257 24.486 1.00 0.00 ATOM 336 OD1 ASP A 45 39.000 47.167 23.242 1.00 0.00 ATOM 337 OD2 ASP A 45 39.689 46.478 25.212 1.00 0.00 ATOM 338 O ASP A 45 37.455 51.418 25.429 1.00 0.00 ATOM 339 C ASP A 45 36.918 50.501 24.818 1.00 0.00 ATOM 340 N GLU A 46 35.608 50.434 24.675 1.00 0.00 ATOM 341 CA GLU A 46 34.727 51.439 25.272 1.00 0.00 ATOM 342 CB GLU A 46 34.738 51.322 26.796 1.00 0.00 ATOM 343 CG GLU A 46 34.208 49.999 27.322 1.00 0.00 ATOM 344 CD GLU A 46 34.208 49.931 28.836 1.00 0.00 ATOM 345 OE1 GLU A 46 34.680 50.894 29.474 1.00 0.00 ATOM 346 OE2 GLU A 46 33.736 48.913 29.385 1.00 0.00 ATOM 347 O GLU A 46 35.107 53.751 25.780 1.00 0.00 ATOM 348 C GLU A 46 35.142 52.866 24.926 1.00 0.00 ATOM 349 N ASN A 47 35.663 53.140 23.654 1.00 0.00 ATOM 350 CA ASN A 47 36.094 54.472 23.247 1.00 0.00 ATOM 351 CB ASN A 47 37.173 54.373 22.167 1.00 0.00 ATOM 352 CG ASN A 47 37.655 55.734 21.700 1.00 0.00 ATOM 353 ND2 ASN A 47 38.407 56.419 22.553 1.00 0.00 ATOM 354 OD1 ASN A 47 37.354 56.158 20.585 1.00 0.00 ATOM 355 O ASN A 47 34.804 56.460 22.943 1.00 0.00 ATOM 356 C ASN A 47 34.929 55.264 22.682 1.00 0.00 ATOM 357 N GLY A 48 34.069 54.623 21.903 1.00 0.00 ATOM 358 CA GLY A 48 32.966 55.280 21.271 1.00 0.00 ATOM 359 O GLY A 48 32.263 56.063 19.165 1.00 0.00 ATOM 360 C GLY A 48 33.124 55.480 19.789 1.00 0.00 ATOM 361 N VAL A 49 34.210 54.980 19.215 1.00 0.00 ATOM 362 CA VAL A 49 34.364 55.058 17.758 1.00 0.00 ATOM 363 CB VAL A 49 35.763 54.588 17.313 1.00 0.00 ATOM 364 CG1 VAL A 49 35.850 54.541 15.797 1.00 0.00 ATOM 365 CG2 VAL A 49 36.833 55.539 17.829 1.00 0.00 ATOM 366 O VAL A 49 32.998 53.076 17.613 1.00 0.00 ATOM 367 C VAL A 49 33.309 54.165 17.116 1.00 0.00 ATOM 368 N CYS A 50 32.779 54.688 15.977 1.00 0.00 ATOM 369 CA CYS A 50 31.715 53.991 15.265 1.00 0.00 ATOM 370 CB CYS A 50 30.902 54.974 14.422 1.00 0.00 ATOM 371 SG CYS A 50 29.967 56.187 15.381 1.00 0.00 ATOM 372 O CYS A 50 32.031 52.986 13.128 1.00 0.00 ATOM 373 C CYS A 50 32.245 52.937 14.343 1.00 0.00 ATOM 374 N THR A 51 32.961 51.990 14.930 1.00 0.00 ATOM 375 CA THR A 51 33.638 50.927 14.205 1.00 0.00 ATOM 376 CB THR A 51 34.988 50.624 14.856 1.00 0.00 ATOM 377 CG2 THR A 51 35.702 49.506 14.104 1.00 0.00 ATOM 378 OG1 THR A 51 35.840 51.756 14.661 1.00 0.00 ATOM 379 O THR A 51 32.260 49.375 15.404 1.00 0.00 ATOM 380 C THR A 51 32.981 49.564 14.429 1.00 0.00 ATOM 381 N ALA A 52 33.189 48.626 13.423 1.00 0.00 ATOM 382 CA ALA A 52 32.534 47.318 13.521 1.00 0.00 ATOM 383 CB ALA A 52 32.840 46.478 12.291 1.00 0.00 ATOM 384 O ALA A 52 32.302 46.039 15.541 1.00 0.00 ATOM 385 C ALA A 52 33.069 46.623 14.770 1.00 0.00 ATOM 386 N THR A 53 34.381 46.686 14.958 1.00 0.00 ATOM 387 CA THR A 53 35.021 46.062 16.120 1.00 0.00 ATOM 388 CB THR A 53 36.555 46.170 16.047 1.00 0.00 ATOM 389 CG2 THR A 53 37.193 45.550 17.281 1.00 0.00 ATOM 390 OG1 THR A 53 37.030 45.480 14.884 1.00 0.00 ATOM 391 O THR A 53 34.254 46.045 18.399 1.00 0.00 ATOM 392 C THR A 53 34.579 46.721 17.419 1.00 0.00 ATOM 393 N GLU A 54 34.514 48.055 17.411 1.00 0.00 ATOM 394 CA GLU A 54 33.964 48.782 18.568 1.00 0.00 ATOM 395 CB GLU A 54 33.976 50.241 18.346 1.00 0.00 ATOM 396 CG GLU A 54 33.196 50.941 19.447 1.00 0.00 ATOM 397 CD GLU A 54 34.123 51.659 20.367 1.00 0.00 ATOM 398 OE1 GLU A 54 35.178 52.102 19.713 1.00 0.00 ATOM 399 OE2 GLU A 54 33.925 51.791 21.567 1.00 0.00 ATOM 400 O GLU A 54 32.025 48.620 19.958 1.00 0.00 ATOM 401 C GLU A 54 32.500 48.463 18.825 1.00 0.00 ATOM 402 N ASP A 55 31.718 48.100 17.748 1.00 0.00 ATOM 403 CA ASP A 55 30.309 47.769 17.898 1.00 0.00 ATOM 404 CB ASP A 55 29.640 47.661 16.525 1.00 0.00 ATOM 405 CG ASP A 55 29.397 49.013 15.889 1.00 0.00 ATOM 406 OD1 ASP A 55 29.515 50.035 16.596 1.00 0.00 ATOM 407 OD2 ASP A 55 29.090 49.053 14.677 1.00 0.00 ATOM 408 O ASP A 55 29.404 45.663 18.589 1.00 0.00 ATOM 409 C ASP A 55 30.374 46.415 18.597 1.00 0.00 ATOM 410 N TYR A 56 31.589 46.102 19.214 1.00 0.00 ATOM 411 CA TYR A 56 31.797 44.843 19.911 1.00 0.00 ATOM 412 CB TYR A 56 33.187 44.810 20.552 1.00 0.00 ATOM 413 CG TYR A 56 33.324 45.702 21.764 1.00 0.00 ATOM 414 CD1 TYR A 56 33.063 45.213 23.037 1.00 0.00 ATOM 415 CD2 TYR A 56 33.713 47.029 21.632 1.00 0.00 ATOM 416 CE1 TYR A 56 33.187 46.021 24.153 1.00 0.00 ATOM 417 CE2 TYR A 56 33.841 47.851 22.735 1.00 0.00 ATOM 418 CZ TYR A 56 33.574 47.335 24.002 1.00 0.00 ATOM 419 OH TYR A 56 33.695 48.141 25.111 1.00 0.00 ATOM 420 O TYR A 56 30.438 43.323 21.157 1.00 0.00 ATOM 421 C TYR A 56 30.787 44.490 20.989 1.00 0.00 ATOM 422 N LYS A 57 30.319 45.461 21.738 1.00 0.00 ATOM 423 CA LYS A 57 29.332 45.206 22.779 1.00 0.00 ATOM 424 CB LYS A 57 28.937 46.464 23.554 1.00 0.00 ATOM 425 CG LYS A 57 30.015 46.980 24.492 1.00 0.00 ATOM 426 CD LYS A 57 29.555 48.226 25.231 1.00 0.00 ATOM 427 CE LYS A 57 30.644 48.757 26.150 1.00 0.00 ATOM 428 NZ LYS A 57 30.218 49.997 26.856 1.00 0.00 ATOM 429 O LYS A 57 27.449 43.702 22.681 1.00 0.00 ATOM 430 C LYS A 57 28.063 44.635 22.164 1.00 0.00 ATOM 431 N ASP A 58 27.647 45.217 21.045 1.00 0.00 ATOM 432 CA ASP A 58 26.407 44.803 20.401 1.00 0.00 ATOM 433 CB ASP A 58 26.054 45.755 19.257 1.00 0.00 ATOM 434 CG ASP A 58 25.562 47.101 19.750 1.00 0.00 ATOM 435 OD1 ASP A 58 25.261 47.217 20.957 1.00 0.00 ATOM 436 OD2 ASP A 58 25.480 48.039 18.931 1.00 0.00 ATOM 437 O ASP A 58 25.633 42.599 19.967 1.00 0.00 ATOM 438 C ASP A 58 26.523 43.408 19.828 1.00 0.00 ATOM 439 N VAL A 59 27.641 43.108 19.149 1.00 0.00 ATOM 440 CA VAL A 59 27.777 41.758 18.598 1.00 0.00 ATOM 441 CB VAL A 59 29.060 41.616 17.758 1.00 0.00 ATOM 442 CG1 VAL A 59 29.282 40.165 17.364 1.00 0.00 ATOM 443 CG2 VAL A 59 28.959 42.451 16.489 1.00 0.00 ATOM 444 O VAL A 59 27.352 39.611 19.497 1.00 0.00 ATOM 445 C VAL A 59 27.839 40.730 19.702 1.00 0.00 ATOM 446 N VAL A 60 28.422 41.060 20.836 1.00 0.00 ATOM 447 CA VAL A 60 28.489 40.119 21.953 1.00 0.00 ATOM 448 CB VAL A 60 29.342 40.676 23.110 1.00 0.00 ATOM 449 CG1 VAL A 60 29.239 39.772 24.329 1.00 0.00 ATOM 450 CG2 VAL A 60 30.804 40.766 22.700 1.00 0.00 ATOM 451 O VAL A 60 26.732 38.696 22.773 1.00 0.00 ATOM 452 C VAL A 60 27.099 39.843 22.485 1.00 0.00 ATOM 453 N ALA A 61 26.244 40.847 22.590 1.00 0.00 ATOM 454 CA ALA A 61 24.814 40.624 22.886 1.00 0.00 ATOM 455 CB ALA A 61 24.079 41.951 22.981 1.00 0.00 ATOM 456 O ALA A 61 23.307 38.912 22.088 1.00 0.00 ATOM 457 C ALA A 61 24.125 39.798 21.803 1.00 0.00 ATOM 458 N VAL A 62 24.453 40.084 20.522 1.00 0.00 ATOM 459 CA VAL A 62 23.884 39.323 19.420 1.00 0.00 ATOM 460 CB VAL A 62 24.425 39.806 18.060 1.00 0.00 ATOM 461 CG1 VAL A 62 23.986 38.868 16.947 1.00 0.00 ATOM 462 CG2 VAL A 62 23.904 41.201 17.747 1.00 0.00 ATOM 463 O VAL A 62 23.461 36.953 19.352 1.00 0.00 ATOM 464 C VAL A 62 24.264 37.854 19.610 1.00 0.00 ATOM 465 N ALA A 63 25.510 37.618 20.048 1.00 0.00 ATOM 466 CA ALA A 63 25.991 36.259 20.281 1.00 0.00 ATOM 467 CB ALA A 63 27.406 36.286 20.844 1.00 0.00 ATOM 468 O ALA A 63 24.708 34.391 21.077 1.00 0.00 ATOM 469 C ALA A 63 25.088 35.536 21.280 1.00 0.00 ATOM 470 N ASP A 64 24.780 36.212 22.383 1.00 0.00 ATOM 471 CA ASP A 64 23.928 35.627 23.427 1.00 0.00 ATOM 472 CB ASP A 64 23.871 36.544 24.650 1.00 0.00 ATOM 473 CG ASP A 64 25.161 36.537 25.444 1.00 0.00 ATOM 474 OD1 ASP A 64 26.006 35.651 25.199 1.00 0.00 ATOM 475 OD2 ASP A 64 25.330 37.420 26.312 1.00 0.00 ATOM 476 O ASP A 64 21.864 34.389 23.245 1.00 0.00 ATOM 477 C ASP A 64 22.489 35.411 22.939 1.00 0.00 ATOM 478 N GLN A 65 22.021 36.386 22.195 1.00 0.00 ATOM 479 CA GLN A 65 20.679 36.309 21.648 1.00 0.00 ATOM 480 CB GLN A 65 20.313 37.612 20.936 1.00 0.00 ATOM 481 CG GLN A 65 20.117 38.796 21.871 1.00 0.00 ATOM 482 CD GLN A 65 19.820 40.083 21.128 1.00 0.00 ATOM 483 OE1 GLN A 65 19.796 40.109 19.895 1.00 0.00 ATOM 484 NE2 GLN A 65 19.588 41.157 21.873 1.00 0.00 ATOM 485 O GLN A 65 19.537 34.483 20.507 1.00 0.00 ATOM 486 C GLN A 65 20.591 35.143 20.639 1.00 0.00 ATOM 487 N ILE A 66 21.699 34.896 19.936 1.00 0.00 ATOM 488 CA ILE A 66 21.745 33.905 18.891 1.00 0.00 ATOM 489 CB ILE A 66 22.853 34.219 17.869 1.00 0.00 ATOM 490 CG1 ILE A 66 22.572 33.508 16.543 1.00 0.00 ATOM 491 CG2 ILE A 66 24.205 33.751 18.389 1.00 0.00 ATOM 492 CD1 ILE A 66 21.391 34.076 15.785 1.00 0.00 ATOM 493 O ILE A 66 21.786 31.508 18.760 1.00 0.00 ATOM 494 C ILE A 66 22.019 32.504 19.449 1.00 0.00 ATOM 495 N GLY A 67 22.485 32.424 20.695 1.00 0.00 ATOM 496 CA GLY A 67 22.620 31.137 21.384 1.00 0.00 ATOM 497 O GLY A 67 24.083 29.758 22.705 1.00 0.00 ATOM 498 C GLY A 67 23.951 30.800 22.059 1.00 0.00 ATOM 499 N ILE A 68 24.995 31.680 21.966 1.00 0.00 ATOM 500 CA ILE A 68 26.315 31.359 22.486 1.00 0.00 ATOM 501 CB ILE A 68 27.366 32.430 22.079 1.00 0.00 ATOM 502 CG1 ILE A 68 26.941 33.789 22.629 1.00 0.00 ATOM 503 CG2 ILE A 68 27.521 32.483 20.564 1.00 0.00 ATOM 504 CD1 ILE A 68 27.971 34.873 22.417 1.00 0.00 ATOM 505 O ILE A 68 25.576 31.844 24.686 1.00 0.00 ATOM 506 C ILE A 68 26.274 31.143 23.976 1.00 0.00 ATOM 507 N PRO A 69 28.331 30.430 24.095 1.00 0.00 ATOM 508 CA PRO A 69 29.457 31.070 24.731 1.00 0.00 ATOM 509 CB PRO A 69 30.338 29.906 25.186 1.00 0.00 ATOM 510 CG PRO A 69 29.400 28.752 25.305 1.00 0.00 ATOM 511 CD PRO A 69 28.398 28.915 24.196 1.00 0.00 ATOM 512 O PRO A 69 30.096 31.589 22.501 1.00 0.00 ATOM 513 C PRO A 69 30.143 31.939 23.668 1.00 0.00 ATOM 514 N TYR A 70 30.696 33.074 24.081 1.00 0.00 ATOM 515 CA TYR A 70 31.344 34.027 23.178 1.00 0.00 ATOM 516 CB TYR A 70 30.566 35.344 23.170 1.00 0.00 ATOM 517 CG TYR A 70 31.155 36.398 22.261 1.00 0.00 ATOM 518 CD1 TYR A 70 31.017 36.306 20.881 1.00 0.00 ATOM 519 CD2 TYR A 70 31.851 37.483 22.782 1.00 0.00 ATOM 520 CE1 TYR A 70 31.553 37.263 20.041 1.00 0.00 ATOM 521 CE2 TYR A 70 32.392 38.449 21.958 1.00 0.00 ATOM 522 CZ TYR A 70 32.239 38.332 20.577 1.00 0.00 ATOM 523 OH TYR A 70 32.773 39.287 19.743 1.00 0.00 ATOM 524 O TYR A 70 33.000 34.584 24.804 1.00 0.00 ATOM 525 C TYR A 70 32.766 34.313 23.629 1.00 0.00 ATOM 526 N TYR A 71 33.726 34.233 22.699 1.00 0.00 ATOM 527 CA TYR A 71 35.096 34.651 22.950 1.00 0.00 ATOM 528 CB TYR A 71 36.070 33.526 22.595 1.00 0.00 ATOM 529 CG TYR A 71 35.917 32.290 23.451 1.00 0.00 ATOM 530 CD1 TYR A 71 35.084 31.252 23.058 1.00 0.00 ATOM 531 CD2 TYR A 71 36.608 32.166 24.649 1.00 0.00 ATOM 532 CE1 TYR A 71 34.939 30.117 23.833 1.00 0.00 ATOM 533 CE2 TYR A 71 36.477 31.039 25.439 1.00 0.00 ATOM 534 CZ TYR A 71 35.632 30.011 25.020 1.00 0.00 ATOM 535 OH TYR A 71 35.489 28.883 25.794 1.00 0.00 ATOM 536 O TYR A 71 35.549 35.813 20.930 1.00 0.00 ATOM 537 C TYR A 71 35.463 35.872 22.118 1.00 0.00 ATOM 538 N SER A 72 35.646 36.986 22.834 1.00 0.00 ATOM 539 CA SER A 72 36.026 38.256 22.233 1.00 0.00 ATOM 540 CB SER A 72 35.332 39.414 22.955 1.00 0.00 ATOM 541 OG SER A 72 35.724 40.662 22.407 1.00 0.00 ATOM 542 O SER A 72 38.014 38.262 23.571 1.00 0.00 ATOM 543 C SER A 72 37.546 38.239 22.433 1.00 0.00 ATOM 544 N VAL A 73 38.290 38.174 21.351 1.00 0.00 ATOM 545 CA VAL A 73 39.764 38.162 21.404 1.00 0.00 ATOM 546 CB VAL A 73 40.357 36.937 20.639 1.00 0.00 ATOM 547 CG1 VAL A 73 41.854 36.816 20.905 1.00 0.00 ATOM 548 CG2 VAL A 73 39.635 35.653 21.004 1.00 0.00 ATOM 549 O VAL A 73 40.093 39.877 19.753 1.00 0.00 ATOM 550 C VAL A 73 40.408 39.463 20.877 1.00 0.00 ATOM 551 N ASN A 74 41.219 40.126 21.704 1.00 0.00 ATOM 552 CA ASN A 74 41.901 41.339 21.300 1.00 0.00 ATOM 553 CB ASN A 74 42.203 42.215 22.518 1.00 0.00 ATOM 554 CG ASN A 74 42.814 43.549 22.139 1.00 0.00 ATOM 555 ND2 ASN A 74 42.736 44.515 23.048 1.00 0.00 ATOM 556 OD1 ASN A 74 43.350 43.709 21.042 1.00 0.00 ATOM 557 O ASN A 74 44.201 40.605 21.286 1.00 0.00 ATOM 558 C ASN A 74 43.195 40.915 20.625 1.00 0.00 ATOM 559 N PHE A 75 43.179 40.945 19.291 1.00 0.00 ATOM 560 CA PHE A 75 44.309 40.453 18.481 1.00 0.00 ATOM 561 CB PHE A 75 43.812 39.565 17.338 1.00 0.00 ATOM 562 CG PHE A 75 43.150 38.298 17.796 1.00 0.00 ATOM 563 CD1 PHE A 75 41.771 38.184 17.803 1.00 0.00 ATOM 564 CD2 PHE A 75 43.906 37.219 18.222 1.00 0.00 ATOM 565 CE1 PHE A 75 41.161 37.019 18.227 1.00 0.00 ATOM 566 CE2 PHE A 75 43.297 36.053 18.644 1.00 0.00 ATOM 567 CZ PHE A 75 41.929 35.951 18.648 1.00 0.00 ATOM 568 O PHE A 75 46.035 41.297 16.987 1.00 0.00 ATOM 569 C PHE A 75 45.139 41.582 17.839 1.00 0.00 ATOM 570 N GLU A 76 44.903 42.807 18.258 1.00 0.00 ATOM 571 CA GLU A 76 45.434 43.966 17.538 1.00 0.00 ATOM 572 CB GLU A 76 44.913 45.265 18.156 1.00 0.00 ATOM 573 CG GLU A 76 45.365 46.521 17.429 1.00 0.00 ATOM 574 CD GLU A 76 44.802 47.786 18.049 1.00 0.00 ATOM 575 OE1 GLU A 76 44.060 47.679 19.049 1.00 0.00 ATOM 576 OE2 GLU A 76 45.103 48.885 17.537 1.00 0.00 ATOM 577 O GLU A 76 47.624 44.123 16.584 1.00 0.00 ATOM 578 C GLU A 76 46.961 43.966 17.608 1.00 0.00 ATOM 579 N LYS A 77 47.508 43.774 18.792 1.00 0.00 ATOM 580 CA LYS A 77 48.959 43.768 18.957 1.00 0.00 ATOM 581 CB LYS A 77 49.332 43.525 20.421 1.00 0.00 ATOM 582 CG LYS A 77 50.828 43.544 20.691 1.00 0.00 ATOM 583 CD LYS A 77 51.123 43.367 22.172 1.00 0.00 ATOM 584 CE LYS A 77 52.618 43.337 22.437 1.00 0.00 ATOM 585 NZ LYS A 77 52.924 43.140 23.882 1.00 0.00 ATOM 586 O LYS A 77 50.611 42.929 17.429 1.00 0.00 ATOM 587 C LYS A 77 49.625 42.678 18.124 1.00 0.00 ATOM 588 N GLU A 78 49.079 41.494 18.220 1.00 0.00 ATOM 589 CA GLU A 78 49.628 40.380 17.454 1.00 0.00 ATOM 590 CB GLU A 78 48.865 39.092 17.762 1.00 0.00 ATOM 591 CG GLU A 78 49.116 38.538 19.156 1.00 0.00 ATOM 592 CD GLU A 78 48.251 37.334 19.467 1.00 0.00 ATOM 593 OE1 GLU A 78 47.403 36.975 18.625 1.00 0.00 ATOM 594 OE2 GLU A 78 48.420 36.746 20.557 1.00 0.00 ATOM 595 O GLU A 78 50.409 40.233 15.178 1.00 0.00 ATOM 596 C GLU A 78 49.502 40.600 15.939 1.00 0.00 ATOM 597 N TYR A 79 48.416 41.209 15.560 1.00 0.00 ATOM 598 CA TYR A 79 48.213 41.541 14.155 1.00 0.00 ATOM 599 CB TYR A 79 46.893 42.296 13.975 1.00 0.00 ATOM 600 CG TYR A 79 46.651 42.780 12.565 1.00 0.00 ATOM 601 CD1 TYR A 79 46.161 41.920 11.591 1.00 0.00 ATOM 602 CD2 TYR A 79 46.913 44.097 12.209 1.00 0.00 ATOM 603 CE1 TYR A 79 45.935 42.354 10.298 1.00 0.00 ATOM 604 CE2 TYR A 79 46.695 44.550 10.923 1.00 0.00 ATOM 605 CZ TYR A 79 46.203 43.665 9.965 1.00 0.00 ATOM 606 OH TYR A 79 45.981 44.100 8.679 1.00 0.00 ATOM 607 O TYR A 79 49.976 42.226 12.647 1.00 0.00 ATOM 608 C TYR A 79 49.364 42.461 13.683 1.00 0.00 ATOM 609 N TRP A 80 49.666 43.507 14.440 1.00 0.00 ATOM 610 CA TRP A 80 50.691 44.450 14.026 1.00 0.00 ATOM 611 CB TRP A 80 50.923 45.586 14.887 1.00 0.00 ATOM 612 CG TRP A 80 49.808 46.578 14.698 1.00 0.00 ATOM 613 CD1 TRP A 80 48.915 47.005 15.642 1.00 0.00 ATOM 614 CD2 TRP A 80 49.406 47.185 13.461 1.00 0.00 ATOM 615 CE2 TRP A 80 48.252 47.955 13.730 1.00 0.00 ATOM 616 CE3 TRP A 80 49.904 47.148 12.151 1.00 0.00 ATOM 617 NE1 TRP A 80 47.976 47.827 15.065 1.00 0.00 ATOM 618 CZ2 TRP A 80 47.586 48.682 12.734 1.00 0.00 ATOM 619 CZ3 TRP A 80 49.244 47.872 11.160 1.00 0.00 ATOM 620 CH2 TRP A 80 48.096 48.628 11.459 1.00 0.00 ATOM 621 O TRP A 80 52.734 43.723 13.010 1.00 0.00 ATOM 622 C TRP A 80 51.992 43.675 13.989 1.00 0.00 ATOM 623 N ASP A 81 52.353 43.039 15.108 1.00 0.00 ATOM 624 CA ASP A 81 53.736 42.525 15.208 1.00 0.00 ATOM 625 CB ASP A 81 54.075 42.169 16.656 1.00 0.00 ATOM 626 CG ASP A 81 54.284 43.395 17.524 1.00 0.00 ATOM 627 OD1 ASP A 81 54.410 44.504 16.964 1.00 0.00 ATOM 628 OD2 ASP A 81 54.324 43.247 18.764 1.00 0.00 ATOM 629 O ASP A 81 55.167 41.115 13.941 1.00 0.00 ATOM 630 C ASP A 81 54.031 41.289 14.412 1.00 0.00 ATOM 631 N ARG A 82 53.044 40.412 14.251 1.00 0.00 ATOM 632 CA ARG A 82 53.249 39.126 13.642 1.00 0.00 ATOM 633 CB ARG A 82 53.450 38.065 14.802 1.00 0.00 ATOM 634 CG ARG A 82 53.700 36.691 14.345 1.00 0.00 ATOM 635 CD ARG A 82 53.811 35.701 15.491 1.00 0.00 ATOM 636 NE ARG A 82 52.530 35.685 16.162 1.00 0.00 ATOM 637 CZ ARG A 82 52.264 36.146 17.374 1.00 0.00 ATOM 638 NH1 ARG A 82 53.228 36.675 18.186 1.00 0.00 ATOM 639 NH2 ARG A 82 50.965 36.064 17.750 1.00 0.00 ATOM 640 O ARG A 82 52.566 38.074 11.553 1.00 0.00 ATOM 641 C ARG A 82 52.466 39.054 12.310 1.00 0.00 ATOM 642 N VAL A 83 51.776 40.132 11.997 1.00 0.00 ATOM 643 CA VAL A 83 51.032 40.231 10.749 1.00 0.00 ATOM 644 CB VAL A 83 49.519 40.081 10.991 1.00 0.00 ATOM 645 CG1 VAL A 83 48.758 40.190 9.679 1.00 0.00 ATOM 646 CG2 VAL A 83 49.210 38.728 11.615 1.00 0.00 ATOM 647 O VAL A 83 50.891 42.623 10.625 1.00 0.00 ATOM 648 C VAL A 83 51.255 41.586 10.078 1.00 0.00 ATOM 649 N PHE A 84 51.891 41.570 8.900 1.00 0.00 ATOM 650 CA PHE A 84 52.127 42.775 8.177 1.00 0.00 ATOM 651 CB PHE A 84 53.617 43.131 8.199 1.00 0.00 ATOM 652 CG PHE A 84 54.121 43.507 9.559 1.00 0.00 ATOM 653 CD1 PHE A 84 54.183 44.843 9.947 1.00 0.00 ATOM 654 CD2 PHE A 84 54.548 42.531 10.455 1.00 0.00 ATOM 655 CE1 PHE A 84 54.665 45.201 11.204 1.00 0.00 ATOM 656 CE2 PHE A 84 55.030 42.875 11.713 1.00 0.00 ATOM 657 CZ PHE A 84 55.089 44.212 12.088 1.00 0.00 ATOM 658 O PHE A 84 52.055 41.478 6.169 1.00 0.00 ATOM 659 C PHE A 84 52.090 42.602 6.668 1.00 0.00 ATOM 660 N GLU A 85 52.295 43.733 5.858 1.00 0.00 ATOM 661 CA GLU A 85 52.326 43.650 4.400 1.00 0.00 ATOM 662 CB GLU A 85 52.257 45.050 3.782 1.00 0.00 ATOM 663 CG GLU A 85 50.910 45.732 3.945 1.00 0.00 ATOM 664 CD GLU A 85 50.914 47.159 3.431 1.00 0.00 ATOM 665 OE1 GLU A 85 51.991 47.637 3.015 1.00 0.00 ATOM 666 OE2 GLU A 85 49.841 47.798 3.445 1.00 0.00 ATOM 667 O GLU A 85 53.672 42.121 3.093 1.00 0.00 ATOM 668 C GLU A 85 53.628 42.975 3.983 1.00 0.00 ATOM 669 N TYR A 86 54.726 43.337 4.645 1.00 0.00 ATOM 670 CA TYR A 86 56.027 42.749 4.348 1.00 0.00 ATOM 671 CB TYR A 86 57.103 43.337 5.264 1.00 0.00 ATOM 672 CG TYR A 86 58.478 42.749 5.049 1.00 0.00 ATOM 673 CD1 TYR A 86 59.275 43.172 3.994 1.00 0.00 ATOM 674 CD2 TYR A 86 58.977 41.773 5.903 1.00 0.00 ATOM 675 CE1 TYR A 86 60.534 42.639 3.790 1.00 0.00 ATOM 676 CE2 TYR A 86 60.233 41.231 5.714 1.00 0.00 ATOM 677 CZ TYR A 86 61.012 41.673 4.646 1.00 0.00 ATOM 678 OH TYR A 86 62.265 41.143 4.446 1.00 0.00 ATOM 679 O TYR A 86 56.459 40.462 3.702 1.00 0.00 ATOM 680 C TYR A 86 56.015 41.236 4.551 1.00 0.00 ATOM 681 N PHE A 87 55.496 40.797 5.685 1.00 0.00 ATOM 682 CA PHE A 87 55.403 39.380 6.011 1.00 0.00 ATOM 683 CB PHE A 87 54.777 39.267 7.438 1.00 0.00 ATOM 684 CG PHE A 87 54.550 37.874 7.918 1.00 0.00 ATOM 685 CD1 PHE A 87 55.552 37.211 8.650 1.00 0.00 ATOM 686 CD2 PHE A 87 53.323 37.253 7.713 1.00 0.00 ATOM 687 CE1 PHE A 87 55.305 35.941 9.176 1.00 0.00 ATOM 688 CE2 PHE A 87 53.075 35.959 8.253 1.00 0.00 ATOM 689 CZ PHE A 87 54.058 35.324 8.972 1.00 0.00 ATOM 690 O PHE A 87 54.957 37.504 4.584 1.00 0.00 ATOM 691 C PHE A 87 54.566 38.591 5.013 1.00 0.00 ATOM 692 N LEU A 88 53.429 39.139 4.647 1.00 0.00 ATOM 693 CA LEU A 88 52.537 38.461 3.714 1.00 0.00 ATOM 694 CB LEU A 88 51.235 39.248 3.543 1.00 0.00 ATOM 695 CG LEU A 88 50.298 39.275 4.752 1.00 0.00 ATOM 696 CD1 LEU A 88 49.141 40.233 4.512 1.00 0.00 ATOM 697 CD2 LEU A 88 49.722 37.894 5.017 1.00 0.00 ATOM 698 O LEU A 88 52.800 37.208 1.698 1.00 0.00 ATOM 699 C LEU A 88 53.080 38.246 2.305 1.00 0.00 ATOM 700 N ALA A 89 53.852 39.199 1.817 1.00 0.00 ATOM 701 CA ALA A 89 54.485 39.045 0.521 1.00 0.00 ATOM 702 CB ALA A 89 55.311 40.253 0.113 1.00 0.00 ATOM 703 O ALA A 89 55.333 36.967 -0.336 1.00 0.00 ATOM 704 C ALA A 89 55.388 37.816 0.554 1.00 0.00 ATOM 705 N GLU A 90 56.216 37.715 1.581 1.00 0.00 ATOM 706 CA GLU A 90 57.123 36.581 1.699 1.00 0.00 ATOM 707 CB GLU A 90 58.115 36.803 2.842 1.00 0.00 ATOM 708 CG GLU A 90 59.143 37.891 2.568 1.00 0.00 ATOM 709 CD GLU A 90 60.030 38.168 3.767 1.00 0.00 ATOM 710 OE1 GLU A 90 59.794 37.562 4.834 1.00 0.00 ATOM 711 OE2 GLU A 90 60.960 38.992 3.640 1.00 0.00 ATOM 712 O GLU A 90 56.680 34.223 1.465 1.00 0.00 ATOM 713 C GLU A 90 56.361 35.293 1.991 1.00 0.00 ATOM 714 N TYR A 91 55.332 35.388 2.829 1.00 0.00 ATOM 715 CA TYR A 91 54.516 34.221 3.165 1.00 0.00 ATOM 716 CB TYR A 91 53.391 34.613 4.123 1.00 0.00 ATOM 717 CG TYR A 91 52.467 33.471 4.483 1.00 0.00 ATOM 718 CD1 TYR A 91 52.832 32.534 5.439 1.00 0.00 ATOM 719 CD2 TYR A 91 51.230 33.335 3.862 1.00 0.00 ATOM 720 CE1 TYR A 91 51.992 31.487 5.772 1.00 0.00 ATOM 721 CE2 TYR A 91 50.379 32.295 4.183 1.00 0.00 ATOM 722 CZ TYR A 91 50.771 31.369 5.147 1.00 0.00 ATOM 723 OH TYR A 91 49.934 30.327 5.477 1.00 0.00 ATOM 724 O TYR A 91 53.911 32.388 1.729 1.00 0.00 ATOM 725 C TYR A 91 53.868 33.602 1.929 1.00 0.00 ATOM 726 N ARG A 92 53.261 34.435 1.110 1.00 0.00 ATOM 727 CA ARG A 92 52.604 33.956 -0.097 1.00 0.00 ATOM 728 CB ARG A 92 51.933 35.116 -0.838 1.00 0.00 ATOM 729 CG ARG A 92 50.707 35.674 -0.136 1.00 0.00 ATOM 730 CD ARG A 92 50.142 36.873 -0.880 1.00 0.00 ATOM 731 NE ARG A 92 48.974 37.436 -0.205 1.00 0.00 ATOM 732 CZ ARG A 92 48.356 38.550 -0.586 1.00 0.00 ATOM 733 NH1 ARG A 92 47.304 38.986 0.089 1.00 0.00 ATOM 734 NH2 ARG A 92 48.798 39.226 -1.637 1.00 0.00 ATOM 735 O ARG A 92 53.175 32.333 -1.774 1.00 0.00 ATOM 736 C ARG A 92 53.562 33.244 -1.043 1.00 0.00 ATOM 737 N ALA A 93 54.815 33.694 -1.066 1.00 0.00 ATOM 738 CA ALA A 93 55.846 33.100 -1.915 1.00 0.00 ATOM 739 CB ALA A 93 56.929 34.121 -2.227 1.00 0.00 ATOM 740 O ALA A 93 57.337 31.236 -1.848 1.00 0.00 ATOM 741 C ALA A 93 56.472 31.878 -1.251 1.00 0.00 ATOM 742 N GLY A 94 56.049 31.540 0.013 1.00 0.00 ATOM 743 CA GLY A 94 56.572 30.404 0.757 1.00 0.00 ATOM 744 O GLY A 94 58.705 29.730 1.609 1.00 0.00 ATOM 745 C GLY A 94 57.970 30.669 1.292 1.00 0.00 ATOM 746 N ARG A 95 58.366 31.952 1.394 1.00 0.00 ATOM 747 CA ARG A 95 59.729 32.332 1.758 1.00 0.00 ATOM 748 CB ARG A 95 60.181 33.544 0.943 1.00 0.00 ATOM 749 CG ARG A 95 60.267 33.293 -0.553 1.00 0.00 ATOM 750 CD ARG A 95 60.621 34.562 -1.310 1.00 0.00 ATOM 751 NE ARG A 95 60.655 34.347 -2.753 1.00 0.00 ATOM 752 CZ ARG A 95 60.769 35.321 -3.652 1.00 0.00 ATOM 753 NH1 ARG A 95 60.789 35.031 -4.946 1.00 0.00 ATOM 754 NH2 ARG A 95 60.862 36.583 -3.252 1.00 0.00 ATOM 755 O ARG A 95 61.011 32.674 3.740 1.00 0.00 ATOM 756 C ARG A 95 59.902 32.697 3.233 1.00 0.00 ATOM 757 N THR A 96 58.786 33.136 4.022 1.00 0.00 ATOM 758 CA THR A 96 58.906 33.454 5.448 1.00 0.00 ATOM 759 CB THR A 96 57.534 33.833 6.035 1.00 0.00 ATOM 760 CG2 THR A 96 57.666 34.183 7.509 1.00 0.00 ATOM 761 OG1 THR A 96 57.007 34.966 5.335 1.00 0.00 ATOM 762 O THR A 96 58.886 31.075 5.780 1.00 0.00 ATOM 763 C THR A 96 59.429 32.160 6.048 1.00 0.00 ATOM 764 N PRO A 97 60.483 32.276 6.856 1.00 0.00 ATOM 765 CA PRO A 97 61.120 31.088 7.406 1.00 0.00 ATOM 766 CB PRO A 97 62.194 31.646 8.341 1.00 0.00 ATOM 767 CG PRO A 97 62.490 33.006 7.804 1.00 0.00 ATOM 768 CD PRO A 97 61.178 33.555 7.319 1.00 0.00 ATOM 769 O PRO A 97 59.252 30.789 8.895 1.00 0.00 ATOM 770 C PRO A 97 60.087 30.252 8.153 1.00 0.00 ATOM 771 N ASN A 98 60.132 28.944 7.939 1.00 0.00 ATOM 772 CA ASN A 98 59.171 28.025 8.571 1.00 0.00 ATOM 773 CB ASN A 98 59.495 26.576 8.208 1.00 0.00 ATOM 774 CG ASN A 98 59.148 26.243 6.769 1.00 0.00 ATOM 775 ND2 ASN A 98 59.749 25.180 6.248 1.00 0.00 ATOM 776 OD1 ASN A 98 58.351 26.935 6.138 1.00 0.00 ATOM 777 O ASN A 98 58.225 28.056 10.728 1.00 0.00 ATOM 778 C ASN A 98 59.250 28.197 10.078 1.00 0.00 ATOM 779 N PRO A 99 60.474 28.403 10.704 1.00 0.00 ATOM 780 CA PRO A 99 60.470 28.586 12.166 1.00 0.00 ATOM 781 CB PRO A 99 61.890 29.062 12.483 1.00 0.00 ATOM 782 CG PRO A 99 62.727 28.497 11.385 1.00 0.00 ATOM 783 CD PRO A 99 61.896 28.588 10.137 1.00 0.00 ATOM 784 O PRO A 99 59.125 29.530 13.905 1.00 0.00 ATOM 785 C PRO A 99 59.459 29.586 12.730 1.00 0.00 ATOM 786 N ASP A 100 59.026 30.531 11.903 1.00 0.00 ATOM 787 CA ASP A 100 58.040 31.550 12.333 1.00 0.00 ATOM 788 CB ASP A 100 57.926 32.657 11.282 1.00 0.00 ATOM 789 CG ASP A 100 59.141 33.564 11.258 1.00 0.00 ATOM 790 OD1 ASP A 100 59.954 33.494 12.202 1.00 0.00 ATOM 791 OD2 ASP A 100 59.278 34.347 10.293 1.00 0.00 ATOM 792 O ASP A 100 55.898 31.391 13.486 1.00 0.00 ATOM 793 C ASP A 100 56.660 30.994 12.558 1.00 0.00 ATOM 794 N VAL A 101 56.324 30.044 11.700 1.00 0.00 ATOM 795 CA VAL A 101 55.013 29.454 11.718 1.00 0.00 ATOM 796 CB VAL A 101 54.763 28.600 10.462 1.00 0.00 ATOM 797 CG1 VAL A 101 53.449 27.844 10.582 1.00 0.00 ATOM 798 CG2 VAL A 101 54.697 29.483 9.224 1.00 0.00 ATOM 799 O VAL A 101 53.653 28.400 13.366 1.00 0.00 ATOM 800 C VAL A 101 54.792 28.553 12.900 1.00 0.00 ATOM 801 N MET A 102 55.934 27.854 13.084 1.00 0.00 ATOM 802 CA MET A 102 55.855 26.959 14.253 1.00 0.00 ATOM 803 CB MET A 102 57.243 26.418 14.605 1.00 0.00 ATOM 804 CG MET A 102 57.805 25.440 13.588 1.00 0.00 ATOM 805 SD MET A 102 59.505 24.959 13.948 1.00 0.00 ATOM 806 CE MET A 102 59.289 24.092 15.501 1.00 0.00 ATOM 807 O MET A 102 54.361 27.289 16.154 1.00 0.00 ATOM 808 C MET A 102 55.310 27.727 15.477 1.00 0.00 ATOM 809 N CYS A 103 55.903 28.850 15.785 1.00 0.00 ATOM 810 CA CYS A 103 55.497 29.672 16.912 1.00 0.00 ATOM 811 CB CYS A 103 56.330 30.954 16.968 1.00 0.00 ATOM 812 SG CYS A 103 58.063 30.700 17.418 1.00 0.00 ATOM 813 O CYS A 103 53.281 30.058 17.814 1.00 0.00 ATOM 814 C CYS A 103 54.049 30.063 16.797 1.00 0.00 ATOM 815 N ASN A 104 53.591 30.472 15.547 1.00 0.00 ATOM 816 CA ASN A 104 52.217 30.872 15.327 1.00 0.00 ATOM 817 CB ASN A 104 51.989 31.222 13.855 1.00 0.00 ATOM 818 CG ASN A 104 52.621 32.544 13.465 1.00 0.00 ATOM 819 ND2 ASN A 104 52.832 32.737 12.169 1.00 0.00 ATOM 820 OD1 ASN A 104 52.914 33.378 14.322 1.00 0.00 ATOM 821 O ASN A 104 50.078 30.070 16.072 1.00 0.00 ATOM 822 C ASN A 104 51.217 29.782 15.708 1.00 0.00 ATOM 823 N LYS A 105 51.648 28.546 15.636 1.00 0.00 ATOM 824 CA LYS A 105 50.785 27.413 15.947 1.00 0.00 ATOM 825 CB LYS A 105 51.567 26.103 15.852 1.00 0.00 ATOM 826 CG LYS A 105 51.958 25.716 14.434 1.00 0.00 ATOM 827 CD LYS A 105 52.736 24.409 14.412 1.00 0.00 ATOM 828 CE LYS A 105 53.133 24.027 12.996 1.00 0.00 ATOM 829 NZ LYS A 105 53.922 22.765 12.962 1.00 0.00 ATOM 830 O LYS A 105 49.130 27.022 17.621 1.00 0.00 ATOM 831 C LYS A 105 50.212 27.519 17.353 1.00 0.00 ATOM 832 N GLU A 106 50.929 28.177 18.250 1.00 0.00 ATOM 833 CA GLU A 106 50.460 28.261 19.625 1.00 0.00 ATOM 834 CB GLU A 106 51.642 28.249 20.596 1.00 0.00 ATOM 835 CG GLU A 106 52.424 26.946 20.605 1.00 0.00 ATOM 836 CD GLU A 106 53.600 26.979 21.562 1.00 0.00 ATOM 837 OE1 GLU A 106 53.856 28.049 22.153 1.00 0.00 ATOM 838 OE2 GLU A 106 54.267 25.934 21.722 1.00 0.00 ATOM 839 O GLU A 106 49.122 29.566 21.102 1.00 0.00 ATOM 840 C GLU A 106 49.653 29.500 19.996 1.00 0.00 ATOM 841 N ILE A 107 49.570 30.482 19.110 1.00 0.00 ATOM 842 CA ILE A 107 48.830 31.692 19.465 1.00 0.00 ATOM 843 CB ILE A 107 49.728 32.942 19.405 1.00 0.00 ATOM 844 CG1 ILE A 107 50.887 32.814 20.397 1.00 0.00 ATOM 845 CG2 ILE A 107 48.928 34.188 19.756 1.00 0.00 ATOM 846 CD1 ILE A 107 51.942 33.890 20.246 1.00 0.00 ATOM 847 O ILE A 107 47.787 31.934 17.314 1.00 0.00 ATOM 848 C ILE A 107 47.624 31.983 18.530 1.00 0.00 ATOM 849 N LYS A 108 46.270 32.209 18.968 1.00 0.00 ATOM 850 CA LYS A 108 45.172 32.659 18.116 1.00 0.00 ATOM 851 CB LYS A 108 45.707 33.476 16.939 1.00 0.00 ATOM 852 CG LYS A 108 44.627 34.045 16.033 1.00 0.00 ATOM 853 CD LYS A 108 45.225 34.899 14.929 1.00 0.00 ATOM 854 CE LYS A 108 44.145 35.459 14.018 1.00 0.00 ATOM 855 NZ LYS A 108 44.715 36.298 12.927 1.00 0.00 ATOM 856 O LYS A 108 43.546 30.924 18.238 1.00 0.00 ATOM 857 C LYS A 108 44.535 31.353 17.662 1.00 0.00 ATOM 858 N PHE A 109 45.112 30.716 16.643 1.00 0.00 ATOM 859 CA PHE A 109 44.561 29.491 16.089 1.00 0.00 ATOM 860 CB PHE A 109 45.741 28.957 15.012 1.00 0.00 ATOM 861 CG PHE A 109 45.352 27.939 13.979 1.00 0.00 ATOM 862 CD1 PHE A 109 44.728 28.330 12.797 1.00 0.00 ATOM 863 CD2 PHE A 109 45.552 26.582 14.214 1.00 0.00 ATOM 864 CE1 PHE A 109 44.300 27.383 11.866 1.00 0.00 ATOM 865 CE2 PHE A 109 45.131 25.626 13.291 1.00 0.00 ATOM 866 CZ PHE A 109 44.502 26.028 12.114 1.00 0.00 ATOM 867 O PHE A 109 43.869 27.462 17.208 1.00 0.00 ATOM 868 C PHE A 109 44.744 28.325 17.090 1.00 0.00 ATOM 869 N LYS A 110 45.876 28.297 17.768 1.00 0.00 ATOM 870 CA LYS A 110 46.152 27.236 18.738 1.00 0.00 ATOM 871 CB LYS A 110 47.187 27.601 19.698 1.00 0.00 ATOM 872 CG LYS A 110 47.490 26.367 20.548 1.00 0.00 ATOM 873 CD LYS A 110 48.226 25.379 19.640 1.00 0.00 ATOM 874 CE LYS A 110 48.935 24.361 20.515 1.00 0.00 ATOM 875 NZ LYS A 110 49.057 23.031 19.852 1.00 0.00 ATOM 876 O LYS A 110 44.553 26.261 20.252 1.00 0.00 ATOM 877 C LYS A 110 45.119 27.283 19.871 1.00 0.00 ATOM 878 N ALA A 111 44.857 28.484 20.430 1.00 0.00 ATOM 879 CA ALA A 111 43.887 28.622 21.504 1.00 0.00 ATOM 880 CB ALA A 111 43.830 30.063 21.988 1.00 0.00 ATOM 881 O ALA A 111 41.739 27.573 21.712 1.00 0.00 ATOM 882 C ALA A 111 42.503 28.211 20.994 1.00 0.00 ATOM 883 N PHE A 112 42.164 28.575 19.741 1.00 0.00 ATOM 884 CA PHE A 112 40.888 28.202 19.149 1.00 0.00 ATOM 885 CB PHE A 112 40.765 28.775 17.736 1.00 0.00 ATOM 886 CG PHE A 112 40.618 30.269 17.698 1.00 0.00 ATOM 887 CD1 PHE A 112 40.321 30.980 18.846 1.00 0.00 ATOM 888 CD2 PHE A 112 40.779 30.964 16.511 1.00 0.00 ATOM 889 CE1 PHE A 112 40.186 32.354 18.812 1.00 0.00 ATOM 890 CE2 PHE A 112 40.644 32.339 16.476 1.00 0.00 ATOM 891 CZ PHE A 112 40.348 33.033 17.619 1.00 0.00 ATOM 892 O PHE A 112 39.775 26.090 19.484 1.00 0.00 ATOM 893 C PHE A 112 40.785 26.658 19.080 1.00 0.00 ATOM 894 N LEU A 113 41.838 25.976 18.619 1.00 0.00 ATOM 895 CA LEU A 113 41.848 24.528 18.531 1.00 0.00 ATOM 896 CB LEU A 113 43.154 24.038 17.902 1.00 0.00 ATOM 897 CG LEU A 113 43.348 24.344 16.417 1.00 0.00 ATOM 898 CD1 LEU A 113 44.752 23.966 15.969 1.00 0.00 ATOM 899 CD2 LEU A 113 42.354 23.563 15.573 1.00 0.00 ATOM 900 O LEU A 113 41.058 22.898 20.098 1.00 0.00 ATOM 901 C LEU A 113 41.752 23.896 19.920 1.00 0.00 ATOM 902 N ASP A 114 42.429 24.496 20.895 1.00 0.00 ATOM 903 CA ASP A 114 42.396 24.031 22.285 1.00 0.00 ATOM 904 CB ASP A 114 43.375 24.809 23.165 1.00 0.00 ATOM 905 CG ASP A 114 44.822 24.477 22.860 1.00 0.00 ATOM 906 OD1 ASP A 114 45.067 23.479 22.151 1.00 0.00 ATOM 907 OD2 ASP A 114 45.714 25.217 23.331 1.00 0.00 ATOM 908 O ASP A 114 40.545 23.216 23.620 1.00 0.00 ATOM 909 C ASP A 114 40.999 24.151 22.902 1.00 0.00 ATOM 910 N TYR A 115 40.274 25.239 22.599 1.00 0.00 ATOM 911 CA TYR A 115 38.898 25.420 23.092 1.00 0.00 ATOM 912 CB TYR A 115 38.398 26.833 22.780 1.00 0.00 ATOM 913 CG TYR A 115 39.103 27.918 23.560 1.00 0.00 ATOM 914 CD1 TYR A 115 39.862 27.609 24.680 1.00 0.00 ATOM 915 CD2 TYR A 115 39.009 29.248 23.172 1.00 0.00 ATOM 916 CE1 TYR A 115 40.510 28.595 25.400 1.00 0.00 ATOM 917 CE2 TYR A 115 39.651 30.248 23.879 1.00 0.00 ATOM 918 CZ TYR A 115 40.406 29.909 25.001 1.00 0.00 ATOM 919 OH TYR A 115 41.051 30.894 25.716 1.00 0.00 ATOM 920 O TYR A 115 37.075 23.882 23.102 1.00 0.00 ATOM 921 C TYR A 115 37.954 24.427 22.436 1.00 0.00 ATOM 922 N ALA A 116 38.096 24.197 21.144 1.00 0.00 ATOM 923 CA ALA A 116 37.271 23.210 20.453 1.00 0.00 ATOM 924 CB ALA A 116 37.652 23.136 18.983 1.00 0.00 ATOM 925 O ALA A 116 36.496 21.140 21.380 1.00 0.00 ATOM 926 C ALA A 116 37.473 21.846 21.097 1.00 0.00 ATOM 927 N ILE A 117 38.718 21.501 21.392 1.00 0.00 ATOM 928 CA ILE A 117 39.026 20.200 21.999 1.00 0.00 ATOM 929 CB ILE A 117 40.546 19.950 22.052 1.00 0.00 ATOM 930 CG1 ILE A 117 41.111 19.797 20.639 1.00 0.00 ATOM 931 CG2 ILE A 117 40.849 18.682 22.833 1.00 0.00 ATOM 932 CD1 ILE A 117 42.623 19.812 20.581 1.00 0.00 ATOM 933 O ILE A 117 38.010 18.995 23.812 1.00 0.00 ATOM 934 C ILE A 117 38.504 20.065 23.423 1.00 0.00 ATOM 935 N THR A 118 38.623 21.117 24.203 1.00 0.00 ATOM 936 CA THR A 118 38.056 21.137 25.559 1.00 0.00 ATOM 937 CB THR A 118 38.331 22.478 26.266 1.00 0.00 ATOM 938 CG2 THR A 118 37.709 22.486 27.654 1.00 0.00 ATOM 939 OG1 THR A 118 39.743 22.678 26.390 1.00 0.00 ATOM 940 O THR A 118 35.958 20.212 26.366 1.00 0.00 ATOM 941 C THR A 118 36.544 20.928 25.517 1.00 0.00 ATOM 942 N LEU A 119 35.911 21.524 24.514 1.00 0.00 ATOM 943 CA LEU A 119 34.459 21.533 24.401 1.00 0.00 ATOM 944 CB LEU A 119 33.983 22.809 23.705 1.00 0.00 ATOM 945 CG LEU A 119 34.282 24.126 24.425 1.00 0.00 ATOM 946 CD1 LEU A 119 33.846 25.313 23.579 1.00 0.00 ATOM 947 CD2 LEU A 119 33.543 24.193 25.754 1.00 0.00 ATOM 948 O LEU A 119 32.645 20.155 23.675 1.00 0.00 ATOM 949 C LEU A 119 33.853 20.374 23.618 1.00 0.00 ATOM 950 N GLY A 120 34.688 19.619 22.884 1.00 0.00 ATOM 951 CA GLY A 120 34.192 18.501 22.103 1.00 0.00 ATOM 952 O GLY A 120 32.660 18.321 20.265 1.00 0.00 ATOM 953 C GLY A 120 33.521 19.000 20.834 1.00 0.00 ATOM 954 N ALA A 121 33.892 20.225 20.427 1.00 0.00 ATOM 955 CA ALA A 121 33.303 20.792 19.217 1.00 0.00 ATOM 956 CB ALA A 121 33.603 22.278 19.096 1.00 0.00 ATOM 957 O ALA A 121 35.013 19.579 18.075 1.00 0.00 ATOM 958 C ALA A 121 33.874 20.037 18.038 1.00 0.00 ATOM 959 N ASP A 122 33.062 19.882 17.007 1.00 0.00 ATOM 960 CA ASP A 122 33.474 19.137 15.833 1.00 0.00 ATOM 961 CB ASP A 122 32.207 18.447 15.222 1.00 0.00 ATOM 962 CG ASP A 122 31.650 17.335 16.079 1.00 0.00 ATOM 963 OD1 ASP A 122 32.403 16.377 16.349 1.00 0.00 ATOM 964 OD2 ASP A 122 30.468 17.409 16.478 1.00 0.00 ATOM 965 O ASP A 122 34.962 19.595 14.011 1.00 0.00 ATOM 966 C ASP A 122 34.129 20.051 14.812 1.00 0.00 ATOM 967 N TYR A 123 33.725 21.329 14.894 1.00 0.00 ATOM 968 CA TYR A 123 34.174 22.332 13.947 1.00 0.00 ATOM 969 CB TYR A 123 33.084 22.636 12.903 1.00 0.00 ATOM 970 CG TYR A 123 32.617 21.453 12.086 1.00 0.00 ATOM 971 CD1 TYR A 123 31.256 21.197 11.906 1.00 0.00 ATOM 972 CD2 TYR A 123 33.534 20.590 11.493 1.00 0.00 ATOM 973 CE1 TYR A 123 30.823 20.116 11.150 1.00 0.00 ATOM 974 CE2 TYR A 123 33.115 19.512 10.737 1.00 0.00 ATOM 975 CZ TYR A 123 31.757 19.277 10.565 1.00 0.00 ATOM 976 OH TYR A 123 31.350 18.228 9.779 1.00 0.00 ATOM 977 O TYR A 123 33.708 24.087 15.456 1.00 0.00 ATOM 978 C TYR A 123 34.414 23.676 14.559 1.00 0.00 ATOM 979 N VAL A 124 35.373 24.396 14.005 1.00 0.00 ATOM 980 CA VAL A 124 35.659 25.718 14.490 1.00 0.00 ATOM 981 CB VAL A 124 36.783 25.702 15.542 1.00 0.00 ATOM 982 CG1 VAL A 124 36.349 24.924 16.775 1.00 0.00 ATOM 983 CG2 VAL A 124 38.033 25.046 14.976 1.00 0.00 ATOM 984 O VAL A 124 36.834 25.992 12.451 1.00 0.00 ATOM 985 C VAL A 124 36.132 26.521 13.312 1.00 0.00 ATOM 986 N ALA A 125 35.807 27.836 13.229 1.00 0.00 ATOM 987 CA ALA A 125 36.360 28.763 12.251 1.00 0.00 ATOM 988 CB ALA A 125 35.306 29.803 11.905 1.00 0.00 ATOM 989 O ALA A 125 37.536 30.060 13.868 1.00 0.00 ATOM 990 C ALA A 125 37.598 29.410 12.832 1.00 0.00 ATOM 991 N THR A 126 38.860 29.169 12.168 1.00 0.00 ATOM 992 CA THR A 126 40.085 29.770 12.694 1.00 0.00 ATOM 993 CB THR A 126 40.961 28.727 13.414 1.00 0.00 ATOM 994 CG2 THR A 126 42.229 29.376 13.946 1.00 0.00 ATOM 995 OG1 THR A 126 40.233 28.163 14.512 1.00 0.00 ATOM 996 O THR A 126 41.400 29.580 10.702 1.00 0.00 ATOM 997 C THR A 126 40.969 30.323 11.581 1.00 0.00 ATOM 998 N GLY A 127 41.255 31.620 11.643 1.00 0.00 ATOM 999 CA GLY A 127 42.119 32.240 10.652 1.00 0.00 ATOM 1000 O GLY A 127 42.253 31.959 8.266 1.00 0.00 ATOM 1001 C GLY A 127 41.527 32.089 9.253 1.00 0.00 ATOM 1002 N HIS A 128 40.195 32.076 9.182 1.00 0.00 ATOM 1003 CA HIS A 128 39.497 31.902 7.919 1.00 0.00 ATOM 1004 CB HIS A 128 38.063 31.431 8.160 1.00 0.00 ATOM 1005 CG HIS A 128 37.969 30.051 8.738 1.00 0.00 ATOM 1006 CD2 HIS A 128 38.903 28.960 8.975 1.00 0.00 ATOM 1007 ND1 HIS A 128 36.787 29.521 9.208 1.00 0.00 ATOM 1008 CE1 HIS A 128 37.018 28.275 9.662 1.00 0.00 ATOM 1009 NE2 HIS A 128 38.285 27.932 9.523 1.00 0.00 ATOM 1010 O HIS A 128 39.618 34.271 7.578 1.00 0.00 ATOM 1011 C HIS A 128 39.391 33.170 7.095 1.00 0.00 ATOM 1012 N TYR A 129 38.965 33.004 5.853 1.00 0.00 ATOM 1013 CA TYR A 129 38.807 34.120 4.923 1.00 0.00 ATOM 1014 CB TYR A 129 40.174 34.572 4.403 1.00 0.00 ATOM 1015 CG TYR A 129 40.922 33.506 3.637 1.00 0.00 ATOM 1016 CD1 TYR A 129 40.752 33.364 2.266 1.00 0.00 ATOM 1017 CD2 TYR A 129 41.795 32.643 4.287 1.00 0.00 ATOM 1018 CE1 TYR A 129 41.429 32.391 1.556 1.00 0.00 ATOM 1019 CE2 TYR A 129 42.481 31.664 3.593 1.00 0.00 ATOM 1020 CZ TYR A 129 42.293 31.545 2.216 1.00 0.00 ATOM 1021 OH TYR A 129 42.970 30.575 1.513 1.00 0.00 ATOM 1022 O TYR A 129 37.808 32.441 3.568 1.00 0.00 ATOM 1023 C TYR A 129 37.951 33.643 3.772 1.00 0.00 ATOM 1024 N ALA A 130 37.453 34.593 2.990 1.00 0.00 ATOM 1025 CA ALA A 130 36.696 34.309 1.783 1.00 0.00 ATOM 1026 CB ALA A 130 35.290 34.593 1.823 1.00 0.00 ATOM 1027 O ALA A 130 37.881 35.052 -0.172 1.00 0.00 ATOM 1028 C ALA A 130 37.399 35.350 0.922 1.00 0.00 ATOM 1029 N ARG A 131 37.409 36.753 1.409 1.00 0.00 ATOM 1030 CA ARG A 131 37.930 37.880 0.650 1.00 0.00 ATOM 1031 CB ARG A 131 36.795 38.774 0.180 1.00 0.00 ATOM 1032 CG ARG A 131 35.634 37.992 -0.332 1.00 0.00 ATOM 1033 CD ARG A 131 34.749 38.826 -1.213 1.00 0.00 ATOM 1034 NE ARG A 131 34.366 40.088 -0.597 1.00 0.00 ATOM 1035 CZ ARG A 131 33.233 40.719 -0.880 1.00 0.00 ATOM 1036 NH1 ARG A 131 32.392 40.188 -1.759 1.00 0.00 ATOM 1037 NH2 ARG A 131 32.941 41.875 -0.291 1.00 0.00 ATOM 1038 O ARG A 131 39.037 38.526 2.661 1.00 0.00 ATOM 1039 C ARG A 131 38.200 38.810 1.815 1.00 0.00 ATOM 1040 N VAL A 132 37.477 39.999 1.889 1.00 0.00 ATOM 1041 CA VAL A 132 37.638 40.943 2.984 1.00 0.00 ATOM 1042 CB VAL A 132 36.779 42.204 2.774 1.00 0.00 ATOM 1043 CG1 VAL A 132 36.818 43.087 4.013 1.00 0.00 ATOM 1044 CG2 VAL A 132 37.300 43.012 1.595 1.00 0.00 ATOM 1045 O VAL A 132 37.872 40.511 5.336 1.00 0.00 ATOM 1046 C VAL A 132 37.228 40.301 4.303 1.00 0.00 ATOM 1047 N ALA A 133 36.149 39.521 4.269 1.00 0.00 ATOM 1048 CA ALA A 133 35.656 38.847 5.469 1.00 0.00 ATOM 1049 CB ALA A 133 34.192 38.473 5.298 1.00 0.00 ATOM 1050 O ALA A 133 36.327 36.471 5.319 1.00 0.00 ATOM 1051 C ALA A 133 36.557 37.641 5.694 1.00 0.00 ATOM 1052 N ARG A 134 37.778 38.016 6.359 1.00 0.00 ATOM 1053 CA ARG A 134 38.817 37.014 6.632 1.00 0.00 ATOM 1054 CB ARG A 134 39.913 37.627 7.432 1.00 0.00 ATOM 1055 CG ARG A 134 40.636 38.711 6.646 1.00 0.00 ATOM 1056 CD ARG A 134 41.435 39.696 7.512 1.00 0.00 ATOM 1057 NE ARG A 134 42.164 40.641 6.658 1.00 0.00 ATOM 1058 CZ ARG A 134 41.605 41.645 5.981 1.00 0.00 ATOM 1059 NH1 ARG A 134 40.300 41.869 6.056 1.00 0.00 ATOM 1060 NH2 ARG A 134 42.346 42.412 5.194 1.00 0.00 ATOM 1061 O ARG A 134 38.962 34.764 7.470 1.00 0.00 ATOM 1062 C ARG A 134 38.443 35.873 7.597 1.00 0.00 ATOM 1063 N ASP A 135 37.575 36.112 8.540 1.00 0.00 ATOM 1064 CA ASP A 135 37.178 35.060 9.472 1.00 0.00 ATOM 1065 CB ASP A 135 36.781 35.659 10.824 1.00 0.00 ATOM 1066 CG ASP A 135 35.570 36.566 10.724 1.00 0.00 ATOM 1067 OD1 ASP A 135 35.060 36.757 9.599 1.00 0.00 ATOM 1068 OD2 ASP A 135 35.130 37.086 11.772 1.00 0.00 ATOM 1069 O ASP A 135 35.580 33.272 9.553 1.00 0.00 ATOM 1070 C ASP A 135 35.987 34.267 8.954 1.00 0.00 ATOM 1071 N GLU A 136 35.453 34.703 7.814 1.00 0.00 ATOM 1072 CA GLU A 136 34.339 34.021 7.182 1.00 0.00 ATOM 1073 CB GLU A 136 34.694 32.558 6.910 1.00 0.00 ATOM 1074 CG GLU A 136 35.892 32.370 5.995 1.00 0.00 ATOM 1075 CD GLU A 136 36.179 30.911 5.701 1.00 0.00 ATOM 1076 OE1 GLU A 136 35.444 30.045 6.219 1.00 0.00 ATOM 1077 OE2 GLU A 136 37.139 30.633 4.952 1.00 0.00 ATOM 1078 O GLU A 136 32.299 32.941 7.749 1.00 0.00 ATOM 1079 C GLU A 136 33.027 33.916 7.936 1.00 0.00 ATOM 1080 N ASP A 137 32.703 34.888 8.781 1.00 0.00 ATOM 1081 CA ASP A 137 31.443 34.799 9.514 1.00 0.00 ATOM 1082 CB ASP A 137 31.448 35.747 10.699 1.00 0.00 ATOM 1083 CG ASP A 137 32.083 37.103 10.401 1.00 0.00 ATOM 1084 OD1 ASP A 137 32.081 37.473 9.196 1.00 0.00 ATOM 1085 OD2 ASP A 137 32.563 37.792 11.355 1.00 0.00 ATOM 1086 O ASP A 137 29.155 35.182 8.978 1.00 0.00 ATOM 1087 C ASP A 137 30.317 35.387 8.657 1.00 0.00 ATOM 1088 N GLY A 138 30.685 36.134 7.626 1.00 0.00 ATOM 1089 CA GLY A 138 29.715 36.769 6.756 1.00 0.00 ATOM 1090 O GLY A 138 28.983 36.828 4.476 1.00 0.00 ATOM 1091 C GLY A 138 29.553 36.166 5.367 1.00 0.00 ATOM 1092 N THR A 139 30.023 34.939 5.196 1.00 0.00 ATOM 1093 CA THR A 139 29.917 34.251 3.909 1.00 0.00 ATOM 1094 CB THR A 139 31.172 34.471 3.047 1.00 0.00 ATOM 1095 CG2 THR A 139 31.441 35.956 2.863 1.00 0.00 ATOM 1096 OG1 THR A 139 32.306 33.869 3.686 1.00 0.00 ATOM 1097 O THR A 139 30.244 32.204 5.109 1.00 0.00 ATOM 1098 C THR A 139 29.761 32.746 4.120 1.00 0.00 ATOM 1099 N VAL A 140 29.074 32.074 3.199 1.00 0.00 ATOM 1100 CA VAL A 140 28.852 30.635 3.302 1.00 0.00 ATOM 1101 CB VAL A 140 27.297 30.338 3.420 1.00 0.00 ATOM 1102 CG1 VAL A 140 27.073 28.835 3.591 1.00 0.00 ATOM 1103 CG2 VAL A 140 26.678 31.093 4.590 1.00 0.00 ATOM 1104 O VAL A 140 30.144 28.921 2.268 1.00 0.00 ATOM 1105 C VAL A 140 29.472 29.937 2.109 1.00 0.00 ATOM 1106 N HIS A 141 29.232 30.468 0.916 1.00 0.00 ATOM 1107 CA HIS A 141 29.784 29.873 -0.297 1.00 0.00 ATOM 1108 CB HIS A 141 28.618 29.262 -1.105 1.00 0.00 ATOM 1109 CG HIS A 141 27.486 30.216 -1.330 1.00 0.00 ATOM 1110 CD2 HIS A 141 27.332 31.219 -2.225 1.00 0.00 ATOM 1111 ND1 HIS A 141 26.334 30.201 -0.571 1.00 0.00 ATOM 1112 CE1 HIS A 141 25.522 31.156 -0.987 1.00 0.00 ATOM 1113 NE2 HIS A 141 26.104 31.788 -1.991 1.00 0.00 ATOM 1114 O HIS A 141 30.458 31.997 -1.114 1.00 0.00 ATOM 1115 C HIS A 141 30.775 30.838 -0.864 1.00 0.00 ATOM 1116 N MET A 142 32.063 30.299 -1.059 1.00 0.00 ATOM 1117 CA MET A 142 33.134 31.148 -1.506 1.00 0.00 ATOM 1118 CB MET A 142 34.393 30.888 -0.676 1.00 0.00 ATOM 1119 CG MET A 142 34.255 31.317 0.755 1.00 0.00 ATOM 1120 SD MET A 142 33.878 33.059 1.072 1.00 0.00 ATOM 1121 CE MET A 142 32.093 32.914 1.314 1.00 0.00 ATOM 1122 O MET A 142 33.504 29.758 -3.433 1.00 0.00 ATOM 1123 C MET A 142 33.525 30.894 -2.952 1.00 0.00 ATOM 1124 N LEU A 143 33.750 31.973 -3.693 1.00 0.00 ATOM 1125 CA LEU A 143 34.103 31.844 -5.106 1.00 0.00 ATOM 1126 CB LEU A 143 33.060 32.577 -5.954 1.00 0.00 ATOM 1127 CG LEU A 143 31.617 32.088 -5.825 1.00 0.00 ATOM 1128 CD1 LEU A 143 30.674 32.983 -6.615 1.00 0.00 ATOM 1129 CD2 LEU A 143 31.480 30.668 -6.351 1.00 0.00 ATOM 1130 O LEU A 143 35.662 33.658 -4.968 1.00 0.00 ATOM 1131 C LEU A 143 35.487 32.480 -5.265 1.00 0.00 ATOM 1132 N ARG A 144 36.483 31.683 -5.641 1.00 0.00 ATOM 1133 CA ARG A 144 37.842 32.197 -5.787 1.00 0.00 ATOM 1134 CB ARG A 144 38.861 31.166 -5.296 1.00 0.00 ATOM 1135 CG ARG A 144 38.748 30.841 -3.814 1.00 0.00 ATOM 1136 CD ARG A 144 39.184 32.014 -2.955 1.00 0.00 ATOM 1137 NE ARG A 144 39.188 31.681 -1.533 1.00 0.00 ATOM 1138 CZ ARG A 144 38.129 31.785 -0.738 1.00 0.00 ATOM 1139 NH1 ARG A 144 38.226 31.458 0.544 1.00 0.00 ATOM 1140 NH2 ARG A 144 36.974 32.218 -1.225 1.00 0.00 ATOM 1141 O ARG A 144 37.536 31.872 -8.150 1.00 0.00 ATOM 1142 C ARG A 144 38.128 32.488 -7.257 1.00 0.00 ATOM 1143 N GLY A 145 39.166 33.581 -7.761 1.00 0.00 ATOM 1144 CA GLY A 145 39.568 33.900 -9.126 1.00 0.00 ATOM 1145 O GLY A 145 41.788 33.223 -8.628 1.00 0.00 ATOM 1146 C GLY A 145 40.766 33.002 -9.272 1.00 0.00 ATOM 1147 N VAL A 146 40.652 31.991 -10.118 1.00 0.00 ATOM 1148 CA VAL A 146 41.741 31.039 -10.263 1.00 0.00 ATOM 1149 CB VAL A 146 41.254 29.590 -10.071 1.00 0.00 ATOM 1150 CG1 VAL A 146 42.408 28.615 -10.234 1.00 0.00 ATOM 1151 CG2 VAL A 146 40.664 29.408 -8.680 1.00 0.00 ATOM 1152 O VAL A 146 42.058 30.306 -12.513 1.00 0.00 ATOM 1153 C VAL A 146 42.495 30.975 -11.577 1.00 0.00 ATOM 1154 N ASP A 147 43.617 31.687 -11.655 1.00 0.00 ATOM 1155 CA ASP A 147 44.466 31.619 -12.841 1.00 0.00 ATOM 1156 CB ASP A 147 45.171 32.957 -13.064 1.00 0.00 ATOM 1157 CG ASP A 147 45.650 33.133 -14.493 1.00 0.00 ATOM 1158 OD1 ASP A 147 45.372 32.244 -15.325 1.00 0.00 ATOM 1159 OD2 ASP A 147 46.304 34.159 -14.778 1.00 0.00 ATOM 1160 O ASP A 147 45.484 30.219 -11.173 1.00 0.00 ATOM 1161 C ASP A 147 45.372 30.492 -12.359 1.00 0.00 ATOM 1162 N ASN A 148 46.020 29.833 -13.261 1.00 0.00 ATOM 1163 CA ASN A 148 46.870 28.693 -12.955 1.00 0.00 ATOM 1164 CB ASN A 148 47.338 28.015 -14.243 1.00 0.00 ATOM 1165 CG ASN A 148 46.223 27.266 -14.945 1.00 0.00 ATOM 1166 ND2 ASN A 148 46.436 26.948 -16.218 1.00 0.00 ATOM 1167 OD1 ASN A 148 45.185 26.977 -14.350 1.00 0.00 ATOM 1168 O ASN A 148 48.888 28.169 -11.769 1.00 0.00 ATOM 1169 C ASN A 148 48.126 29.048 -12.163 1.00 0.00 ATOM 1170 N GLY A 149 48.339 30.417 -11.841 1.00 0.00 ATOM 1171 CA GLY A 149 49.501 30.877 -11.100 1.00 0.00 ATOM 1172 O GLY A 149 48.839 29.896 -9.024 1.00 0.00 ATOM 1173 C GLY A 149 49.705 30.517 -9.633 1.00 0.00 ATOM 1174 N LYS A 150 50.870 30.882 -9.120 1.00 0.00 ATOM 1175 CA LYS A 150 51.249 30.538 -7.746 1.00 0.00 ATOM 1176 CB LYS A 150 52.668 31.023 -7.443 1.00 0.00 ATOM 1177 CG LYS A 150 53.159 30.672 -6.049 1.00 0.00 ATOM 1178 CD LYS A 150 54.596 31.120 -5.841 1.00 0.00 ATOM 1179 CE LYS A 150 55.072 30.814 -4.430 1.00 0.00 ATOM 1180 NZ LYS A 150 56.471 31.269 -4.204 1.00 0.00 ATOM 1181 O LYS A 150 49.882 30.459 -5.759 1.00 0.00 ATOM 1182 C LYS A 150 50.286 31.137 -6.704 1.00 0.00 ATOM 1183 N ASP A 151 49.870 32.398 -6.878 1.00 0.00 ATOM 1184 CA ASP A 151 48.970 33.083 -5.948 1.00 0.00 ATOM 1185 CB ASP A 151 48.707 34.550 -6.297 1.00 0.00 ATOM 1186 CG ASP A 151 49.894 35.442 -5.998 1.00 0.00 ATOM 1187 OD1 ASP A 151 50.827 34.979 -5.307 1.00 0.00 ATOM 1188 OD2 ASP A 151 49.892 36.605 -6.453 1.00 0.00 ATOM 1189 O ASP A 151 47.055 32.091 -4.819 1.00 0.00 ATOM 1190 C ASP A 151 47.608 32.355 -5.901 1.00 0.00 ATOM 1191 N GLN A 152 47.075 32.047 -7.053 1.00 0.00 ATOM 1192 CA GLN A 152 45.781 31.349 -7.124 1.00 0.00 ATOM 1193 CB GLN A 152 45.253 31.335 -8.560 1.00 0.00 ATOM 1194 CG GLN A 152 44.783 32.692 -9.062 1.00 0.00 ATOM 1195 CD GLN A 152 45.932 33.652 -9.304 1.00 0.00 ATOM 1196 OE1 GLN A 152 47.028 33.241 -9.682 1.00 0.00 ATOM 1197 NE2 GLN A 152 45.682 34.937 -9.086 1.00 0.00 ATOM 1198 O GLN A 152 45.062 29.342 -5.942 1.00 0.00 ATOM 1199 C GLN A 152 45.930 29.888 -6.642 1.00 0.00 ATOM 1200 N THR A 153 47.020 29.246 -7.024 1.00 0.00 ATOM 1201 CA THR A 153 47.259 27.876 -6.595 1.00 0.00 ATOM 1202 CB THR A 153 48.541 27.302 -7.228 1.00 0.00 ATOM 1203 CG2 THR A 153 48.793 25.887 -6.731 1.00 0.00 ATOM 1204 OG1 THR A 153 48.403 27.275 -8.654 1.00 0.00 ATOM 1205 O THR A 153 46.843 26.932 -4.423 1.00 0.00 ATOM 1206 C THR A 153 47.415 27.803 -5.080 1.00 0.00 ATOM 1207 N TYR A 154 48.189 28.710 -4.543 1.00 0.00 ATOM 1208 CA TYR A 154 48.409 28.768 -3.107 1.00 0.00 ATOM 1209 CB TYR A 154 49.657 29.683 -2.838 1.00 0.00 ATOM 1210 CG TYR A 154 50.200 29.566 -1.427 1.00 0.00 ATOM 1211 CD1 TYR A 154 51.198 28.640 -1.125 1.00 0.00 ATOM 1212 CD2 TYR A 154 49.730 30.383 -0.402 1.00 0.00 ATOM 1213 CE1 TYR A 154 51.725 28.532 0.159 1.00 0.00 ATOM 1214 CE2 TYR A 154 50.252 30.283 0.901 1.00 0.00 ATOM 1215 CZ TYR A 154 51.250 29.352 1.166 1.00 0.00 ATOM 1216 OH TYR A 154 51.786 29.233 2.432 1.00 0.00 ATOM 1217 O TYR A 154 46.840 28.598 -1.284 1.00 0.00 ATOM 1218 C TYR A 154 47.123 29.143 -2.358 1.00 0.00 ATOM 1219 N PHE A 155 46.361 30.088 -2.911 1.00 0.00 ATOM 1220 CA PHE A 155 45.118 30.511 -2.286 1.00 0.00 ATOM 1221 CB PHE A 155 44.454 31.644 -2.997 1.00 0.00 ATOM 1222 CG PHE A 155 45.107 32.982 -2.741 1.00 0.00 ATOM 1223 CD1 PHE A 155 44.553 34.139 -3.290 1.00 0.00 ATOM 1224 CD2 PHE A 155 46.261 33.093 -1.966 1.00 0.00 ATOM 1225 CE1 PHE A 155 45.130 35.384 -3.073 1.00 0.00 ATOM 1226 CE2 PHE A 155 46.851 34.337 -1.740 1.00 0.00 ATOM 1227 CZ PHE A 155 46.283 35.487 -2.296 1.00 0.00 ATOM 1228 O PHE A 155 43.450 29.120 -1.279 1.00 0.00 ATOM 1229 C PHE A 155 44.094 29.392 -2.294 1.00 0.00 ATOM 1230 N LEU A 156 43.950 28.742 -3.445 1.00 0.00 ATOM 1231 CA LEU A 156 43.003 27.641 -3.588 1.00 0.00 ATOM 1232 CB LEU A 156 42.928 27.185 -5.046 1.00 0.00 ATOM 1233 CG LEU A 156 42.274 28.157 -6.028 1.00 0.00 ATOM 1234 CD1 LEU A 156 42.435 27.668 -7.458 1.00 0.00 ATOM 1235 CD2 LEU A 156 40.786 28.294 -5.738 1.00 0.00 ATOM 1236 O LEU A 156 42.447 25.780 -2.160 1.00 0.00 ATOM 1237 C LEU A 156 43.337 26.400 -2.754 1.00 0.00 ATOM 1238 N SER A 157 44.615 26.009 -2.744 1.00 0.00 ATOM 1239 CA SER A 157 45.070 24.852 -1.980 1.00 0.00 ATOM 1240 CB SER A 157 46.566 24.587 -2.164 1.00 0.00 ATOM 1241 OG SER A 157 46.856 24.200 -3.496 1.00 0.00 ATOM 1242 O SER A 157 44.335 24.197 0.202 1.00 0.00 ATOM 1243 C SER A 157 44.796 25.097 -0.510 1.00 0.00 ATOM 1244 N GLN A 158 45.043 26.323 -0.075 1.00 0.00 ATOM 1245 CA GLN A 158 44.754 26.725 1.293 1.00 0.00 ATOM 1246 CB GLN A 158 45.200 28.171 1.531 1.00 0.00 ATOM 1247 CG GLN A 158 45.042 28.640 2.968 1.00 0.00 ATOM 1248 CD GLN A 158 45.914 27.863 3.933 1.00 0.00 ATOM 1249 OE1 GLN A 158 47.098 27.641 3.675 1.00 0.00 ATOM 1250 NE2 GLN A 158 45.332 27.447 5.053 1.00 0.00 ATOM 1251 O GLN A 158 42.871 26.195 2.672 1.00 0.00 ATOM 1252 C GLN A 158 43.263 26.639 1.594 1.00 0.00 ATOM 1253 N LEU A 159 42.434 27.059 0.634 1.00 0.00 ATOM 1254 CA LEU A 159 40.994 27.003 0.844 1.00 0.00 ATOM 1255 CB LEU A 159 40.257 27.700 -0.302 1.00 0.00 ATOM 1256 CG LEU A 159 38.730 27.744 -0.199 1.00 0.00 ATOM 1257 CD1 LEU A 159 38.297 28.492 1.052 1.00 0.00 ATOM 1258 CD2 LEU A 159 38.130 28.449 -1.406 1.00 0.00 ATOM 1259 O LEU A 159 39.608 25.246 1.706 1.00 0.00 ATOM 1260 C LEU A 159 40.498 25.564 0.917 1.00 0.00 ATOM 1261 N SER A 160 41.039 24.675 0.078 1.00 0.00 ATOM 1262 CA SER A 160 40.655 23.271 0.113 1.00 0.00 ATOM 1263 CB SER A 160 41.320 22.507 -1.035 1.00 0.00 ATOM 1264 OG SER A 160 42.727 22.465 -0.873 1.00 0.00 ATOM 1265 O SER A 160 40.516 21.815 2.007 1.00 0.00 ATOM 1266 C SER A 160 41.143 22.703 1.444 1.00 0.00 ATOM 1267 N GLN A 161 42.260 23.220 1.959 1.00 0.00 ATOM 1268 CA GLN A 161 42.753 22.745 3.248 1.00 0.00 ATOM 1269 CB GLN A 161 44.120 23.336 3.596 1.00 0.00 ATOM 1270 CG GLN A 161 45.262 22.806 2.742 1.00 0.00 ATOM 1271 CD GLN A 161 46.580 23.494 3.041 1.00 0.00 ATOM 1272 OE1 GLN A 161 46.631 24.446 3.819 1.00 0.00 ATOM 1273 NE2 GLN A 161 47.651 23.012 2.418 1.00 0.00 ATOM 1274 O GLN A 161 41.417 22.409 5.225 1.00 0.00 ATOM 1275 C GLN A 161 41.739 23.161 4.310 1.00 0.00 ATOM 1276 N GLU A 162 41.241 24.379 4.146 1.00 0.00 ATOM 1277 CA GLU A 162 40.264 25.000 5.038 1.00 0.00 ATOM 1278 CB GLU A 162 40.224 26.517 4.689 1.00 0.00 ATOM 1279 CG GLU A 162 39.359 27.362 5.599 1.00 0.00 ATOM 1280 CD GLU A 162 39.350 28.820 5.179 1.00 0.00 ATOM 1281 OE1 GLU A 162 38.880 29.112 4.057 1.00 0.00 ATOM 1282 OE2 GLU A 162 39.816 29.671 5.967 1.00 0.00 ATOM 1283 O GLU A 162 38.243 24.150 6.020 1.00 0.00 ATOM 1284 C GLU A 162 38.913 24.294 4.991 1.00 0.00 ATOM 1285 N GLN A 163 38.513 23.867 3.802 1.00 0.00 ATOM 1286 CA GLN A 163 37.242 23.180 3.621 1.00 0.00 ATOM 1287 CB GLN A 163 36.958 22.957 2.134 1.00 0.00 ATOM 1288 CG GLN A 163 35.618 22.300 1.850 1.00 0.00 ATOM 1289 CD GLN A 163 35.346 22.153 0.364 1.00 0.00 ATOM 1290 OE1 GLN A 163 36.186 22.499 -0.468 1.00 0.00 ATOM 1291 NE2 GLN A 163 34.169 21.638 0.028 1.00 0.00 ATOM 1292 O GLN A 163 36.373 21.417 4.993 1.00 0.00 ATOM 1293 C GLN A 163 37.332 21.846 4.344 1.00 0.00 ATOM 1294 N LEU A 164 38.464 21.194 4.228 1.00 0.00 ATOM 1295 CA LEU A 164 38.619 19.899 4.891 1.00 0.00 ATOM 1296 CB LEU A 164 39.949 19.256 4.502 1.00 0.00 ATOM 1297 CG LEU A 164 40.102 18.848 3.034 1.00 0.00 ATOM 1298 CD1 LEU A 164 41.508 18.336 2.759 1.00 0.00 ATOM 1299 CD2 LEU A 164 39.116 17.748 2.676 1.00 0.00 ATOM 1300 O LEU A 164 38.311 19.156 7.131 1.00 0.00 ATOM 1301 C LEU A 164 38.583 20.091 6.389 1.00 0.00 ATOM 1302 N GLN A 165 38.856 21.312 6.847 1.00 0.00 ATOM 1303 CA GLN A 165 38.808 21.610 8.267 1.00 0.00 ATOM 1304 CB GLN A 165 39.887 22.629 8.638 1.00 0.00 ATOM 1305 CG GLN A 165 41.308 22.149 8.384 1.00 0.00 ATOM 1306 CD GLN A 165 42.347 23.196 8.732 1.00 0.00 ATOM 1307 OE1 GLN A 165 42.015 24.274 9.224 1.00 0.00 ATOM 1308 NE2 GLN A 165 43.613 22.880 8.474 1.00 0.00 ATOM 1309 O GLN A 165 37.267 22.286 9.995 1.00 0.00 ATOM 1310 C GLN A 165 37.493 22.205 8.784 1.00 0.00 ATOM 1311 N LYS A 166 36.622 22.611 7.863 1.00 0.00 ATOM 1312 CA LYS A 166 35.324 23.183 8.219 1.00 0.00 ATOM 1313 CB LYS A 166 35.305 24.689 7.945 1.00 0.00 ATOM 1314 CG LYS A 166 34.063 25.396 8.459 1.00 0.00 ATOM 1315 CD LYS A 166 34.248 26.906 8.457 1.00 0.00 ATOM 1316 CE LYS A 166 32.961 27.621 8.840 1.00 0.00 ATOM 1317 NZ LYS A 166 32.496 27.236 10.201 1.00 0.00 ATOM 1318 O LYS A 166 33.790 23.072 6.379 1.00 0.00 ATOM 1319 C LYS A 166 34.216 22.533 7.402 1.00 0.00 ATOM 1320 N THR A 167 33.734 21.360 7.850 1.00 0.00 ATOM 1321 CA THR A 167 32.669 20.609 7.169 1.00 0.00 ATOM 1322 CB THR A 167 32.436 19.344 7.323 1.00 0.00 ATOM 1323 CG2 THR A 167 30.992 18.932 7.267 1.00 0.00 ATOM 1324 OG1 THR A 167 33.171 18.741 6.224 1.00 0.00 ATOM 1325 O THR A 167 31.035 22.276 7.713 1.00 0.00 ATOM 1326 C THR A 167 31.439 21.464 6.885 1.00 0.00 ATOM 1327 N MET A 168 30.723 21.390 5.670 1.00 0.00 ATOM 1328 CA MET A 168 29.590 22.219 5.324 1.00 0.00 ATOM 1329 CB MET A 168 28.955 22.811 6.583 1.00 0.00 ATOM 1330 CG MET A 168 28.274 21.785 7.475 1.00 0.00 ATOM 1331 SD MET A 168 27.583 22.515 8.972 1.00 0.00 ATOM 1332 CE MET A 168 26.215 23.451 8.294 1.00 0.00 ATOM 1333 O MET A 168 29.307 23.829 3.581 1.00 0.00 ATOM 1334 C MET A 168 30.070 23.353 4.417 1.00 0.00 ATOM 1335 N PHE A 169 31.304 23.814 4.591 1.00 0.00 ATOM 1336 CA PHE A 169 31.809 24.918 3.773 1.00 0.00 ATOM 1337 CB PHE A 169 33.200 25.343 4.245 1.00 0.00 ATOM 1338 CG PHE A 169 33.748 26.540 3.519 1.00 0.00 ATOM 1339 CD1 PHE A 169 33.327 27.817 3.844 1.00 0.00 ATOM 1340 CD2 PHE A 169 34.683 26.386 2.510 1.00 0.00 ATOM 1341 CE1 PHE A 169 33.831 28.917 3.175 1.00 0.00 ATOM 1342 CE2 PHE A 169 35.186 27.486 1.841 1.00 0.00 ATOM 1343 CZ PHE A 169 34.764 28.748 2.172 1.00 0.00 ATOM 1344 O PHE A 169 32.674 24.009 1.753 1.00 0.00 ATOM 1345 C PHE A 169 31.810 24.719 2.271 1.00 0.00 ATOM 1346 N PRO A 170 30.871 25.296 1.352 1.00 0.00 ATOM 1347 CA PRO A 170 30.914 25.096 -0.103 1.00 0.00 ATOM 1348 CB PRO A 170 29.580 25.640 -0.584 1.00 0.00 ATOM 1349 CG PRO A 170 29.075 26.522 0.509 1.00 0.00 ATOM 1350 CD PRO A 170 29.781 26.178 1.794 1.00 0.00 ATOM 1351 O PRO A 170 31.969 27.234 -0.490 1.00 0.00 ATOM 1352 C PRO A 170 31.920 26.018 -0.762 1.00 0.00 ATOM 1353 N LEU A 171 32.666 25.464 -1.708 1.00 0.00 ATOM 1354 CA LEU A 171 33.774 26.184 -2.357 1.00 0.00 ATOM 1355 CB LEU A 171 35.107 25.589 -1.853 1.00 0.00 ATOM 1356 CG LEU A 171 36.364 26.072 -2.584 1.00 0.00 ATOM 1357 CD1 LEU A 171 36.664 27.549 -2.392 1.00 0.00 ATOM 1358 CD2 LEU A 171 37.558 25.209 -2.144 1.00 0.00 ATOM 1359 O LEU A 171 33.530 25.014 -4.425 1.00 0.00 ATOM 1360 C LEU A 171 33.709 26.093 -3.875 1.00 0.00 ATOM 1361 N GLY A 172 33.859 27.224 -4.554 1.00 0.00 ATOM 1362 CA GLY A 172 33.826 27.233 -6.013 1.00 0.00 ATOM 1363 O GLY A 172 35.507 28.949 -5.986 1.00 0.00 ATOM 1364 C GLY A 172 35.017 27.993 -6.588 1.00 0.00 ATOM 1365 N HIS A 173 35.485 27.567 -7.756 1.00 0.00 ATOM 1366 CA HIS A 173 36.612 28.225 -8.384 1.00 0.00 ATOM 1367 CB HIS A 173 37.576 27.233 -8.822 1.00 0.00 ATOM 1368 CG HIS A 173 37.248 25.778 -8.927 1.00 0.00 ATOM 1369 CD2 HIS A 173 36.762 25.056 -9.972 1.00 0.00 ATOM 1370 ND1 HIS A 173 37.349 24.904 -7.872 1.00 0.00 ATOM 1371 CE1 HIS A 173 36.954 23.700 -8.249 1.00 0.00 ATOM 1372 NE2 HIS A 173 36.602 23.766 -9.529 1.00 0.00 ATOM 1373 O HIS A 173 35.641 27.942 -10.544 1.00 0.00 ATOM 1374 C HIS A 173 36.305 28.683 -9.784 1.00 0.00 ATOM 1375 N LEU A 174 36.768 29.860 -10.159 1.00 0.00 ATOM 1376 CA LEU A 174 36.552 30.373 -11.503 1.00 0.00 ATOM 1377 CB LEU A 174 35.604 31.571 -11.452 1.00 0.00 ATOM 1378 CG LEU A 174 34.193 31.300 -10.924 1.00 0.00 ATOM 1379 CD1 LEU A 174 33.423 32.598 -10.753 1.00 0.00 ATOM 1380 CD2 LEU A 174 33.420 30.411 -11.887 1.00 0.00 ATOM 1381 O LEU A 174 38.469 31.779 -11.834 1.00 0.00 ATOM 1382 C LEU A 174 37.776 30.860 -12.267 1.00 0.00 ATOM 1383 N GLU A 175 38.024 30.215 -13.404 1.00 0.00 ATOM 1384 CA GLU A 175 39.156 30.614 -14.249 1.00 0.00 ATOM 1385 CB GLU A 175 39.303 29.657 -15.434 1.00 0.00 ATOM 1386 CG GLU A 175 39.796 28.269 -15.054 1.00 0.00 ATOM 1387 CD GLU A 175 41.195 28.289 -14.469 1.00 0.00 ATOM 1388 OE1 GLU A 175 42.116 28.793 -15.147 1.00 0.00 ATOM 1389 OE2 GLU A 175 41.371 27.798 -13.333 1.00 0.00 ATOM 1390 O GLU A 175 37.820 32.461 -15.054 1.00 0.00 ATOM 1391 C GLU A 175 38.939 32.035 -14.806 1.00 0.00 ATOM 1392 N LYS A 176 40.009 32.792 -15.008 1.00 0.00 ATOM 1393 CA LYS A 176 39.834 34.177 -15.416 1.00 0.00 ATOM 1394 CB LYS A 176 41.188 34.879 -15.521 1.00 0.00 ATOM 1395 CG LYS A 176 41.872 35.111 -14.184 1.00 0.00 ATOM 1396 CD LYS A 176 43.212 35.809 -14.362 1.00 0.00 ATOM 1397 CE LYS A 176 43.907 36.019 -13.028 1.00 0.00 ATOM 1398 NZ LYS A 176 45.236 36.669 -13.189 1.00 0.00 ATOM 1399 O LYS A 176 38.108 34.790 -16.960 1.00 0.00 ATOM 1400 C LYS A 176 39.142 34.154 -16.767 1.00 0.00 ATOM 1401 N PRO A 177 39.686 33.346 -17.677 1.00 0.00 ATOM 1402 CA PRO A 177 39.175 33.254 -19.038 1.00 0.00 ATOM 1403 CB PRO A 177 40.112 32.254 -19.716 1.00 0.00 ATOM 1404 CG PRO A 177 41.406 32.401 -18.992 1.00 0.00 ATOM 1405 CD PRO A 177 41.052 32.640 -17.549 1.00 0.00 ATOM 1406 O PRO A 177 36.909 33.455 -19.795 1.00 0.00 ATOM 1407 C PRO A 177 37.735 32.771 -19.190 1.00 0.00 ATOM 1408 N GLU A 178 37.451 31.586 -18.660 1.00 0.00 ATOM 1409 CA GLU A 178 36.120 30.994 -18.755 1.00 0.00 ATOM 1410 CB GLU A 178 36.074 29.659 -18.009 1.00 0.00 ATOM 1411 CG GLU A 178 36.853 28.543 -18.686 1.00 0.00 ATOM 1412 CD GLU A 178 36.888 27.272 -17.857 1.00 0.00 ATOM 1413 OE1 GLU A 178 36.366 27.289 -16.723 1.00 0.00 ATOM 1414 OE2 GLU A 178 37.437 26.262 -18.343 1.00 0.00 ATOM 1415 O GLU A 178 33.998 32.105 -18.739 1.00 0.00 ATOM 1416 C GLU A 178 35.064 31.895 -18.156 1.00 0.00 ATOM 1417 N VAL A 179 35.371 32.437 -16.988 1.00 0.00 ATOM 1418 CA VAL A 179 34.443 33.294 -16.306 1.00 0.00 ATOM 1419 CB VAL A 179 34.934 33.646 -14.889 1.00 0.00 ATOM 1420 CG1 VAL A 179 34.037 34.700 -14.260 1.00 0.00 ATOM 1421 CG2 VAL A 179 34.923 32.412 -14.001 1.00 0.00 ATOM 1422 O VAL A 179 33.083 35.103 -17.111 1.00 0.00 ATOM 1423 C VAL A 179 34.217 34.615 -17.028 1.00 0.00 ATOM 1424 N ARG A 180 35.307 35.202 -17.525 1.00 0.00 ATOM 1425 CA ARG A 180 35.215 36.467 -18.239 1.00 0.00 ATOM 1426 CB ARG A 180 36.525 36.926 -18.748 1.00 0.00 ATOM 1427 CG ARG A 180 37.439 37.413 -17.629 1.00 0.00 ATOM 1428 CD ARG A 180 37.320 38.924 -17.473 1.00 0.00 ATOM 1429 NE ARG A 180 37.909 39.606 -18.622 1.00 0.00 ATOM 1430 CZ ARG A 180 37.758 40.898 -18.886 1.00 0.00 ATOM 1431 NH1 ARG A 180 37.028 41.664 -18.084 1.00 0.00 ATOM 1432 NH2 ARG A 180 38.345 41.426 -19.948 1.00 0.00 ATOM 1433 O ARG A 180 33.370 37.072 -19.632 1.00 0.00 ATOM 1434 C ARG A 180 34.249 36.249 -19.400 1.00 0.00 ATOM 1435 N ARG A 181 34.372 35.131 -20.103 1.00 0.00 ATOM 1436 CA ARG A 181 33.495 34.847 -21.230 1.00 0.00 ATOM 1437 CB ARG A 181 33.960 33.588 -21.965 1.00 0.00 ATOM 1438 CG ARG A 181 35.257 33.765 -22.739 1.00 0.00 ATOM 1439 CD ARG A 181 35.700 32.458 -23.378 1.00 0.00 ATOM 1440 NE ARG A 181 36.950 32.609 -24.123 1.00 0.00 ATOM 1441 CZ ARG A 181 37.594 31.606 -24.709 1.00 0.00 ATOM 1442 NH1 ARG A 181 38.724 31.838 -25.365 1.00 0.00 ATOM 1443 NH2 ARG A 181 37.109 30.374 -24.639 1.00 0.00 ATOM 1444 O ARG A 181 31.110 35.097 -21.404 1.00 0.00 ATOM 1445 C ARG A 181 32.050 34.627 -20.767 1.00 0.00 ATOM 1446 N LEU A 182 31.866 33.908 -19.672 1.00 0.00 ATOM 1447 CA LEU A 182 30.522 33.709 -19.148 1.00 0.00 ATOM 1448 CB LEU A 182 30.570 32.914 -17.839 1.00 0.00 ATOM 1449 CG LEU A 182 30.976 31.444 -17.954 1.00 0.00 ATOM 1450 CD1 LEU A 182 31.158 30.828 -16.575 1.00 0.00 ATOM 1451 CD2 LEU A 182 29.913 30.648 -18.694 1.00 0.00 ATOM 1452 O LEU A 182 28.628 35.179 -19.095 1.00 0.00 ATOM 1453 C LEU A 182 29.826 35.040 -18.862 1.00 0.00 ATOM 1454 N ALA A 183 30.582 36.011 -18.364 1.00 0.00 ATOM 1455 CA ALA A 183 29.998 37.313 -18.058 1.00 0.00 ATOM 1456 CB ALA A 183 31.061 38.253 -17.508 1.00 0.00 ATOM 1457 O ALA A 183 28.335 38.515 -19.312 1.00 0.00 ATOM 1458 C ALA A 183 29.410 37.915 -19.331 1.00 0.00 ATOM 1459 N GLU A 184 30.130 37.767 -20.441 1.00 0.00 ATOM 1460 CA GLU A 184 29.653 38.287 -21.721 1.00 0.00 ATOM 1461 CB GLU A 184 30.741 38.161 -22.790 1.00 0.00 ATOM 1462 CG GLU A 184 31.919 39.099 -22.587 1.00 0.00 ATOM 1463 CD GLU A 184 33.032 38.863 -23.591 1.00 0.00 ATOM 1464 OE1 GLU A 184 32.910 37.917 -24.398 1.00 0.00 ATOM 1465 OE2 GLU A 184 34.022 39.623 -23.569 1.00 0.00 ATOM 1466 O GLU A 184 27.470 38.111 -22.700 1.00 0.00 ATOM 1467 C GLU A 184 28.423 37.519 -22.194 1.00 0.00 ATOM 1468 N GLU A 185 28.444 36.203 -22.038 1.00 0.00 ATOM 1469 CA GLU A 185 27.324 35.375 -22.460 1.00 0.00 ATOM 1470 CB GLU A 185 27.588 33.905 -22.130 1.00 0.00 ATOM 1471 CG GLU A 185 28.672 33.261 -22.981 1.00 0.00 ATOM 1472 CD GLU A 185 28.991 31.846 -22.545 1.00 0.00 ATOM 1473 OE1 GLU A 185 28.421 31.394 -21.532 1.00 0.00 ATOM 1474 OE2 GLU A 185 29.817 31.189 -23.219 1.00 0.00 ATOM 1475 O GLU A 185 24.969 35.856 -22.441 1.00 0.00 ATOM 1476 C GLU A 185 26.015 35.771 -21.788 1.00 0.00 ATOM 1477 N ALA A 186 26.086 35.988 -20.506 1.00 0.00 ATOM 1478 CA ALA A 186 24.897 36.376 -19.752 1.00 0.00 ATOM 1479 CB ALA A 186 25.161 36.273 -18.259 1.00 0.00 ATOM 1480 O ALA A 186 23.359 38.197 -20.010 1.00 0.00 ATOM 1481 C ALA A 186 24.523 37.812 -20.096 1.00 0.00 ATOM 1482 N GLY A 187 25.515 38.695 -20.531 1.00 0.00 ATOM 1483 CA GLY A 187 25.237 40.064 -20.916 1.00 0.00 ATOM 1484 O GLY A 187 24.706 42.013 -19.641 1.00 0.00 ATOM 1485 C GLY A 187 25.504 41.084 -19.826 1.00 0.00 ATOM 1486 N LEU A 188 26.643 40.965 -19.151 1.00 0.00 ATOM 1487 CA LEU A 188 27.022 41.883 -18.064 1.00 0.00 ATOM 1488 CB LEU A 188 28.253 41.356 -17.322 1.00 0.00 ATOM 1489 CG LEU A 188 28.084 40.023 -16.590 1.00 0.00 ATOM 1490 CD1 LEU A 188 29.410 39.556 -16.011 1.00 0.00 ATOM 1491 CD2 LEU A 188 27.087 40.159 -15.450 1.00 0.00 ATOM 1492 O LEU A 188 27.724 43.643 -19.570 1.00 0.00 ATOM 1493 C LEU A 188 27.395 43.317 -18.426 1.00 0.00 ATOM 1494 N SER A 189 27.349 44.168 -17.415 1.00 0.00 ATOM 1495 CA SER A 189 27.653 45.579 -17.549 1.00 0.00 ATOM 1496 CB SER A 189 27.012 46.372 -16.409 1.00 0.00 ATOM 1497 OG SER A 189 25.599 46.324 -16.486 1.00 0.00 ATOM 1498 O SER A 189 29.739 46.365 -18.422 1.00 0.00 ATOM 1499 C SER A 189 29.171 45.756 -17.503 1.00 0.00 ATOM 1500 N THR A 190 29.836 45.161 -16.516 1.00 0.00 ATOM 1501 CA THR A 190 31.330 45.226 -16.535 1.00 0.00 ATOM 1502 CB THR A 190 31.850 46.469 -15.790 1.00 0.00 ATOM 1503 CG2 THR A 190 31.227 47.732 -16.363 1.00 0.00 ATOM 1504 OG1 THR A 190 31.513 46.375 -14.401 1.00 0.00 ATOM 1505 O THR A 190 31.160 43.320 -15.061 1.00 0.00 ATOM 1506 C THR A 190 31.859 43.957 -15.853 1.00 0.00 ATOM 1507 N ALA A 191 33.133 43.650 -16.135 1.00 0.00 ATOM 1508 CA ALA A 191 33.789 42.504 -15.514 1.00 0.00 ATOM 1509 CB ALA A 191 33.786 41.313 -16.460 1.00 0.00 ATOM 1510 O ALA A 191 35.974 43.399 -15.922 1.00 0.00 ATOM 1511 C ALA A 191 35.232 42.792 -15.153 1.00 0.00 ATOM 1512 N LYS A 192 35.630 42.364 -13.971 1.00 0.00 ATOM 1513 CA LYS A 192 37.009 42.569 -13.568 1.00 0.00 ATOM 1514 CB LYS A 192 37.118 43.765 -12.620 1.00 0.00 ATOM 1515 CG LYS A 192 38.546 44.132 -12.248 1.00 0.00 ATOM 1516 CD LYS A 192 38.589 45.419 -11.438 1.00 0.00 ATOM 1517 CE LYS A 192 40.014 45.769 -11.040 1.00 0.00 ATOM 1518 NZ LYS A 192 40.077 47.051 -10.284 1.00 0.00 ATOM 1519 O LYS A 192 37.072 40.984 -11.781 1.00 0.00 ATOM 1520 C LYS A 192 37.542 41.333 -12.851 1.00 0.00 ATOM 1521 N LYS A 193 38.554 40.672 -13.438 1.00 0.00 ATOM 1522 CA LYS A 193 39.128 39.471 -12.824 1.00 0.00 ATOM 1523 CB LYS A 193 40.124 38.807 -13.778 1.00 0.00 ATOM 1524 CG LYS A 193 41.395 39.610 -14.006 1.00 0.00 ATOM 1525 CD LYS A 193 42.328 38.904 -14.976 1.00 0.00 ATOM 1526 CE LYS A 193 43.603 39.702 -15.197 1.00 0.00 ATOM 1527 NZ LYS A 193 44.496 39.058 -16.200 1.00 0.00 ATOM 1528 O LYS A 193 40.407 40.917 -11.359 1.00 0.00 ATOM 1529 C LYS A 193 39.863 39.818 -11.528 1.00 0.00 ATOM 1530 N LYS A 194 39.902 38.822 -10.640 1.00 0.00 ATOM 1531 CA LYS A 194 40.526 38.984 -9.338 1.00 0.00 ATOM 1532 CB LYS A 194 40.130 39.534 -8.219 1.00 0.00 ATOM 1533 CG LYS A 194 40.586 40.975 -8.287 1.00 0.00 ATOM 1534 CD LYS A 194 39.991 41.905 -7.280 1.00 0.00 ATOM 1535 CE LYS A 194 40.289 41.441 -5.903 1.00 0.00 ATOM 1536 NZ LYS A 194 39.927 42.513 -4.887 1.00 0.00 ATOM 1537 O LYS A 194 41.211 36.689 -9.272 1.00 0.00 ATOM 1538 C LYS A 194 41.446 37.848 -8.946 1.00 0.00 ATOM 1539 N ASP A 195 42.551 38.251 -8.151 1.00 0.00 ATOM 1540 CA ASP A 195 43.491 37.246 -7.697 1.00 0.00 ATOM 1541 CB ASP A 195 44.638 37.888 -6.910 1.00 0.00 ATOM 1542 CG ASP A 195 45.613 38.627 -7.803 1.00 0.00 ATOM 1543 OD1 ASP A 195 45.539 38.453 -9.039 1.00 0.00 ATOM 1544 OD2 ASP A 195 46.452 39.382 -7.269 1.00 0.00 ATOM 1545 O ASP A 195 43.142 35.066 -6.774 1.00 0.00 ATOM 1546 C ASP A 195 42.786 36.239 -6.818 1.00 0.00 ATOM 1547 N SER A 196 41.778 36.726 -6.110 1.00 0.00 ATOM 1548 CA SER A 196 41.008 35.919 -5.184 1.00 0.00 ATOM 1549 CB SER A 196 41.080 36.531 -3.785 1.00 0.00 ATOM 1550 OG SER A 196 42.407 36.512 -3.286 1.00 0.00 ATOM 1551 O SER A 196 38.878 34.837 -5.434 1.00 0.00 ATOM 1552 C SER A 196 39.550 35.851 -5.607 1.00 0.00 ATOM 1553 N THR A 197 39.062 36.945 -6.165 1.00 0.00 ATOM 1554 CA THR A 197 37.687 36.971 -6.598 1.00 0.00 ATOM 1555 CB THR A 197 36.771 37.588 -5.526 1.00 0.00 ATOM 1556 CG2 THR A 197 35.322 37.574 -5.993 1.00 0.00 ATOM 1557 OG1 THR A 197 36.872 36.831 -4.312 1.00 0.00 ATOM 1558 O THR A 197 37.896 38.894 -8.015 1.00 0.00 ATOM 1559 C THR A 197 37.415 37.772 -7.866 1.00 0.00 ATOM 1560 N GLY A 198 36.584 37.162 -8.834 1.00 0.00 ATOM 1561 CA GLY A 198 36.230 37.899 -10.038 1.00 0.00 ATOM 1562 O GLY A 198 34.026 38.142 -9.089 1.00 0.00 ATOM 1563 C GLY A 198 34.952 38.666 -9.745 1.00 0.00 ATOM 1564 N ILE A 199 34.906 39.872 -10.255 1.00 0.00 ATOM 1565 CA ILE A 199 33.733 40.721 -10.016 1.00 0.00 ATOM 1566 CB ILE A 199 34.137 42.102 -9.470 1.00 0.00 ATOM 1567 CG1 ILE A 199 34.860 41.954 -8.129 1.00 0.00 ATOM 1568 CG2 ILE A 199 32.908 42.974 -9.259 1.00 0.00 ATOM 1569 CD1 ILE A 199 35.494 43.235 -7.632 1.00 0.00 ATOM 1570 O ILE A 199 33.510 41.204 -12.353 1.00 0.00 ATOM 1571 C ILE A 199 32.944 40.930 -11.293 1.00 0.00 ATOM 1572 N CYS A 200 31.627 40.778 -11.172 1.00 0.00 ATOM 1573 CA CYS A 200 30.746 41.008 -12.301 1.00 0.00 ATOM 1574 CB CYS A 200 30.065 39.700 -12.709 1.00 0.00 ATOM 1575 SG CYS A 200 31.203 38.407 -13.260 1.00 0.00 ATOM 1576 O CYS A 200 29.088 41.877 -10.824 1.00 0.00 ATOM 1577 C CYS A 200 29.707 42.019 -11.892 1.00 0.00 ATOM 1578 N PHE A 201 29.559 43.068 -12.712 1.00 0.00 ATOM 1579 CA PHE A 201 28.586 44.101 -12.470 1.00 0.00 ATOM 1580 CB PHE A 201 29.262 45.478 -12.532 1.00 0.00 ATOM 1581 CG PHE A 201 28.337 46.634 -12.275 1.00 0.00 ATOM 1582 CD1 PHE A 201 27.879 46.908 -10.990 1.00 0.00 ATOM 1583 CD2 PHE A 201 27.926 47.452 -13.319 1.00 0.00 ATOM 1584 CE1 PHE A 201 27.021 47.984 -10.750 1.00 0.00 ATOM 1585 CE2 PHE A 201 27.069 48.530 -13.091 1.00 0.00 ATOM 1586 CZ PHE A 201 26.618 48.796 -11.804 1.00 0.00 ATOM 1587 O PHE A 201 27.634 43.991 -14.650 1.00 0.00 ATOM 1588 C PHE A 201 27.421 44.057 -13.442 1.00 0.00 ATOM 1589 N ILE A 202 26.198 44.110 -12.891 1.00 0.00 ATOM 1590 CA ILE A 202 25.005 44.035 -13.739 1.00 0.00 ATOM 1591 CB ILE A 202 24.316 42.664 -13.646 1.00 0.00 ATOM 1592 CG1 ILE A 202 23.224 42.492 -14.725 1.00 0.00 ATOM 1593 CG2 ILE A 202 23.756 42.472 -12.241 1.00 0.00 ATOM 1594 CD1 ILE A 202 22.743 41.068 -14.913 1.00 0.00 ATOM 1595 O ILE A 202 23.884 45.572 -12.277 1.00 0.00 ATOM 1596 C ILE A 202 23.958 45.097 -13.404 1.00 0.00 ATOM 1597 N GLY A 203 23.068 45.506 -14.418 1.00 0.00 ATOM 1598 CA GLY A 203 22.056 46.522 -14.192 1.00 0.00 ATOM 1599 O GLY A 203 21.162 44.873 -12.656 1.00 0.00 ATOM 1600 C GLY A 203 21.398 46.083 -12.882 1.00 0.00 ATOM 1601 N GLU A 204 21.171 47.036 -12.001 1.00 0.00 ATOM 1602 CA GLU A 204 20.672 46.767 -10.662 1.00 0.00 ATOM 1603 CB GLU A 204 20.355 48.075 -9.935 1.00 0.00 ATOM 1604 CG GLU A 204 19.851 47.889 -8.512 1.00 0.00 ATOM 1605 CD GLU A 204 19.588 49.207 -7.811 1.00 0.00 ATOM 1606 OE1 GLU A 204 19.833 50.267 -8.425 1.00 0.00 ATOM 1607 OE2 GLU A 204 19.137 49.181 -6.646 1.00 0.00 ATOM 1608 O GLU A 204 19.278 44.942 -9.924 1.00 0.00 ATOM 1609 C GLU A 204 19.391 45.927 -10.666 1.00 0.00 ATOM 1610 N LYS A 205 18.442 46.277 -11.524 1.00 0.00 ATOM 1611 CA LYS A 205 17.207 45.512 -11.565 1.00 0.00 ATOM 1612 CB LYS A 205 16.227 46.128 -12.565 1.00 0.00 ATOM 1613 CG LYS A 205 15.678 47.482 -12.145 1.00 0.00 ATOM 1614 CD LYS A 205 14.737 48.046 -13.196 1.00 0.00 ATOM 1615 CE LYS A 205 14.157 49.382 -12.759 1.00 0.00 ATOM 1616 NZ LYS A 205 13.254 49.961 -13.792 1.00 0.00 ATOM 1617 O LYS A 205 16.644 43.176 -11.632 1.00 0.00 ATOM 1618 C LYS A 205 17.439 44.046 -11.979 1.00 0.00 ATOM 1619 N ASN A 206 18.515 43.813 -12.696 1.00 0.00 ATOM 1620 CA ASN A 206 18.796 42.438 -13.210 1.00 0.00 ATOM 1621 CB ASN A 206 19.329 42.505 -14.644 1.00 0.00 ATOM 1622 CG ASN A 206 18.290 43.010 -15.626 1.00 0.00 ATOM 1623 ND2 ASN A 206 18.550 44.173 -16.213 1.00 0.00 ATOM 1624 OD1 ASN A 206 17.269 42.363 -15.854 1.00 0.00 ATOM 1625 O ASN A 206 20.358 40.621 -12.926 1.00 0.00 ATOM 1626 C ASN A 206 19.815 41.623 -12.445 1.00 0.00 ATOM 1627 N PHE A 207 20.069 42.062 -11.230 1.00 0.00 ATOM 1628 CA PHE A 207 21.033 41.382 -10.400 1.00 0.00 ATOM 1629 CB PHE A 207 21.117 42.118 -9.050 1.00 0.00 ATOM 1630 CG PHE A 207 22.239 41.647 -8.177 1.00 0.00 ATOM 1631 CD1 PHE A 207 23.501 42.239 -8.271 1.00 0.00 ATOM 1632 CD2 PHE A 207 22.046 40.599 -7.268 1.00 0.00 ATOM 1633 CE1 PHE A 207 24.564 41.796 -7.458 1.00 0.00 ATOM 1634 CE2 PHE A 207 23.094 40.158 -6.461 1.00 0.00 ATOM 1635 CZ PHE A 207 24.359 40.756 -6.557 1.00 0.00 ATOM 1636 O PHE A 207 21.606 39.057 -10.243 1.00 0.00 ATOM 1637 C PHE A 207 20.705 39.894 -10.144 1.00 0.00 ATOM 1638 N LYS A 208 19.512 39.606 -9.730 1.00 0.00 ATOM 1639 CA LYS A 208 19.146 38.202 -9.452 1.00 0.00 ATOM 1640 CB LYS A 208 17.709 38.114 -8.937 1.00 0.00 ATOM 1641 CG LYS A 208 17.514 38.675 -7.538 1.00 0.00 ATOM 1642 CD LYS A 208 16.066 38.554 -7.092 1.00 0.00 ATOM 1643 CE LYS A 208 15.866 39.137 -5.702 1.00 0.00 ATOM 1644 NZ LYS A 208 14.446 39.056 -5.262 1.00 0.00 ATOM 1645 O LYS A 208 19.723 36.189 -10.594 1.00 0.00 ATOM 1646 C LYS A 208 19.316 37.363 -10.710 1.00 0.00 ATOM 1647 N ASN A 209 19.029 37.924 -11.866 1.00 0.00 ATOM 1648 CA ASN A 209 19.210 37.144 -13.095 1.00 0.00 ATOM 1649 CB ASN A 209 18.782 37.984 -14.306 1.00 0.00 ATOM 1650 CG ASN A 209 17.285 38.279 -14.329 1.00 0.00 ATOM 1651 ND2 ASN A 209 16.488 37.415 -13.702 1.00 0.00 ATOM 1652 OD1 ASN A 209 16.856 39.277 -14.926 1.00 0.00 ATOM 1653 O ASN A 209 21.017 35.647 -13.632 1.00 0.00 ATOM 1654 C ASN A 209 20.688 36.800 -13.276 1.00 0.00 ATOM 1655 N PHE A 210 21.583 37.739 -13.046 1.00 0.00 ATOM 1656 CA PHE A 210 23.028 37.487 -13.138 1.00 0.00 ATOM 1657 CB PHE A 210 23.857 38.739 -12.892 1.00 0.00 ATOM 1658 CG PHE A 210 25.312 38.441 -12.637 1.00 0.00 ATOM 1659 CD1 PHE A 210 26.165 38.121 -13.694 1.00 0.00 ATOM 1660 CD2 PHE A 210 25.813 38.417 -11.339 1.00 0.00 ATOM 1661 CE1 PHE A 210 27.503 37.812 -13.460 1.00 0.00 ATOM 1662 CE2 PHE A 210 27.150 38.104 -11.098 1.00 0.00 ATOM 1663 CZ PHE A 210 27.996 37.812 -12.160 1.00 0.00 ATOM 1664 O PHE A 210 24.190 35.446 -12.600 1.00 0.00 ATOM 1665 C PHE A 210 23.464 36.355 -12.196 1.00 0.00 ATOM 1666 N LEU A 211 23.010 36.403 -10.943 1.00 0.00 ATOM 1667 CA LEU A 211 23.361 35.377 -9.971 1.00 0.00 ATOM 1668 CB LEU A 211 22.773 35.714 -8.600 1.00 0.00 ATOM 1669 CG LEU A 211 23.077 34.725 -7.470 1.00 0.00 ATOM 1670 CD1 LEU A 211 24.575 34.636 -7.223 1.00 0.00 ATOM 1671 CD2 LEU A 211 22.407 35.165 -6.178 1.00 0.00 ATOM 1672 O LEU A 211 23.516 33.001 -10.296 1.00 0.00 ATOM 1673 C LEU A 211 22.820 34.017 -10.406 1.00 0.00 ATOM 1674 N SER A 212 21.593 33.965 -10.925 1.00 0.00 ATOM 1675 CA SER A 212 21.012 32.709 -11.400 1.00 0.00 ATOM 1676 CB SER A 212 19.617 32.881 -11.903 1.00 0.00 ATOM 1677 OG SER A 212 18.747 33.181 -10.828 1.00 0.00 ATOM 1678 O SER A 212 22.066 30.920 -12.600 1.00 0.00 ATOM 1679 C SER A 212 21.800 32.123 -12.571 1.00 0.00 ATOM 1680 N ASN A 213 22.161 32.949 -13.543 1.00 0.00 ATOM 1681 CA ASN A 213 22.893 32.462 -14.695 1.00 0.00 ATOM 1682 CB ASN A 213 23.164 33.513 -15.739 1.00 0.00 ATOM 1683 CG ASN A 213 21.891 33.867 -16.534 1.00 0.00 ATOM 1684 ND2 ASN A 213 21.943 35.007 -17.183 1.00 0.00 ATOM 1685 OD1 ASN A 213 20.894 33.149 -16.535 1.00 0.00 ATOM 1686 O ASN A 213 24.627 30.803 -14.871 1.00 0.00 ATOM 1687 C ASN A 213 24.251 31.850 -14.338 1.00 0.00 ATOM 1688 N TYR A 214 24.939 32.435 -13.372 1.00 0.00 ATOM 1689 CA TYR A 214 26.159 31.816 -12.870 1.00 0.00 ATOM 1690 CB TYR A 214 26.758 32.653 -11.737 1.00 0.00 ATOM 1691 CG TYR A 214 28.009 32.058 -11.132 1.00 0.00 ATOM 1692 CD1 TYR A 214 29.239 32.196 -11.762 1.00 0.00 ATOM 1693 CD2 TYR A 214 27.955 31.359 -9.933 1.00 0.00 ATOM 1694 CE1 TYR A 214 30.386 31.657 -11.215 1.00 0.00 ATOM 1695 CE2 TYR A 214 29.093 30.814 -9.372 1.00 0.00 ATOM 1696 CZ TYR A 214 30.316 30.966 -10.022 1.00 0.00 ATOM 1697 OH TYR A 214 31.458 30.428 -9.477 1.00 0.00 ATOM 1698 O TYR A 214 26.686 29.475 -12.646 1.00 0.00 ATOM 1699 C TYR A 214 25.936 30.409 -12.324 1.00 0.00 ATOM 1700 N LEU A 215 24.920 30.283 -11.490 1.00 0.00 ATOM 1701 CA LEU A 215 24.618 28.970 -10.916 1.00 0.00 ATOM 1702 CB LEU A 215 23.484 29.079 -9.895 1.00 0.00 ATOM 1703 CG LEU A 215 23.797 29.857 -8.616 1.00 0.00 ATOM 1704 CD1 LEU A 215 22.540 30.040 -7.776 1.00 0.00 ATOM 1705 CD2 LEU A 215 24.827 29.118 -7.774 1.00 0.00 ATOM 1706 O LEU A 215 24.638 26.792 -11.848 1.00 0.00 ATOM 1707 C LEU A 215 24.207 27.944 -11.960 1.00 0.00 ATOM 1708 N PRO A 216 23.245 28.360 -12.884 1.00 0.00 ATOM 1709 CA PRO A 216 22.893 27.355 -13.899 1.00 0.00 ATOM 1710 CB PRO A 216 21.775 28.012 -14.698 1.00 0.00 ATOM 1711 CG PRO A 216 21.323 29.123 -13.862 1.00 0.00 ATOM 1712 CD PRO A 216 22.445 29.550 -12.985 1.00 0.00 ATOM 1713 O PRO A 216 24.898 27.707 -15.170 1.00 0.00 ATOM 1714 C PRO A 216 24.120 26.890 -14.677 1.00 0.00 ATOM 1715 N ALA A 217 24.350 25.572 -14.762 1.00 0.00 ATOM 1716 CA ALA A 217 25.474 25.015 -15.490 1.00 0.00 ATOM 1717 CB ALA A 217 25.531 23.507 -15.304 1.00 0.00 ATOM 1718 O ALA A 217 24.216 25.366 -17.518 1.00 0.00 ATOM 1719 C ALA A 217 25.314 25.340 -16.960 1.00 0.00 ATOM 1720 N GLN A 218 26.466 25.344 -17.655 1.00 0.00 ATOM 1721 CA GLN A 218 26.461 25.631 -19.138 1.00 0.00 ATOM 1722 CB GLN A 218 27.537 26.662 -19.492 1.00 0.00 ATOM 1723 CG GLN A 218 27.381 27.992 -18.772 1.00 0.00 ATOM 1724 CD GLN A 218 26.106 28.716 -19.160 1.00 0.00 ATOM 1725 OE1 GLN A 218 25.800 28.867 -20.342 1.00 0.00 ATOM 1726 NE2 GLN A 218 25.361 29.172 -18.159 1.00 0.00 ATOM 1727 O GLN A 218 27.446 23.462 -19.418 1.00 0.00 ATOM 1728 C GLN A 218 26.734 24.351 -19.902 1.00 0.00 ATOM 1729 N PRO A 219 26.205 24.221 -21.064 1.00 0.00 ATOM 1730 CA PRO A 219 26.489 23.048 -21.886 1.00 0.00 ATOM 1731 CB PRO A 219 25.902 23.402 -23.254 1.00 0.00 ATOM 1732 CG PRO A 219 24.768 24.322 -22.944 1.00 0.00 ATOM 1733 CD PRO A 219 25.238 25.199 -21.818 1.00 0.00 ATOM 1734 O PRO A 219 28.334 21.535 -21.977 1.00 0.00 ATOM 1735 C PRO A 219 27.975 22.708 -22.035 1.00 0.00 ATOM 1736 N GLY A 220 28.816 23.709 -22.277 1.00 0.00 ATOM 1737 CA GLY A 220 30.229 23.450 -22.467 1.00 0.00 ATOM 1738 O GLY A 220 31.983 22.224 -21.325 1.00 0.00 ATOM 1739 C GLY A 220 30.946 22.929 -21.223 1.00 0.00 ATOM 1740 N ARG A 221 30.462 23.057 -19.916 1.00 0.00 ATOM 1741 CA ARG A 221 31.021 22.487 -18.687 1.00 0.00 ATOM 1742 CB ARG A 221 31.151 23.504 -17.583 1.00 0.00 ATOM 1743 CG ARG A 221 29.842 24.090 -17.086 1.00 0.00 ATOM 1744 CD ARG A 221 30.064 25.139 -15.999 1.00 0.00 ATOM 1745 NE ARG A 221 30.732 26.328 -16.562 1.00 0.00 ATOM 1746 CZ ARG A 221 31.077 27.379 -15.802 1.00 0.00 ATOM 1747 NH1 ARG A 221 30.815 27.353 -14.489 1.00 0.00 ATOM 1748 NH2 ARG A 221 31.678 28.401 -16.379 1.00 0.00 ATOM 1749 O ARG A 221 30.514 20.540 -17.392 1.00 0.00 ATOM 1750 C ARG A 221 30.103 21.371 -18.206 1.00 0.00 ATOM 1751 N MET A 222 28.852 21.374 -18.657 1.00 0.00 ATOM 1752 CA MET A 222 27.908 20.341 -18.245 1.00 0.00 ATOM 1753 CB MET A 222 26.594 20.478 -19.016 1.00 0.00 ATOM 1754 CG MET A 222 25.551 19.435 -18.655 1.00 0.00 ATOM 1755 SD MET A 222 24.054 19.575 -19.650 1.00 0.00 ATOM 1756 CE MET A 222 24.641 18.979 -21.233 1.00 0.00 ATOM 1757 O MET A 222 28.321 18.048 -17.664 1.00 0.00 ATOM 1758 C MET A 222 28.446 18.948 -18.499 1.00 0.00 ATOM 1759 N MET A 223 29.009 18.702 -19.678 1.00 0.00 ATOM 1760 CA MET A 223 29.571 17.391 -19.962 1.00 0.00 ATOM 1761 CB MET A 223 29.776 17.213 -21.469 1.00 0.00 ATOM 1762 CG MET A 223 28.487 17.219 -22.275 1.00 0.00 ATOM 1763 SD MET A 223 27.395 15.850 -21.852 1.00 0.00 ATOM 1764 CE MET A 223 28.285 14.471 -22.568 1.00 0.00 ATOM 1765 O MET A 223 31.884 17.910 -19.448 1.00 0.00 ATOM 1766 C MET A 223 30.930 17.114 -19.316 1.00 0.00 ATOM 1767 N THR A 224 30.995 15.964 -18.499 1.00 0.00 ATOM 1768 CA THR A 224 32.266 15.599 -17.891 1.00 0.00 ATOM 1769 CB THR A 224 31.945 14.427 -16.896 1.00 0.00 ATOM 1770 CG2 THR A 224 33.200 14.024 -16.116 1.00 0.00 ATOM 1771 OG1 THR A 224 30.907 14.815 -15.998 1.00 0.00 ATOM 1772 O THR A 224 34.554 15.584 -18.668 1.00 0.00 ATOM 1773 C THR A 224 33.387 15.251 -18.897 1.00 0.00 ATOM 1774 N VAL A 225 33.035 14.568 -19.969 1.00 0.00 ATOM 1775 CA VAL A 225 34.017 14.184 -20.982 1.00 0.00 ATOM 1776 CB VAL A 225 33.365 13.382 -22.124 1.00 0.00 ATOM 1777 CG1 VAL A 225 34.357 13.169 -23.258 1.00 0.00 ATOM 1778 CG2 VAL A 225 32.905 12.021 -21.625 1.00 0.00 ATOM 1779 O VAL A 225 35.904 15.539 -21.661 1.00 0.00 ATOM 1780 C VAL A 225 34.667 15.442 -21.576 1.00 0.00 ATOM 1781 N ASP A 226 33.848 16.412 -21.983 1.00 0.00 ATOM 1782 CA ASP A 226 34.341 17.646 -22.587 1.00 0.00 ATOM 1783 CB ASP A 226 33.178 18.466 -23.148 1.00 0.00 ATOM 1784 CG ASP A 226 32.588 17.857 -24.405 1.00 0.00 ATOM 1785 OD1 ASP A 226 33.223 16.949 -24.979 1.00 0.00 ATOM 1786 OD2 ASP A 226 31.490 18.290 -24.815 1.00 0.00 ATOM 1787 O ASP A 226 36.160 19.044 -21.752 1.00 0.00 ATOM 1788 C ASP A 226 35.078 18.464 -21.501 1.00 0.00 ATOM 1789 N GLY A 227 34.471 18.554 -20.330 1.00 0.00 ATOM 1790 CA GLY A 227 35.051 19.292 -19.212 1.00 0.00 ATOM 1791 O GLY A 227 37.369 19.316 -18.565 1.00 0.00 ATOM 1792 C GLY A 227 36.349 18.627 -18.803 1.00 0.00 ATOM 1793 N ARG A 228 36.325 17.296 -18.677 1.00 0.00 ATOM 1794 CA ARG A 228 37.526 16.557 -18.290 1.00 0.00 ATOM 1795 CB ARG A 228 37.428 15.112 -18.476 1.00 0.00 ATOM 1796 CG ARG A 228 38.699 14.354 -18.144 1.00 0.00 ATOM 1797 CD ARG A 228 38.529 12.844 -18.224 1.00 0.00 ATOM 1798 NE ARG A 228 39.719 12.116 -17.799 1.00 0.00 ATOM 1799 CZ ARG A 228 39.963 11.735 -16.548 1.00 0.00 ATOM 1800 NH1 ARG A 228 39.104 12.019 -15.576 1.00 0.00 ATOM 1801 NH2 ARG A 228 41.075 11.070 -16.260 1.00 0.00 ATOM 1802 O ARG A 228 39.774 17.070 -18.956 1.00 0.00 ATOM 1803 C ARG A 228 38.626 16.810 -19.315 1.00 0.00 ATOM 1804 N ASP A 229 38.281 16.741 -20.615 1.00 0.00 ATOM 1805 CA ASP A 229 39.246 16.967 -21.682 1.00 0.00 ATOM 1806 CB ASP A 229 38.608 16.700 -23.047 1.00 0.00 ATOM 1807 CG ASP A 229 38.388 15.224 -23.308 1.00 0.00 ATOM 1808 OD1 ASP A 229 38.944 14.397 -22.554 1.00 0.00 ATOM 1809 OD2 ASP A 229 37.659 14.892 -24.265 1.00 0.00 ATOM 1810 O ASP A 229 41.007 18.587 -21.852 1.00 0.00 ATOM 1811 C ASP A 229 39.809 18.386 -21.675 1.00 0.00 ATOM 1812 N MET A 230 38.961 19.373 -21.488 1.00 0.00 ATOM 1813 CA MET A 230 39.400 20.764 -21.482 1.00 0.00 ATOM 1814 CB MET A 230 38.189 21.699 -21.449 1.00 0.00 ATOM 1815 CG MET A 230 37.351 21.675 -22.715 1.00 0.00 ATOM 1816 SD MET A 230 38.281 22.187 -24.175 1.00 0.00 ATOM 1817 CE MET A 230 38.539 23.924 -23.821 1.00 0.00 ATOM 1818 O MET A 230 41.313 21.780 -20.464 1.00 0.00 ATOM 1819 C MET A 230 40.286 21.119 -20.291 1.00 0.00 ATOM 1820 N GLY A 231 39.898 20.661 -19.093 1.00 0.00 ATOM 1821 CA GLY A 231 40.688 20.946 -17.906 1.00 0.00 ATOM 1822 O GLY A 231 43.104 20.889 -17.730 1.00 0.00 ATOM 1823 C GLY A 231 42.076 20.303 -18.053 1.00 0.00 ATOM 1824 N GLU A 232 42.097 19.079 -18.505 1.00 0.00 ATOM 1825 CA GLU A 232 43.326 18.361 -18.699 1.00 0.00 ATOM 1826 CB GLU A 232 43.044 16.905 -19.077 1.00 0.00 ATOM 1827 CG GLU A 232 42.463 16.072 -17.945 1.00 0.00 ATOM 1828 CD GLU A 232 42.082 14.674 -18.388 1.00 0.00 ATOM 1829 OE1 GLU A 232 42.206 14.378 -19.594 1.00 0.00 ATOM 1830 OE2 GLU A 232 41.660 13.872 -17.529 1.00 0.00 ATOM 1831 O GLU A 232 45.383 19.154 -19.653 1.00 0.00 ATOM 1832 C GLU A 232 44.169 18.972 -19.803 1.00 0.00 ATOM 1833 N HIS A 233 43.553 19.306 -21.003 1.00 0.00 ATOM 1834 CA HIS A 233 44.317 19.865 -22.114 1.00 0.00 ATOM 1835 CB HIS A 233 43.388 20.209 -23.281 1.00 0.00 ATOM 1836 CG HIS A 233 44.096 20.790 -24.465 1.00 0.00 ATOM 1837 CD2 HIS A 233 44.190 22.108 -25.078 1.00 0.00 ATOM 1838 ND1 HIS A 233 44.901 20.036 -25.293 1.00 0.00 ATOM 1839 CE1 HIS A 233 45.394 20.828 -26.263 1.00 0.00 ATOM 1840 NE2 HIS A 233 44.974 22.072 -26.139 1.00 0.00 ATOM 1841 O HIS A 233 46.215 21.378 -22.051 1.00 0.00 ATOM 1842 C HIS A 233 45.045 21.132 -21.670 1.00 0.00 ATOM 1843 N ALA A 234 44.367 21.933 -20.858 1.00 0.00 ATOM 1844 CA ALA A 234 44.866 23.239 -20.448 1.00 0.00 ATOM 1845 CB ALA A 234 43.704 24.191 -20.209 1.00 0.00 ATOM 1846 O ALA A 234 46.295 24.175 -18.763 1.00 0.00 ATOM 1847 C ALA A 234 45.687 23.182 -19.162 1.00 0.00 ATOM 1848 N GLY A 235 45.718 22.028 -18.508 1.00 0.00 ATOM 1849 CA GLY A 235 46.469 21.882 -17.273 1.00 0.00 ATOM 1850 O GLY A 235 46.465 23.158 -15.230 1.00 0.00 ATOM 1851 C GLY A 235 45.799 22.673 -16.148 1.00 0.00 ATOM 1852 N LEU A 236 44.447 22.843 -16.248 1.00 0.00 ATOM 1853 CA LEU A 236 43.810 23.583 -15.175 1.00 0.00 ATOM 1854 CB LEU A 236 42.371 23.945 -15.552 1.00 0.00 ATOM 1855 CG LEU A 236 42.201 24.892 -16.740 1.00 0.00 ATOM 1856 CD1 LEU A 236 40.730 25.071 -17.079 1.00 0.00 ATOM 1857 CD2 LEU A 236 42.786 26.262 -16.425 1.00 0.00 ATOM 1858 O LEU A 236 43.805 21.488 -14.029 1.00 0.00 ATOM 1859 C LEU A 236 43.793 22.713 -13.940 1.00 0.00 ATOM 1860 N MET A 237 43.875 23.351 -12.785 1.00 0.00 ATOM 1861 CA MET A 237 43.854 22.636 -11.515 1.00 0.00 ATOM 1862 CB MET A 237 44.642 23.409 -10.456 1.00 0.00 ATOM 1863 CG MET A 237 46.119 23.568 -10.774 1.00 0.00 ATOM 1864 SD MET A 237 46.962 21.986 -10.972 1.00 0.00 ATOM 1865 CE MET A 237 46.891 21.353 -9.298 1.00 0.00 ATOM 1866 O MET A 237 42.366 21.459 -10.050 1.00 0.00 ATOM 1867 C MET A 237 42.513 22.369 -10.871 1.00 0.00 ATOM 1868 N TYR A 238 41.454 22.844 -11.648 1.00 0.00 ATOM 1869 CA TYR A 238 40.136 22.683 -11.084 1.00 0.00 ATOM 1870 CB TYR A 238 39.808 23.815 -10.099 1.00 0.00 ATOM 1871 CG TYR A 238 40.688 23.850 -8.896 1.00 0.00 ATOM 1872 CD1 TYR A 238 41.944 24.437 -8.878 1.00 0.00 ATOM 1873 CD2 TYR A 238 40.280 23.271 -7.719 1.00 0.00 ATOM 1874 CE1 TYR A 238 42.749 24.469 -7.788 1.00 0.00 ATOM 1875 CE2 TYR A 238 41.071 23.294 -6.562 1.00 0.00 ATOM 1876 CZ TYR A 238 42.294 23.907 -6.636 1.00 0.00 ATOM 1877 OH TYR A 238 43.072 23.896 -5.497 1.00 0.00 ATOM 1878 O TYR A 238 39.158 23.159 -13.211 1.00 0.00 ATOM 1879 C TYR A 238 39.062 22.563 -12.135 1.00 0.00 ATOM 1880 N TYR A 239 38.037 21.784 -11.829 1.00 0.00 ATOM 1881 CA TYR A 239 36.899 21.586 -12.717 1.00 0.00 ATOM 1882 CB TYR A 239 36.713 20.063 -12.882 1.00 0.00 ATOM 1883 CG TYR A 239 35.601 19.711 -13.857 1.00 0.00 ATOM 1884 CD1 TYR A 239 35.792 19.878 -15.219 1.00 0.00 ATOM 1885 CD2 TYR A 239 34.386 19.226 -13.396 1.00 0.00 ATOM 1886 CE1 TYR A 239 34.775 19.564 -16.104 1.00 0.00 ATOM 1887 CE2 TYR A 239 33.360 18.906 -14.278 1.00 0.00 ATOM 1888 CZ TYR A 239 33.582 19.082 -15.627 1.00 0.00 ATOM 1889 OH TYR A 239 32.578 18.778 -16.538 1.00 0.00 ATOM 1890 O TYR A 239 35.206 21.955 -11.056 1.00 0.00 ATOM 1891 C TYR A 239 35.720 22.339 -12.106 1.00 0.00 ATOM 1892 N THR A 240 35.360 23.460 -12.724 1.00 0.00 ATOM 1893 CA THR A 240 34.335 24.341 -12.174 1.00 0.00 ATOM 1894 CB THR A 240 34.711 25.823 -12.347 1.00 0.00 ATOM 1895 CG2 THR A 240 33.621 26.720 -11.782 1.00 0.00 ATOM 1896 OG1 THR A 240 35.937 26.091 -11.655 1.00 0.00 ATOM 1897 O THR A 240 32.818 24.348 -14.042 1.00 0.00 ATOM 1898 C THR A 240 32.968 24.166 -12.832 1.00 0.00 ATOM 1899 N ILE A 241 31.974 23.827 -11.998 1.00 0.00 ATOM 1900 CA ILE A 241 30.604 23.609 -12.449 1.00 0.00 ATOM 1901 CB ILE A 241 30.051 22.267 -11.938 1.00 0.00 ATOM 1902 CG1 ILE A 241 30.909 21.107 -12.446 1.00 0.00 ATOM 1903 CG2 ILE A 241 28.624 22.059 -12.425 1.00 0.00 ATOM 1904 CD1 ILE A 241 30.559 19.770 -11.827 1.00 0.00 ATOM 1905 O ILE A 241 29.329 24.780 -10.782 1.00 0.00 ATOM 1906 C ILE A 241 29.613 24.662 -11.995 1.00 0.00 ATOM 1907 N GLY A 242 29.074 25.449 -12.913 1.00 0.00 ATOM 1908 CA GLY A 242 28.134 26.515 -12.583 1.00 0.00 ATOM 1909 O GLY A 242 25.783 26.675 -12.213 1.00 0.00 ATOM 1910 C GLY A 242 26.744 25.931 -12.408 1.00 0.00 ATOM 1911 N GLN A 243 26.568 24.534 -12.434 1.00 0.00 ATOM 1912 CA GLN A 243 25.266 23.899 -12.248 1.00 0.00 ATOM 1913 CB GLN A 243 25.411 22.384 -12.189 1.00 0.00 ATOM 1914 CG GLN A 243 25.835 21.760 -13.511 1.00 0.00 ATOM 1915 CD GLN A 243 25.521 20.271 -13.597 1.00 0.00 ATOM 1916 OE1 GLN A 243 24.410 19.848 -13.274 1.00 0.00 ATOM 1917 NE2 GLN A 243 26.489 19.481 -14.051 1.00 0.00 ATOM 1918 O GLN A 243 25.419 24.840 -10.027 1.00 0.00 ATOM 1919 C GLN A 243 24.690 24.451 -10.936 1.00 0.00 ATOM 1920 N ARG A 244 23.383 24.465 -10.849 1.00 0.00 ATOM 1921 CA ARG A 244 22.714 25.112 -9.747 1.00 0.00 ATOM 1922 CB ARG A 244 21.212 25.215 -10.022 1.00 0.00 ATOM 1923 CG ARG A 244 20.852 26.155 -11.161 1.00 0.00 ATOM 1924 CD ARG A 244 19.346 26.238 -11.353 1.00 0.00 ATOM 1925 NE ARG A 244 18.981 27.193 -12.396 1.00 0.00 ATOM 1926 CZ ARG A 244 17.730 27.449 -12.768 1.00 0.00 ATOM 1927 NH1 ARG A 244 17.490 28.334 -13.728 1.00 0.00 ATOM 1928 NH2 ARG A 244 16.722 26.819 -12.183 1.00 0.00 ATOM 1929 O ARG A 244 23.132 23.142 -8.441 1.00 0.00 ATOM 1930 C ARG A 244 22.898 24.352 -8.440 1.00 0.00 ATOM 1931 N GLY A 245 22.837 25.071 -7.357 1.00 0.00 ATOM 1932 CA GLY A 245 23.040 24.472 -6.050 1.00 0.00 ATOM 1933 O GLY A 245 22.219 22.614 -4.803 1.00 0.00 ATOM 1934 C GLY A 245 21.965 23.488 -5.632 1.00 0.00 ATOM 1935 N GLY A 246 20.792 23.569 -6.223 1.00 0.00 ATOM 1936 CA GLY A 246 19.715 22.666 -5.852 1.00 0.00 ATOM 1937 O GLY A 246 18.109 21.118 -6.794 1.00 0.00 ATOM 1938 C GLY A 246 19.190 21.698 -6.933 1.00 0.00 ATOM 1939 N LEU A 247 19.971 21.426 -7.979 1.00 0.00 ATOM 1940 CA LEU A 247 19.578 20.433 -8.984 1.00 0.00 ATOM 1941 CB LEU A 247 19.489 21.125 -10.355 1.00 0.00 ATOM 1942 CG LEU A 247 20.766 21.742 -10.916 1.00 0.00 ATOM 1943 CD1 LEU A 247 21.585 20.661 -11.598 1.00 0.00 ATOM 1944 CD2 LEU A 247 20.403 22.832 -11.923 1.00 0.00 ATOM 1945 O LEU A 247 21.629 19.238 -8.596 1.00 0.00 ATOM 1946 C LEU A 247 20.532 19.254 -9.155 1.00 0.00 ATOM 1947 N GLY A 248 20.159 18.266 -10.067 1.00 0.00 ATOM 1948 CA GLY A 248 21.004 17.110 -10.298 1.00 0.00 ATOM 1949 O GLY A 248 22.294 18.299 -11.940 1.00 0.00 ATOM 1950 C GLY A 248 22.281 17.437 -11.033 1.00 0.00 ATOM 1951 N ILE A 249 23.399 16.739 -10.686 1.00 0.00 ATOM 1952 CA ILE A 249 24.652 16.870 -11.406 1.00 0.00 ATOM 1953 CB ILE A 249 25.637 17.624 -10.494 1.00 0.00 ATOM 1954 CG1 ILE A 249 25.085 19.006 -10.141 1.00 0.00 ATOM 1955 CG2 ILE A 249 26.978 17.804 -11.191 1.00 0.00 ATOM 1956 CD1 ILE A 249 25.911 19.750 -9.114 1.00 0.00 ATOM 1957 O ILE A 249 25.387 14.644 -10.841 1.00 0.00 ATOM 1958 C ILE A 249 25.201 15.464 -11.725 1.00 0.00 ATOM 1959 N GLY A 250 25.541 15.256 -13.009 1.00 0.00 ATOM 1960 CA GLY A 250 26.107 13.950 -13.419 1.00 0.00 ATOM 1961 O GLY A 250 28.274 14.538 -12.473 1.00 0.00 ATOM 1962 C GLY A 250 27.403 13.693 -12.670 1.00 0.00 ATOM 1963 N GLY A 251 27.536 12.439 -12.201 1.00 0.00 ATOM 1964 CA GLY A 251 28.720 11.960 -11.536 1.00 0.00 ATOM 1965 O GLY A 251 29.628 11.648 -9.396 1.00 0.00 ATOM 1966 C GLY A 251 28.737 12.184 -10.035 1.00 0.00 ATOM 1967 N GLN A 252 27.793 12.926 -9.422 1.00 0.00 ATOM 1968 CA GLN A 252 27.869 13.166 -8.013 1.00 0.00 ATOM 1969 CB GLN A 252 26.727 14.082 -7.564 1.00 0.00 ATOM 1970 CG GLN A 252 26.794 14.485 -6.100 1.00 0.00 ATOM 1971 CD GLN A 252 28.023 15.314 -5.781 1.00 0.00 ATOM 1972 OE1 GLN A 252 28.359 16.248 -6.507 1.00 0.00 ATOM 1973 NE2 GLN A 252 28.698 14.971 -4.689 1.00 0.00 ATOM 1974 O GLN A 252 28.547 11.601 -6.371 1.00 0.00 ATOM 1975 C GLN A 252 27.766 11.832 -7.302 1.00 0.00 ATOM 1976 N HIS A 253 26.844 10.979 -7.710 1.00 0.00 ATOM 1977 CA HIS A 253 26.744 9.690 -7.027 1.00 0.00 ATOM 1978 CB HIS A 253 25.441 8.978 -7.474 1.00 0.00 ATOM 1979 CG HIS A 253 24.209 9.811 -7.299 1.00 0.00 ATOM 1980 CD2 HIS A 253 23.736 10.483 -6.226 1.00 0.00 ATOM 1981 ND1 HIS A 253 23.319 10.048 -8.325 1.00 0.00 ATOM 1982 CE1 HIS A 253 22.351 10.834 -7.891 1.00 0.00 ATOM 1983 NE2 HIS A 253 22.580 11.115 -6.619 1.00 0.00 ATOM 1984 O HIS A 253 28.483 8.196 -6.317 1.00 0.00 ATOM 1985 C HIS A 253 27.968 8.803 -7.254 1.00 0.00 ATOM 1986 N GLY A 254 28.453 8.730 -8.466 1.00 0.00 ATOM 1987 CA GLY A 254 29.610 7.911 -8.788 1.00 0.00 ATOM 1988 O GLY A 254 31.737 7.490 -7.743 1.00 0.00 ATOM 1989 C GLY A 254 30.961 8.332 -8.216 1.00 0.00 ATOM 1990 N GLY A 255 31.255 9.617 -8.287 1.00 0.00 ATOM 1991 CA GLY A 255 32.513 10.139 -7.770 1.00 0.00 ATOM 1992 O GLY A 255 33.604 9.464 -5.748 1.00 0.00 ATOM 1993 C GLY A 255 32.562 9.852 -6.287 1.00 0.00 ATOM 1994 N ASP A 256 31.459 10.019 -5.560 1.00 0.00 ATOM 1995 CA ASP A 256 31.390 9.776 -4.108 1.00 0.00 ATOM 1996 CB ASP A 256 30.007 10.137 -3.566 1.00 0.00 ATOM 1997 CG ASP A 256 29.775 11.634 -3.514 1.00 0.00 ATOM 1998 OD1 ASP A 256 30.755 12.393 -3.667 1.00 0.00 ATOM 1999 OD2 ASP A 256 28.614 12.049 -3.319 1.00 0.00 ATOM 2000 O ASP A 256 32.402 7.979 -2.868 1.00 0.00 ATOM 2001 C ASP A 256 31.668 8.303 -3.803 1.00 0.00 ATOM 2002 N ASN A 257 30.972 7.441 -4.596 1.00 0.00 ATOM 2003 CA ASN A 257 31.194 6.010 -4.417 1.00 0.00 ATOM 2004 CB ASN A 257 30.368 5.210 -5.427 1.00 0.00 ATOM 2005 CG ASN A 257 30.357 3.725 -5.124 1.00 0.00 ATOM 2006 ND2 ASN A 257 30.117 2.915 -6.148 1.00 0.00 ATOM 2007 OD1 ASN A 257 30.562 3.313 -3.982 1.00 0.00 ATOM 2008 O ASN A 257 33.356 5.033 -3.885 1.00 0.00 ATOM 2009 C ASN A 257 32.710 5.803 -4.579 1.00 0.00 ATOM 2010 N ALA A 258 33.414 6.582 -5.557 1.00 0.00 ATOM 2011 CA ALA A 258 34.844 6.439 -5.874 1.00 0.00 ATOM 2012 CB ALA A 258 35.228 7.183 -7.144 1.00 0.00 ATOM 2013 O ALA A 258 36.816 6.196 -4.473 1.00 0.00 ATOM 2014 C ALA A 258 35.818 6.877 -4.784 1.00 0.00 ATOM 2015 N PRO A 259 35.561 8.029 -4.201 1.00 0.00 ATOM 2016 CA PRO A 259 36.491 8.613 -3.220 1.00 0.00 ATOM 2017 CB PRO A 259 36.499 10.118 -3.665 1.00 0.00 ATOM 2018 CG PRO A 259 35.098 10.316 -4.153 1.00 0.00 ATOM 2019 CD PRO A 259 34.865 9.021 -4.939 1.00 0.00 ATOM 2020 O PRO A 259 37.243 8.247 -0.966 1.00 0.00 ATOM 2021 C PRO A 259 36.358 8.030 -1.807 1.00 0.00 ATOM 2022 N TRP A 260 35.288 7.318 -1.512 1.00 0.00 ATOM 2023 CA TRP A 260 35.107 6.762 -0.198 1.00 0.00 ATOM 2024 CB TRP A 260 34.562 7.823 0.761 1.00 0.00 ATOM 2025 CG TRP A 260 33.237 8.384 0.344 1.00 0.00 ATOM 2026 CD1 TRP A 260 33.018 9.360 -0.585 1.00 0.00 ATOM 2027 CD2 TRP A 260 31.949 8.003 0.841 1.00 0.00 ATOM 2028 CE2 TRP A 260 30.993 8.790 0.168 1.00 0.00 ATOM 2029 CE3 TRP A 260 31.508 7.073 1.787 1.00 0.00 ATOM 2030 NE1 TRP A 260 31.670 9.613 -0.697 1.00 0.00 ATOM 2031 CZ2 TRP A 260 29.626 8.677 0.413 1.00 0.00 ATOM 2032 CZ3 TRP A 260 30.152 6.963 2.024 1.00 0.00 ATOM 2033 CH2 TRP A 260 29.225 7.758 1.344 1.00 0.00 ATOM 2034 O TRP A 260 33.836 5.164 -1.415 1.00 0.00 ATOM 2035 C TRP A 260 34.125 5.622 -0.313 1.00 0.00 ATOM 2036 N PHE A 261 33.567 5.073 0.841 1.00 0.00 ATOM 2037 CA PHE A 261 32.584 4.009 0.800 1.00 0.00 ATOM 2038 CB PHE A 261 33.233 2.667 1.144 1.00 0.00 ATOM 2039 CG PHE A 261 33.761 2.590 2.547 1.00 0.00 ATOM 2040 CD1 PHE A 261 32.972 2.097 3.572 1.00 0.00 ATOM 2041 CD2 PHE A 261 35.046 3.012 2.844 1.00 0.00 ATOM 2042 CE1 PHE A 261 33.457 2.027 4.865 1.00 0.00 ATOM 2043 CE2 PHE A 261 35.531 2.941 4.136 1.00 0.00 ATOM 2044 CZ PHE A 261 34.742 2.453 5.144 1.00 0.00 ATOM 2045 O PHE A 261 31.329 4.973 2.641 1.00 0.00 ATOM 2046 C PHE A 261 31.393 4.132 1.729 1.00 0.00 ATOM 2047 N VAL A 262 30.430 3.271 1.449 1.00 0.00 ATOM 2048 CA VAL A 262 29.191 3.258 2.162 1.00 0.00 ATOM 2049 CB VAL A 262 28.069 3.852 1.253 1.00 0.00 ATOM 2050 CG1 VAL A 262 27.889 2.958 0.042 1.00 0.00 ATOM 2051 CG2 VAL A 262 26.768 3.910 2.005 1.00 0.00 ATOM 2052 O VAL A 262 29.155 0.868 1.914 1.00 0.00 ATOM 2053 C VAL A 262 28.966 1.835 2.660 1.00 0.00 ATOM 2054 N VAL A 263 28.541 1.751 3.881 1.00 0.00 ATOM 2055 CA VAL A 263 28.271 0.457 4.495 1.00 0.00 ATOM 2056 CB VAL A 263 29.270 0.269 5.653 1.00 0.00 ATOM 2057 CG1 VAL A 263 29.035 -1.062 6.350 1.00 0.00 ATOM 2058 CG2 VAL A 263 30.699 0.295 5.132 1.00 0.00 ATOM 2059 O VAL A 263 26.396 1.559 5.354 1.00 0.00 ATOM 2060 C VAL A 263 26.867 0.499 4.980 1.00 0.00 ATOM 2061 N GLY A 264 26.180 -0.624 4.946 1.00 0.00 ATOM 2062 CA GLY A 264 24.823 -0.678 5.473 1.00 0.00 ATOM 2063 O GLY A 264 23.848 0.297 7.431 1.00 0.00 ATOM 2064 C GLY A 264 24.759 -0.383 6.961 1.00 0.00 ATOM 2065 N LYS A 265 25.728 -0.903 7.713 1.00 0.00 ATOM 2066 CA LYS A 265 25.761 -0.689 9.157 1.00 0.00 ATOM 2067 CB LYS A 265 26.772 -1.631 9.815 1.00 0.00 ATOM 2068 CG LYS A 265 26.355 -3.091 9.811 1.00 0.00 ATOM 2069 CD LYS A 265 27.401 -3.965 10.482 1.00 0.00 ATOM 2070 CE LYS A 265 26.999 -5.431 10.447 1.00 0.00 ATOM 2071 NZ LYS A 265 28.026 -6.304 11.081 1.00 0.00 ATOM 2072 O LYS A 265 25.568 1.406 10.303 1.00 0.00 ATOM 2073 C LYS A 265 26.150 0.754 9.436 1.00 0.00 ATOM 2074 N ASP A 266 27.137 1.245 8.703 1.00 0.00 ATOM 2075 CA ASP A 266 27.580 2.617 8.862 1.00 0.00 ATOM 2076 CB ASP A 266 28.715 2.931 7.886 1.00 0.00 ATOM 2077 CG ASP A 266 30.018 2.253 8.269 1.00 0.00 ATOM 2078 OD1 ASP A 266 30.109 1.741 9.404 1.00 0.00 ATOM 2079 OD2 ASP A 266 30.946 2.237 7.434 1.00 0.00 ATOM 2080 O ASP A 266 26.207 4.497 9.432 1.00 0.00 ATOM 2081 C ASP A 266 26.421 3.580 8.643 1.00 0.00 ATOM 2082 N LEU A 267 25.666 3.391 7.543 1.00 0.00 ATOM 2083 CA LEU A 267 24.533 4.247 7.223 1.00 0.00 ATOM 2084 CB LEU A 267 23.883 3.816 5.906 1.00 0.00 ATOM 2085 CG LEU A 267 22.681 4.639 5.442 1.00 0.00 ATOM 2086 CD1 LEU A 267 23.082 6.085 5.194 1.00 0.00 ATOM 2087 CD2 LEU A 267 22.110 4.075 4.150 1.00 0.00 ATOM 2088 O LEU A 267 22.967 5.228 8.771 1.00 0.00 ATOM 2089 C LEU A 267 23.474 4.198 8.329 1.00 0.00 ATOM 2090 N SER A 268 23.157 2.960 8.779 1.00 0.00 ATOM 2091 CA SER A 268 22.158 2.821 9.838 1.00 0.00 ATOM 2092 CB SER A 268 21.298 1.578 9.600 1.00 0.00 ATOM 2093 OG SER A 268 22.077 0.397 9.666 1.00 0.00 ATOM 2094 O SER A 268 22.158 2.719 12.238 1.00 0.00 ATOM 2095 C SER A 268 22.811 2.697 11.199 1.00 0.00 ATOM 2096 N LYS A 269 24.125 2.563 11.158 1.00 0.00 ATOM 2097 CA LYS A 269 24.921 2.414 12.379 1.00 0.00 ATOM 2098 CB LYS A 269 25.201 0.810 12.500 1.00 0.00 ATOM 2099 CG LYS A 269 25.997 0.363 13.711 1.00 0.00 ATOM 2100 CD LYS A 269 26.533 -1.054 13.607 1.00 0.00 ATOM 2101 CE LYS A 269 25.458 -2.114 13.436 1.00 0.00 ATOM 2102 NZ LYS A 269 26.030 -3.498 13.409 1.00 0.00 ATOM 2103 O LYS A 269 26.516 3.679 13.682 1.00 0.00 ATOM 2104 C LYS A 269 25.662 3.680 12.775 1.00 0.00 ATOM 2105 N ASN A 270 25.379 4.772 12.104 1.00 0.00 ATOM 2106 CA ASN A 270 26.006 6.083 12.468 1.00 0.00 ATOM 2107 CB ASN A 270 26.073 7.002 11.246 1.00 0.00 ATOM 2108 CG ASN A 270 24.700 7.408 10.745 1.00 0.00 ATOM 2109 ND2 ASN A 270 24.663 8.072 9.597 1.00 0.00 ATOM 2110 OD1 ASN A 270 23.687 7.127 11.386 1.00 0.00 ATOM 2111 O ASN A 270 24.206 6.453 13.968 1.00 0.00 ATOM 2112 C ASN A 270 25.308 6.910 13.540 1.00 0.00 ATOM 2113 N ILE A 271 25.846 8.044 14.016 1.00 0.00 ATOM 2114 CA ILE A 271 25.215 8.825 15.069 1.00 0.00 ATOM 2115 CB ILE A 271 26.116 9.986 15.529 1.00 0.00 ATOM 2116 CG1 ILE A 271 26.344 10.971 14.381 1.00 0.00 ATOM 2117 CG2 ILE A 271 27.469 9.459 15.988 1.00 0.00 ATOM 2118 CD1 ILE A 271 27.066 12.233 14.796 1.00 0.00 ATOM 2119 O ILE A 271 23.030 9.700 15.393 1.00 0.00 ATOM 2120 C ILE A 271 23.891 9.415 14.555 1.00 0.00 ATOM 2121 N LEU A 272 23.771 9.545 13.283 1.00 0.00 ATOM 2122 CA LEU A 272 22.537 10.062 12.727 1.00 0.00 ATOM 2123 CB LEU A 272 22.663 10.198 11.205 1.00 0.00 ATOM 2124 CG LEU A 272 23.721 11.174 10.696 1.00 0.00 ATOM 2125 CD1 LEU A 272 23.724 11.249 9.186 1.00 0.00 ATOM 2126 CD2 LEU A 272 23.464 12.532 11.336 1.00 0.00 ATOM 2127 O LEU A 272 20.259 9.754 13.413 1.00 0.00 ATOM 2128 C LEU A 272 21.326 9.214 13.081 1.00 0.00 ATOM 2129 N TYR A 273 19.259 8.756 12.853 1.00 0.00 ATOM 2130 CA TYR A 273 18.749 7.985 13.989 1.00 0.00 ATOM 2131 CB TYR A 273 18.988 8.944 15.342 1.00 0.00 ATOM 2132 CG TYR A 273 19.372 8.478 16.728 1.00 0.00 ATOM 2133 CD1 TYR A 273 20.690 8.384 17.114 1.00 0.00 ATOM 2134 CD2 TYR A 273 18.378 8.163 17.649 1.00 0.00 ATOM 2135 CE1 TYR A 273 21.052 7.982 18.386 1.00 0.00 ATOM 2136 CE2 TYR A 273 18.720 7.728 18.919 1.00 0.00 ATOM 2137 CZ TYR A 273 20.043 7.657 19.275 1.00 0.00 ATOM 2138 OH TYR A 273 20.391 7.252 20.548 1.00 0.00 ATOM 2139 O TYR A 273 16.660 7.012 14.676 1.00 0.00 ATOM 2140 C TYR A 273 17.252 7.741 13.874 1.00 0.00 ATOM 2141 N VAL A 274 16.641 8.346 12.863 1.00 0.00 ATOM 2142 CA VAL A 274 15.212 8.200 12.652 1.00 0.00 ATOM 2143 CB VAL A 274 14.436 9.392 13.245 1.00 0.00 ATOM 2144 CG1 VAL A 274 14.637 9.462 14.753 1.00 0.00 ATOM 2145 CG2 VAL A 274 14.917 10.698 12.635 1.00 0.00 ATOM 2146 O VAL A 274 15.690 8.514 10.336 1.00 0.00 ATOM 2147 C VAL A 274 14.883 8.120 11.182 1.00 0.00 ATOM 2148 N GLY A 275 13.697 7.605 10.880 1.00 0.00 ATOM 2149 CA GLY A 275 13.236 7.510 9.503 1.00 0.00 ATOM 2150 O GLY A 275 11.524 8.471 8.149 1.00 0.00 ATOM 2151 C GLY A 275 11.884 8.187 9.282 1.00 0.00 ATOM 2152 N GLN A 276 11.140 8.461 10.351 1.00 0.00 ATOM 2153 CA GLN A 276 9.823 9.073 10.185 1.00 0.00 ATOM 2154 CB GLN A 276 8.723 8.104 10.621 1.00 0.00 ATOM 2155 CG GLN A 276 7.312 8.644 10.440 1.00 0.00 ATOM 2156 CD GLN A 276 6.249 7.620 10.774 1.00 0.00 ATOM 2157 OE1 GLN A 276 6.558 6.500 11.185 1.00 0.00 ATOM 2158 NE2 GLN A 276 4.988 7.998 10.598 1.00 0.00 ATOM 2159 O GLN A 276 9.942 10.333 12.211 1.00 0.00 ATOM 2160 C GLN A 276 9.682 10.335 11.011 1.00 0.00 ATOM 2161 N GLY A 277 9.216 11.406 10.359 1.00 0.00 ATOM 2162 CA GLY A 277 9.066 12.699 11.015 1.00 0.00 ATOM 2163 O GLY A 277 7.470 13.279 9.319 1.00 0.00 ATOM 2164 C GLY A 277 7.972 13.558 10.412 1.00 0.00 ATOM 2165 N PHE A 278 7.600 14.598 11.150 1.00 0.00 ATOM 2166 CA PHE A 278 6.639 15.580 10.681 1.00 0.00 ATOM 2167 CB PHE A 278 5.675 15.963 11.772 1.00 0.00 ATOM 2168 CG PHE A 278 4.717 14.798 12.011 1.00 0.00 ATOM 2169 CD1 PHE A 278 4.962 13.900 13.035 1.00 0.00 ATOM 2170 CD2 PHE A 278 3.589 14.637 11.207 1.00 0.00 ATOM 2171 CE1 PHE A 278 4.082 12.846 13.254 1.00 0.00 ATOM 2172 CE2 PHE A 278 2.720 13.573 11.406 1.00 0.00 ATOM 2173 CZ PHE A 278 2.983 12.673 12.430 1.00 0.00 ATOM 2174 O PHE A 278 8.178 17.281 11.345 1.00 0.00 ATOM 2175 C PHE A 278 7.376 16.892 10.490 1.00 0.00 ATOM 2176 N TYR A 279 6.990 17.725 9.437 1.00 0.00 ATOM 2177 CA TYR A 279 7.654 19.009 9.248 1.00 0.00 ATOM 2178 CB TYR A 279 8.834 18.858 8.257 1.00 0.00 ATOM 2179 CG TYR A 279 8.387 18.752 6.805 1.00 0.00 ATOM 2180 CD1 TYR A 279 8.027 17.524 6.256 1.00 0.00 ATOM 2181 CD2 TYR A 279 8.301 19.887 5.995 1.00 0.00 ATOM 2182 CE1 TYR A 279 7.589 17.422 4.932 1.00 0.00 ATOM 2183 CE2 TYR A 279 7.860 19.793 4.666 1.00 0.00 ATOM 2184 CZ TYR A 279 7.505 18.557 4.144 1.00 0.00 ATOM 2185 OH TYR A 279 7.073 18.462 2.833 1.00 0.00 ATOM 2186 O TYR A 279 5.652 19.887 8.285 1.00 0.00 ATOM 2187 C TYR A 279 6.739 20.132 8.804 1.00 0.00 ATOM 2188 N HIS A 280 7.290 21.255 8.935 1.00 0.00 ATOM 2189 CA HIS A 280 6.596 22.472 8.518 1.00 0.00 ATOM 2190 CB HIS A 280 6.629 23.524 9.627 1.00 0.00 ATOM 2191 CG HIS A 280 5.913 23.111 10.876 1.00 0.00 ATOM 2192 CD2 HIS A 280 6.307 22.578 12.171 1.00 0.00 ATOM 2193 ND1 HIS A 280 4.543 23.183 11.006 1.00 0.00 ATOM 2194 CE1 HIS A 280 4.195 22.745 12.230 1.00 0.00 ATOM 2195 NE2 HIS A 280 5.249 22.381 12.935 1.00 0.00 ATOM 2196 O HIS A 280 8.637 23.052 7.381 1.00 0.00 ATOM 2197 C HIS A 280 7.413 22.875 7.293 1.00 0.00 ATOM 2198 N ASP A 281 6.733 23.050 6.169 1.00 0.00 ATOM 2199 CA ASP A 281 7.393 23.361 4.915 1.00 0.00 ATOM 2200 CB ASP A 281 7.074 22.239 3.924 1.00 0.00 ATOM 2201 CG ASP A 281 7.904 22.314 2.664 1.00 0.00 ATOM 2202 OD1 ASP A 281 8.457 23.387 2.350 1.00 0.00 ATOM 2203 OD2 ASP A 281 7.986 21.275 1.974 1.00 0.00 ATOM 2204 O ASP A 281 5.562 24.663 4.078 1.00 0.00 ATOM 2205 C ASP A 281 6.787 24.525 4.150 1.00 0.00 ATOM 2206 N SER A 282 7.656 25.370 3.613 1.00 0.00 ATOM 2207 CA SER A 282 7.215 26.471 2.764 1.00 0.00 ATOM 2208 CB SER A 282 8.065 27.716 3.021 1.00 0.00 ATOM 2209 OG SER A 282 7.703 28.773 2.148 1.00 0.00 ATOM 2210 O SER A 282 8.496 25.481 0.979 1.00 0.00 ATOM 2211 C SER A 282 7.404 25.938 1.340 1.00 0.00 ATOM 2212 N LEU A 283 6.290 25.707 0.470 1.00 0.00 ATOM 2213 CA LEU A 283 6.369 25.178 -0.887 1.00 0.00 ATOM 2214 CB LEU A 283 5.028 24.567 -1.303 1.00 0.00 ATOM 2215 CG LEU A 283 4.970 23.947 -2.700 1.00 0.00 ATOM 2216 CD1 LEU A 283 5.889 22.737 -2.791 1.00 0.00 ATOM 2217 CD2 LEU A 283 3.555 23.495 -3.029 1.00 0.00 ATOM 2218 O LEU A 283 5.972 27.312 -1.911 1.00 0.00 ATOM 2219 C LEU A 283 6.720 26.341 -1.811 1.00 0.00 ATOM 2220 N MET A 284 7.861 26.240 -2.488 1.00 0.00 ATOM 2221 CA MET A 284 8.328 27.331 -3.345 1.00 0.00 ATOM 2222 CB MET A 284 9.798 27.133 -3.716 1.00 0.00 ATOM 2223 CG MET A 284 10.749 27.193 -2.531 1.00 0.00 ATOM 2224 SD MET A 284 10.797 28.822 -1.759 1.00 0.00 ATOM 2225 CE MET A 284 9.796 28.536 -0.301 1.00 0.00 ATOM 2226 O MET A 284 7.361 26.550 -5.386 1.00 0.00 ATOM 2227 C MET A 284 7.620 27.513 -4.672 1.00 0.00 ATOM 2228 N SER A 285 7.413 28.773 -5.033 1.00 0.00 ATOM 2229 CA SER A 285 6.794 29.124 -6.305 1.00 0.00 ATOM 2230 CB SER A 285 6.174 30.520 -6.231 1.00 0.00 ATOM 2231 OG SER A 285 7.176 31.515 -6.098 1.00 0.00 ATOM 2232 O SER A 285 9.070 29.115 -7.079 1.00 0.00 ATOM 2233 C SER A 285 7.876 29.092 -7.383 1.00 0.00 ATOM 2234 N THR A 286 7.458 29.064 -8.637 1.00 0.00 ATOM 2235 CA THR A 286 8.387 29.036 -9.762 1.00 0.00 ATOM 2236 CB THR A 286 7.643 29.064 -11.110 1.00 0.00 ATOM 2237 CG2 THR A 286 8.633 29.073 -12.264 1.00 0.00 ATOM 2238 OG1 THR A 286 6.809 27.906 -11.224 1.00 0.00 ATOM 2239 O THR A 286 10.543 30.028 -10.062 1.00 0.00 ATOM 2240 C THR A 286 9.355 30.214 -9.782 1.00 0.00 ATOM 2241 N SER A 287 8.893 31.414 -9.437 1.00 0.00 ATOM 2242 CA SER A 287 9.772 32.584 -9.432 1.00 0.00 ATOM 2243 CB SER A 287 8.956 33.866 -9.276 1.00 0.00 ATOM 2244 OG SER A 287 8.342 33.929 -7.998 1.00 0.00 ATOM 2245 O SER A 287 11.692 33.420 -8.271 1.00 0.00 ATOM 2246 C SER A 287 10.798 32.572 -8.303 1.00 0.00 ATOM 2247 N LEU A 288 10.671 31.622 -7.382 1.00 0.00 ATOM 2248 CA LEU A 288 11.597 31.517 -6.252 1.00 0.00 ATOM 2249 CB LEU A 288 10.825 31.425 -4.935 1.00 0.00 ATOM 2250 CG LEU A 288 9.929 32.617 -4.588 1.00 0.00 ATOM 2251 CD1 LEU A 288 9.139 32.344 -3.318 1.00 0.00 ATOM 2252 CD2 LEU A 288 10.763 33.869 -4.371 1.00 0.00 ATOM 2253 O LEU A 288 12.998 29.674 -5.606 1.00 0.00 ATOM 2254 C LEU A 288 12.351 30.210 -6.509 1.00 0.00 ATOM 2255 N GLU A 289 12.279 29.507 -7.763 1.00 0.00 ATOM 2256 CA GLU A 289 12.942 28.260 -8.137 1.00 0.00 ATOM 2257 CB GLU A 289 14.304 28.316 -7.443 1.00 0.00 ATOM 2258 CG GLU A 289 15.236 29.384 -7.991 1.00 0.00 ATOM 2259 CD GLU A 289 16.554 29.448 -7.243 1.00 0.00 ATOM 2260 OE1 GLU A 289 16.726 28.675 -6.277 1.00 0.00 ATOM 2261 OE2 GLU A 289 17.413 30.269 -7.624 1.00 0.00 ATOM 2262 O GLU A 289 12.715 26.170 -6.969 1.00 0.00 ATOM 2263 C GLU A 289 12.156 27.061 -7.610 1.00 0.00 ATOM 2264 N ALA A 290 10.863 27.028 -7.914 1.00 0.00 ATOM 2265 CA ALA A 290 9.999 25.936 -7.491 1.00 0.00 ATOM 2266 CB ALA A 290 9.113 26.381 -6.335 1.00 0.00 ATOM 2267 O ALA A 290 9.671 25.729 -9.844 1.00 0.00 ATOM 2268 C ALA A 290 9.182 25.602 -8.721 1.00 0.00 ATOM 2269 N SER A 291 7.938 25.174 -8.502 1.00 0.00 ATOM 2270 CA SER A 291 7.030 24.811 -9.586 1.00 0.00 ATOM 2271 CB SER A 291 6.889 23.290 -9.679 1.00 0.00 ATOM 2272 OG SER A 291 6.291 22.761 -8.507 1.00 0.00 ATOM 2273 O SER A 291 5.195 25.639 -8.277 1.00 0.00 ATOM 2274 C SER A 291 5.637 25.398 -9.400 1.00 0.00 ATOM 2275 N GLN A 292 4.917 25.518 -10.513 1.00 0.00 ATOM 2276 CA GLN A 292 3.570 26.077 -10.484 1.00 0.00 ATOM 2277 CB GLN A 292 3.090 26.392 -11.904 1.00 0.00 ATOM 2278 CG GLN A 292 3.804 27.564 -12.555 1.00 0.00 ATOM 2279 CD GLN A 292 3.348 27.807 -13.979 1.00 0.00 ATOM 2280 OE1 GLN A 292 2.515 27.070 -14.508 1.00 0.00 ATOM 2281 NE2 GLN A 292 3.892 28.843 -14.606 1.00 0.00 ATOM 2282 O GLN A 292 1.555 25.560 -9.284 1.00 0.00 ATOM 2283 C GLN A 292 2.545 25.127 -9.867 1.00 0.00 ATOM 2284 N VAL A 293 2.803 23.896 -9.933 1.00 0.00 ATOM 2285 CA VAL A 293 1.910 22.864 -9.420 1.00 0.00 ATOM 2286 CB VAL A 293 1.786 21.686 -10.406 1.00 0.00 ATOM 2287 CG1 VAL A 293 0.912 20.590 -9.817 1.00 0.00 ATOM 2288 CG2 VAL A 293 1.160 22.151 -11.712 1.00 0.00 ATOM 2289 O VAL A 293 3.528 21.996 -7.903 1.00 0.00 ATOM 2290 C VAL A 293 2.341 22.233 -8.106 1.00 0.00 ATOM 2291 N HIS A 294 1.374 21.984 -7.231 1.00 0.00 ATOM 2292 CA HIS A 294 1.683 21.406 -5.924 1.00 0.00 ATOM 2293 CB HIS A 294 0.434 21.467 -5.013 1.00 0.00 ATOM 2294 CG HIS A 294 -0.739 20.699 -5.528 1.00 0.00 ATOM 2295 CD2 HIS A 294 -1.854 21.098 -6.189 1.00 0.00 ATOM 2296 ND1 HIS A 294 -0.792 19.320 -5.480 1.00 0.00 ATOM 2297 CE1 HIS A 294 -1.910 18.908 -6.051 1.00 0.00 ATOM 2298 NE2 HIS A 294 -2.591 19.967 -6.484 1.00 0.00 ATOM 2299 O HIS A 294 2.050 19.350 -7.090 1.00 0.00 ATOM 2300 C HIS A 294 1.862 19.906 -6.000 1.00 0.00 ATOM 2301 N PHE A 295 1.819 19.229 -4.856 1.00 0.00 ATOM 2302 CA PHE A 295 1.978 17.783 -4.859 1.00 0.00 ATOM 2303 CB PHE A 295 3.418 17.404 -4.504 1.00 0.00 ATOM 2304 CG PHE A 295 4.445 17.986 -5.432 1.00 0.00 ATOM 2305 CD1 PHE A 295 5.049 19.198 -5.145 1.00 0.00 ATOM 2306 CD2 PHE A 295 4.809 17.323 -6.592 1.00 0.00 ATOM 2307 CE1 PHE A 295 5.994 19.736 -5.998 1.00 0.00 ATOM 2308 CE2 PHE A 295 5.753 17.860 -7.446 1.00 0.00 ATOM 2309 CZ PHE A 295 6.346 19.061 -7.154 1.00 0.00 ATOM 2310 O PHE A 295 0.489 17.689 -2.971 1.00 0.00 ATOM 2311 C PHE A 295 1.082 17.064 -3.865 1.00 0.00 ATOM 2312 N THR A 296 1.005 15.746 -4.032 1.00 0.00 ATOM 2313 CA THR A 296 0.140 14.865 -3.256 1.00 0.00 ATOM 2314 CB THR A 296 -0.830 14.085 -4.162 1.00 0.00 ATOM 2315 CG2 THR A 296 -1.627 15.042 -5.038 1.00 0.00 ATOM 2316 OG1 THR A 296 -0.090 13.194 -5.004 1.00 0.00 ATOM 2317 O THR A 296 2.094 13.675 -2.537 1.00 0.00 ATOM 2318 C THR A 296 0.878 13.814 -2.440 1.00 0.00 ATOM 2319 N ARG A 297 0.169 13.075 -1.650 1.00 0.00 ATOM 2320 CA ARG A 297 0.735 11.974 -0.888 1.00 0.00 ATOM 2321 CB ARG A 297 -0.265 11.383 0.124 1.00 0.00 ATOM 2322 CG ARG A 297 -1.505 10.770 -0.512 1.00 0.00 ATOM 2323 CD ARG A 297 -2.272 9.839 0.463 1.00 0.00 ATOM 2324 NE ARG A 297 -2.820 10.595 1.592 1.00 0.00 ATOM 2325 CZ ARG A 297 -2.327 10.597 2.827 1.00 0.00 ATOM 2326 NH1 ARG A 297 -1.247 9.868 3.139 1.00 0.00 ATOM 2327 NH2 ARG A 297 -2.917 11.325 3.768 1.00 0.00 ATOM 2328 O ARG A 297 0.633 10.824 -3.005 1.00 0.00 ATOM 2329 C ARG A 297 1.254 10.999 -1.956 1.00 0.00 ATOM 2330 N GLU A 298 2.569 10.609 -1.621 1.00 0.00 ATOM 2331 CA GLU A 298 3.234 9.688 -2.534 1.00 0.00 ATOM 2332 CB GLU A 298 2.259 9.066 -3.487 1.00 0.00 ATOM 2333 CG GLU A 298 1.131 8.289 -2.825 1.00 0.00 ATOM 2334 CD GLU A 298 1.612 7.026 -2.142 1.00 0.00 ATOM 2335 OE1 GLU A 298 2.540 6.383 -2.675 1.00 0.00 ATOM 2336 OE2 GLU A 298 1.054 6.670 -1.085 1.00 0.00 ATOM 2337 O GLU A 298 5.489 9.659 -3.346 1.00 0.00 ATOM 2338 C GLU A 298 4.486 10.336 -3.118 1.00 0.00 ATOM 2339 N MET A 299 4.403 11.652 -3.370 1.00 0.00 ATOM 2340 CA MET A 299 5.550 12.383 -3.905 1.00 0.00 ATOM 2341 CB MET A 299 5.143 13.830 -4.188 1.00 0.00 ATOM 2342 CG MET A 299 6.218 14.655 -4.879 1.00 0.00 ATOM 2343 SD MET A 299 6.682 13.981 -6.485 1.00 0.00 ATOM 2344 CE MET A 299 5.202 14.323 -7.437 1.00 0.00 ATOM 2345 O MET A 299 6.817 13.046 -1.995 1.00 0.00 ATOM 2346 C MET A 299 6.794 12.419 -3.070 1.00 0.00 ATOM 2347 N PRO A 300 7.585 11.478 -4.037 1.00 0.00 ATOM 2348 CA PRO A 300 8.872 10.927 -3.612 1.00 0.00 ATOM 2349 CB PRO A 300 8.935 9.560 -4.298 1.00 0.00 ATOM 2350 CG PRO A 300 8.176 9.745 -5.570 1.00 0.00 ATOM 2351 CD PRO A 300 7.067 10.712 -5.256 1.00 0.00 ATOM 2352 O PRO A 300 10.878 11.380 -4.859 1.00 0.00 ATOM 2353 C PRO A 300 10.067 11.785 -4.024 1.00 0.00 ATOM 2354 N GLU A 301 10.203 12.975 -3.428 1.00 0.00 ATOM 2355 CA GLU A 301 11.305 13.885 -3.741 1.00 0.00 ATOM 2356 CB GLU A 301 10.890 15.336 -3.485 1.00 0.00 ATOM 2357 CG GLU A 301 9.804 15.845 -4.418 1.00 0.00 ATOM 2358 CD GLU A 301 9.377 17.263 -4.095 1.00 0.00 ATOM 2359 OE1 GLU A 301 10.250 18.155 -4.064 1.00 0.00 ATOM 2360 OE2 GLU A 301 8.168 17.483 -3.873 1.00 0.00 ATOM 2361 O GLU A 301 12.572 12.688 -2.090 1.00 0.00 ATOM 2362 C GLU A 301 12.544 13.617 -2.905 1.00 0.00 ATOM 2363 N GLU A 302 13.628 14.459 -3.211 1.00 0.00 ATOM 2364 CA GLU A 302 14.872 14.332 -2.460 1.00 0.00 ATOM 2365 CB GLU A 302 16.075 14.559 -3.379 1.00 0.00 ATOM 2366 CG GLU A 302 16.256 13.491 -4.443 1.00 0.00 ATOM 2367 CD GLU A 302 17.425 13.776 -5.364 1.00 0.00 ATOM 2368 OE1 GLU A 302 18.080 14.824 -5.185 1.00 0.00 ATOM 2369 OE2 GLU A 302 17.689 12.952 -6.264 1.00 0.00 ATOM 2370 O GLU A 302 14.688 16.560 -1.563 1.00 0.00 ATOM 2371 C GLU A 302 14.927 15.359 -1.334 1.00 0.00 ATOM 2372 N PHE A 303 15.264 14.901 -0.184 1.00 0.00 ATOM 2373 CA PHE A 303 15.427 15.772 0.974 1.00 0.00 ATOM 2374 CB PHE A 303 15.118 14.926 2.192 1.00 0.00 ATOM 2375 CG PHE A 303 15.208 15.723 3.462 1.00 0.00 ATOM 2376 CD1 PHE A 303 14.215 16.636 3.798 1.00 0.00 ATOM 2377 CD2 PHE A 303 16.256 15.514 4.355 1.00 0.00 ATOM 2378 CE1 PHE A 303 14.257 17.325 5.006 1.00 0.00 ATOM 2379 CE2 PHE A 303 16.308 16.198 5.564 1.00 0.00 ATOM 2380 CZ PHE A 303 15.307 17.104 5.893 1.00 0.00 ATOM 2381 O PHE A 303 17.692 15.052 1.243 1.00 0.00 ATOM 2382 C PHE A 303 16.900 15.993 1.281 1.00 0.00 ATOM 2383 N THR A 304 17.255 17.230 1.604 1.00 0.00 ATOM 2384 CA THR A 304 18.638 17.571 1.907 1.00 0.00 ATOM 2385 CB THR A 304 19.196 18.606 0.913 1.00 0.00 ATOM 2386 CG2 THR A 304 20.639 18.950 1.252 1.00 0.00 ATOM 2387 OG1 THR A 304 19.147 18.072 -0.416 1.00 0.00 ATOM 2388 O THR A 304 18.134 19.197 3.591 1.00 0.00 ATOM 2389 C THR A 304 18.745 18.157 3.302 1.00 0.00 ATOM 2390 N LEU A 305 19.455 17.439 4.177 1.00 0.00 ATOM 2391 CA LEU A 305 19.681 17.860 5.560 1.00 0.00 ATOM 2392 CB LEU A 305 19.193 16.746 6.504 1.00 0.00 ATOM 2393 CG LEU A 305 19.458 17.031 7.981 1.00 0.00 ATOM 2394 CD1 LEU A 305 18.542 18.143 8.485 1.00 0.00 ATOM 2395 CD2 LEU A 305 19.291 15.765 8.804 1.00 0.00 ATOM 2396 O LEU A 305 21.884 16.928 5.633 1.00 0.00 ATOM 2397 C LEU A 305 21.194 17.945 5.718 1.00 0.00 ATOM 2398 N GLU A 306 21.503 19.122 5.883 1.00 0.00 ATOM 2399 CA GLU A 306 22.933 19.338 6.027 1.00 0.00 ATOM 2400 CB GLU A 306 23.474 18.607 7.257 1.00 0.00 ATOM 2401 CG GLU A 306 22.918 19.115 8.576 1.00 0.00 ATOM 2402 CD GLU A 306 23.390 18.299 9.763 1.00 0.00 ATOM 2403 OE1 GLU A 306 24.225 17.389 9.564 1.00 0.00 ATOM 2404 OE2 GLU A 306 22.928 18.566 10.891 1.00 0.00 ATOM 2405 O GLU A 306 23.320 19.300 3.683 1.00 0.00 ATOM 2406 C GLU A 306 23.613 18.797 4.765 1.00 0.00 ATOM 2407 N CYS A 307 24.623 17.821 4.810 1.00 0.00 ATOM 2408 CA CYS A 307 25.242 17.338 3.570 1.00 0.00 ATOM 2409 CB CYS A 307 26.738 17.091 3.776 1.00 0.00 ATOM 2410 SG CYS A 307 27.697 18.577 4.149 1.00 0.00 ATOM 2411 O CYS A 307 25.203 15.407 2.144 1.00 0.00 ATOM 2412 C CYS A 307 24.641 16.020 3.052 1.00 0.00 ATOM 2413 N THR A 308 23.513 15.600 3.633 1.00 0.00 ATOM 2414 CA THR A 308 22.814 14.362 3.261 1.00 0.00 ATOM 2415 CB THR A 308 22.217 13.659 4.494 1.00 0.00 ATOM 2416 CG2 THR A 308 21.489 12.387 4.082 1.00 0.00 ATOM 2417 OG1 THR A 308 23.266 13.317 5.409 1.00 0.00 ATOM 2418 O THR A 308 20.703 15.173 2.525 1.00 0.00 ATOM 2419 C THR A 308 21.674 14.460 2.269 1.00 0.00 ATOM 2420 N ALA A 309 21.847 13.701 1.111 1.00 0.00 ATOM 2421 CA ALA A 309 20.795 13.750 0.107 1.00 0.00 ATOM 2422 CB ALA A 309 21.364 13.953 -1.289 1.00 0.00 ATOM 2423 O ALA A 309 20.699 11.356 -0.073 1.00 0.00 ATOM 2424 C ALA A 309 20.087 12.394 0.202 1.00 0.00 ATOM 2425 N LYS A 310 18.814 12.389 0.585 1.00 0.00 ATOM 2426 CA LYS A 310 18.093 11.132 0.758 1.00 0.00 ATOM 2427 CB LYS A 310 18.271 10.631 2.238 1.00 0.00 ATOM 2428 CG LYS A 310 19.719 10.438 2.683 1.00 0.00 ATOM 2429 CD LYS A 310 20.334 9.156 2.102 1.00 0.00 ATOM 2430 CE LYS A 310 21.701 8.899 2.784 1.00 0.00 ATOM 2431 NZ LYS A 310 22.364 7.709 2.099 1.00 0.00 ATOM 2432 O LYS A 310 15.961 12.213 0.444 1.00 0.00 ATOM 2433 C LYS A 310 16.660 11.218 0.235 1.00 0.00 ATOM 2434 N PHE A 311 16.237 10.181 -0.476 1.00 0.00 ATOM 2435 CA PHE A 311 14.878 10.128 -0.998 1.00 0.00 ATOM 2436 CB PHE A 311 14.785 9.094 -2.121 1.00 0.00 ATOM 2437 CG PHE A 311 15.652 9.409 -3.310 1.00 0.00 ATOM 2438 CD1 PHE A 311 16.972 9.017 -3.350 1.00 0.00 ATOM 2439 CD2 PHE A 311 15.138 10.117 -4.388 1.00 0.00 ATOM 2440 CE1 PHE A 311 17.785 9.304 -4.477 1.00 0.00 ATOM 2441 CE2 PHE A 311 15.933 10.396 -5.505 1.00 0.00 ATOM 2442 CZ PHE A 311 17.256 9.996 -5.545 1.00 0.00 ATOM 2443 O PHE A 311 14.222 9.178 1.108 1.00 0.00 ATOM 2444 C PHE A 311 13.906 9.893 0.160 1.00 0.00 ATOM 2445 N ARG A 312 12.780 10.530 0.022 1.00 0.00 ATOM 2446 CA ARG A 312 11.768 10.358 1.044 1.00 0.00 ATOM 2447 CB ARG A 312 11.844 11.491 2.070 1.00 0.00 ATOM 2448 CG ARG A 312 13.123 11.498 2.892 1.00 0.00 ATOM 2449 CD ARG A 312 13.098 12.598 3.942 1.00 0.00 ATOM 2450 NE ARG A 312 14.299 12.590 4.771 1.00 0.00 ATOM 2451 CZ ARG A 312 14.506 13.411 5.796 1.00 0.00 ATOM 2452 NH1 ARG A 312 15.630 13.330 6.495 1.00 0.00 ATOM 2453 NH2 ARG A 312 13.588 14.311 6.120 1.00 0.00 ATOM 2454 O ARG A 312 10.223 10.721 -0.761 1.00 0.00 ATOM 2455 C ARG A 312 10.389 10.318 0.388 1.00 0.00 ATOM 2456 N TYR A 313 9.410 9.814 1.126 1.00 0.00 ATOM 2457 CA TYR A 313 8.041 9.720 0.639 1.00 0.00 ATOM 2458 CB TYR A 313 7.546 8.273 0.675 1.00 0.00 ATOM 2459 CG TYR A 313 8.273 7.352 -0.279 1.00 0.00 ATOM 2460 CD1 TYR A 313 9.401 6.650 0.130 1.00 0.00 ATOM 2461 CD2 TYR A 313 7.830 7.188 -1.586 1.00 0.00 ATOM 2462 CE1 TYR A 313 10.071 5.807 -0.735 1.00 0.00 ATOM 2463 CE2 TYR A 313 8.488 6.349 -2.465 1.00 0.00 ATOM 2464 CZ TYR A 313 9.617 5.656 -2.028 1.00 0.00 ATOM 2465 OH TYR A 313 10.282 4.817 -2.891 1.00 0.00 ATOM 2466 O TYR A 313 7.149 10.459 2.757 1.00 0.00 ATOM 2467 C TYR A 313 7.142 10.580 1.534 1.00 0.00 ATOM 2468 N ARG A 314 6.366 11.445 0.895 1.00 0.00 ATOM 2469 CA ARG A 314 5.463 12.358 1.580 1.00 0.00 ATOM 2470 CB ARG A 314 5.174 13.583 0.710 1.00 0.00 ATOM 2471 CG ARG A 314 6.364 14.512 0.531 1.00 0.00 ATOM 2472 CD ARG A 314 6.040 15.641 -0.435 1.00 0.00 ATOM 2473 NE ARG A 314 4.948 16.481 0.050 1.00 0.00 ATOM 2474 CZ ARG A 314 4.333 17.404 -0.682 1.00 0.00 ATOM 2475 NH1 ARG A 314 3.350 18.121 -0.156 1.00 0.00 ATOM 2476 NH2 ARG A 314 4.703 17.607 -1.940 1.00 0.00 ATOM 2477 O ARG A 314 3.495 11.068 1.135 1.00 0.00 ATOM 2478 C ARG A 314 4.106 11.762 1.941 1.00 0.00 ATOM 2479 N GLN A 315 3.643 12.061 3.150 1.00 0.00 ATOM 2480 CA GLN A 315 2.308 11.652 3.587 1.00 0.00 ATOM 2481 CB GLN A 315 2.403 10.562 4.656 1.00 0.00 ATOM 2482 CG GLN A 315 1.058 10.050 5.144 1.00 0.00 ATOM 2483 CD GLN A 315 1.193 8.962 6.189 1.00 0.00 ATOM 2484 OE1 GLN A 315 2.294 8.668 6.655 1.00 0.00 ATOM 2485 NE2 GLN A 315 0.070 8.357 6.561 1.00 0.00 ATOM 2486 O GLN A 315 2.054 13.436 5.195 1.00 0.00 ATOM 2487 C GLN A 315 1.643 12.906 4.156 1.00 0.00 ATOM 2488 N PRO A 316 0.636 13.411 3.450 1.00 0.00 ATOM 2489 CA PRO A 316 -0.069 14.613 3.895 1.00 0.00 ATOM 2490 CB PRO A 316 -0.965 14.932 2.721 1.00 0.00 ATOM 2491 CG PRO A 316 -1.137 13.686 1.977 1.00 0.00 ATOM 2492 CD PRO A 316 0.199 12.978 2.127 1.00 0.00 ATOM 2493 O PRO A 316 -1.475 13.140 5.188 1.00 0.00 ATOM 2494 C PRO A 316 -1.022 14.281 5.051 1.00 0.00 ATOM 2495 N ASP A 317 -1.349 15.273 5.893 1.00 0.00 ATOM 2496 CA ASP A 317 -2.249 15.021 7.025 1.00 0.00 ATOM 2497 CB ASP A 317 -2.413 16.284 7.871 1.00 0.00 ATOM 2498 CG ASP A 317 -1.178 16.603 8.688 1.00 0.00 ATOM 2499 OD1 ASP A 317 -0.265 15.753 8.744 1.00 0.00 ATOM 2500 OD2 ASP A 317 -1.121 17.706 9.273 1.00 0.00 ATOM 2501 O ASP A 317 -3.976 14.809 5.358 1.00 0.00 ATOM 2502 C ASP A 317 -3.625 14.591 6.517 1.00 0.00 ATOM 2503 N SER A 318 -4.342 13.826 7.440 1.00 0.00 ATOM 2504 CA SER A 318 -5.678 13.348 7.109 1.00 0.00 ATOM 2505 CB SER A 318 -6.313 12.650 8.313 1.00 0.00 ATOM 2506 OG SER A 318 -7.632 12.225 8.021 1.00 0.00 ATOM 2507 O SER A 318 -6.445 15.608 7.377 1.00 0.00 ATOM 2508 C SER A 318 -6.505 14.569 6.713 1.00 0.00 ATOM 2509 N LYS A 319 -7.209 14.466 5.591 1.00 0.00 ATOM 2510 CA LYS A 319 -8.033 15.574 5.138 1.00 0.00 ATOM 2511 CB LYS A 319 -8.764 16.217 6.319 1.00 0.00 ATOM 2512 CG LYS A 319 -9.665 15.263 7.084 1.00 0.00 ATOM 2513 CD LYS A 319 -10.538 16.008 8.080 1.00 0.00 ATOM 2514 CE LYS A 319 -11.357 15.045 8.926 1.00 0.00 ATOM 2515 NZ LYS A 319 -12.201 15.759 9.923 1.00 0.00 ATOM 2516 O LYS A 319 -7.582 17.869 4.460 1.00 0.00 ATOM 2517 C LYS A 319 -7.248 16.684 4.460 1.00 0.00 ATOM 2518 N VAL A 320 -6.196 16.389 3.787 1.00 0.00 ATOM 2519 CA VAL A 320 -5.330 17.360 3.122 1.00 0.00 ATOM 2520 CB VAL A 320 -4.060 17.655 3.941 1.00 0.00 ATOM 2521 CG1 VAL A 320 -3.182 18.666 3.219 1.00 0.00 ATOM 2522 CG2 VAL A 320 -4.423 18.222 5.303 1.00 0.00 ATOM 2523 O VAL A 320 -4.258 15.686 1.773 1.00 0.00 ATOM 2524 C VAL A 320 -5.031 16.636 1.809 1.00 0.00 ATOM 2525 N THR A 321 -5.582 17.120 0.619 1.00 0.00 ATOM 2526 CA THR A 321 -5.380 16.450 -0.659 1.00 0.00 ATOM 2527 CB THR A 321 -6.439 16.877 -1.692 1.00 0.00 ATOM 2528 CG2 THR A 321 -6.208 16.165 -3.016 1.00 0.00 ATOM 2529 OG1 THR A 321 -7.746 16.544 -1.208 1.00 0.00 ATOM 2530 O THR A 321 -3.359 15.849 -1.809 1.00 0.00 ATOM 2531 C THR A 321 -4.023 16.745 -1.285 1.00 0.00 ATOM 2532 N VAL A 322 -3.590 17.992 -1.174 1.00 0.00 ATOM 2533 CA VAL A 322 -2.305 18.381 -1.724 1.00 0.00 ATOM 2534 CB VAL A 322 -2.369 18.620 -3.246 1.00 0.00 ATOM 2535 CG1 VAL A 322 -2.750 17.331 -3.961 1.00 0.00 ATOM 2536 CG2 VAL A 322 -3.350 19.737 -3.576 1.00 0.00 ATOM 2537 O VAL A 322 -2.707 20.440 -0.580 1.00 0.00 ATOM 2538 C VAL A 322 -1.885 19.691 -1.109 1.00 0.00 ATOM 2539 N HIS A 323 -0.599 20.003 -1.200 1.00 0.00 ATOM 2540 CA HIS A 323 -0.065 21.247 -0.687 1.00 0.00 ATOM 2541 CB HIS A 323 1.172 20.911 0.146 1.00 0.00 ATOM 2542 CG HIS A 323 0.825 19.998 1.288 1.00 0.00 ATOM 2543 CD2 HIS A 323 0.637 18.663 1.371 1.00 0.00 ATOM 2544 ND1 HIS A 323 0.574 20.489 2.552 1.00 0.00 ATOM 2545 CE1 HIS A 323 0.274 19.496 3.374 1.00 0.00 ATOM 2546 NE2 HIS A 323 0.330 18.363 2.668 1.00 0.00 ATOM 2547 O HIS A 323 0.948 21.564 -2.843 1.00 0.00 ATOM 2548 C HIS A 323 0.384 22.082 -1.880 1.00 0.00 ATOM 2549 N VAL A 324 0.124 23.382 -1.808 1.00 0.00 ATOM 2550 CA VAL A 324 0.407 24.279 -2.921 1.00 0.00 ATOM 2551 CB VAL A 324 -0.818 25.214 -3.092 1.00 0.00 ATOM 2552 CG1 VAL A 324 -0.522 26.297 -4.119 1.00 0.00 ATOM 2553 CG2 VAL A 324 -2.050 24.415 -3.483 1.00 0.00 ATOM 2554 O VAL A 324 1.820 25.645 -1.570 1.00 0.00 ATOM 2555 C VAL A 324 1.503 25.303 -2.706 1.00 0.00 ATOM 2556 N LYS A 325 2.057 25.820 -3.893 1.00 0.00 ATOM 2557 CA LYS A 325 3.138 26.788 -3.801 1.00 0.00 ATOM 2558 CB LYS A 325 3.677 27.124 -5.193 1.00 0.00 ATOM 2559 CG LYS A 325 2.708 27.916 -6.058 1.00 0.00 ATOM 2560 CD LYS A 325 3.306 28.215 -7.422 1.00 0.00 ATOM 2561 CE LYS A 325 2.347 29.029 -8.278 1.00 0.00 ATOM 2562 NZ LYS A 325 2.888 29.265 -9.645 1.00 0.00 ATOM 2563 O LYS A 325 1.468 28.438 -3.290 1.00 0.00 ATOM 2564 C LYS A 325 2.627 28.046 -3.113 1.00 0.00 ATOM 2565 N GLY A 326 3.478 28.687 -2.307 1.00 0.00 ATOM 2566 CA GLY A 326 3.076 29.903 -1.626 1.00 0.00 ATOM 2567 O GLY A 326 2.430 30.623 0.559 1.00 0.00 ATOM 2568 C GLY A 326 2.560 29.677 -0.216 1.00 0.00 ATOM 2569 N GLU A 327 2.272 28.423 0.123 1.00 0.00 ATOM 2570 CA GLU A 327 1.739 28.096 1.442 1.00 0.00 ATOM 2571 CB GLU A 327 0.673 27.004 1.343 1.00 0.00 ATOM 2572 CG GLU A 327 -0.568 27.417 0.567 1.00 0.00 ATOM 2573 CD GLU A 327 -1.620 26.327 0.530 1.00 0.00 ATOM 2574 OE1 GLU A 327 -1.358 25.226 1.059 1.00 0.00 ATOM 2575 OE2 GLU A 327 -2.709 26.572 -0.031 1.00 0.00 ATOM 2576 O GLU A 327 3.845 27.067 1.950 1.00 0.00 ATOM 2577 C GLU A 327 2.824 27.588 2.390 1.00 0.00 ATOM 2578 N LYS A 328 2.491 27.787 3.729 1.00 0.00 ATOM 2579 CA LYS A 328 3.273 27.107 4.737 1.00 0.00 ATOM 2580 CB LYS A 328 3.670 28.077 5.851 1.00 0.00 ATOM 2581 CG LYS A 328 4.591 27.476 6.899 1.00 0.00 ATOM 2582 CD LYS A 328 4.915 28.482 7.992 1.00 0.00 ATOM 2583 CE LYS A 328 5.845 27.883 9.034 1.00 0.00 ATOM 2584 NZ LYS A 328 6.177 28.859 10.109 1.00 0.00 ATOM 2585 O LYS A 328 1.307 26.261 5.842 1.00 0.00 ATOM 2586 C LYS A 328 2.368 26.001 5.267 1.00 0.00 ATOM 2587 N THR A 329 2.791 24.763 5.051 1.00 0.00 ATOM 2588 CA THR A 329 1.994 23.605 5.414 1.00 0.00 ATOM 2589 CB THR A 329 1.614 22.772 4.177 1.00 0.00 ATOM 2590 CG2 THR A 329 0.916 23.642 3.141 1.00 0.00 ATOM 2591 OG1 THR A 329 2.795 22.212 3.592 1.00 0.00 ATOM 2592 O THR A 329 3.882 22.913 6.716 1.00 0.00 ATOM 2593 C THR A 329 2.727 22.675 6.360 1.00 0.00 ATOM 2594 N GLU A 330 2.050 21.604 6.751 1.00 0.00 ATOM 2595 CA GLU A 330 2.653 20.595 7.601 1.00 0.00 ATOM 2596 CB GLU A 330 2.119 20.714 9.030 1.00 0.00 ATOM 2597 CG GLU A 330 2.687 19.683 9.993 1.00 0.00 ATOM 2598 CD GLU A 330 2.204 19.886 11.416 1.00 0.00 ATOM 2599 OE1 GLU A 330 1.465 20.863 11.657 1.00 0.00 ATOM 2600 OE2 GLU A 330 2.565 19.070 12.288 1.00 0.00 ATOM 2601 O GLU A 330 1.067 18.892 7.045 1.00 0.00 ATOM 2602 C GLU A 330 2.252 19.194 7.158 1.00 0.00 ATOM 2603 N VAL A 331 3.244 18.348 7.081 1.00 0.00 ATOM 2604 CA VAL A 331 3.051 16.951 6.661 1.00 0.00 ATOM 2605 CB VAL A 331 3.148 16.881 5.125 1.00 0.00 ATOM 2606 CG1 VAL A 331 2.018 17.671 4.484 1.00 0.00 ATOM 2607 CG2 VAL A 331 4.472 17.459 4.649 1.00 0.00 ATOM 2608 O VAL A 331 4.913 16.402 8.073 1.00 0.00 ATOM 2609 C VAL A 331 4.044 15.988 7.308 1.00 0.00 ATOM 2610 N ILE A 332 3.938 14.689 6.799 1.00 0.00 ATOM 2611 CA ILE A 332 4.815 13.678 7.405 1.00 0.00 ATOM 2612 CB ILE A 332 3.996 12.486 7.852 1.00 0.00 ATOM 2613 CG1 ILE A 332 3.013 12.964 8.926 1.00 0.00 ATOM 2614 CG2 ILE A 332 4.930 11.431 8.419 1.00 0.00 ATOM 2615 CD1 ILE A 332 1.933 11.964 9.270 1.00 0.00 ATOM 2616 O ILE A 332 5.364 13.244 5.104 1.00 0.00 ATOM 2617 C ILE A 332 5.692 13.140 6.292 1.00 0.00 ATOM 2618 N PHE A 333 6.853 12.629 6.677 1.00 0.00 ATOM 2619 CA PHE A 333 7.798 12.083 5.728 1.00 0.00 ATOM 2620 CB PHE A 333 8.935 13.071 5.459 1.00 0.00 ATOM 2621 CG PHE A 333 9.752 13.402 6.674 1.00 0.00 ATOM 2622 CD1 PHE A 333 10.887 12.673 6.984 1.00 0.00 ATOM 2623 CD2 PHE A 333 9.385 14.441 7.511 1.00 0.00 ATOM 2624 CE1 PHE A 333 11.639 12.976 8.104 1.00 0.00 ATOM 2625 CE2 PHE A 333 10.136 14.744 8.631 1.00 0.00 ATOM 2626 CZ PHE A 333 11.259 14.017 8.926 1.00 0.00 ATOM 2627 O PHE A 333 8.696 10.667 7.452 1.00 0.00 ATOM 2628 C PHE A 333 8.406 10.791 6.255 1.00 0.00 ATOM 2629 N ALA A 334 8.562 9.817 5.362 1.00 0.00 ATOM 2630 CA ALA A 334 9.251 8.581 5.719 1.00 0.00 ATOM 2631 CB ALA A 334 8.323 7.390 5.545 1.00 0.00 ATOM 2632 O ALA A 334 10.290 8.452 3.549 1.00 0.00 ATOM 2633 C ALA A 334 10.451 8.475 4.775 1.00 0.00 ATOM 2634 N GLU A 335 11.648 8.495 5.352 1.00 0.00 ATOM 2635 CA GLU A 335 12.896 8.417 4.583 1.00 0.00 ATOM 2636 CB GLU A 335 14.028 9.129 5.328 1.00 0.00 ATOM 2637 CG GLU A 335 15.342 9.168 4.568 1.00 0.00 ATOM 2638 CD GLU A 335 16.430 9.908 5.320 1.00 0.00 ATOM 2639 OE1 GLU A 335 16.158 10.380 6.444 1.00 0.00 ATOM 2640 OE2 GLU A 335 17.555 10.017 4.785 1.00 0.00 ATOM 2641 O GLU A 335 13.165 6.115 5.219 1.00 0.00 ATOM 2642 C GLU A 335 13.343 6.966 4.340 1.00 0.00 ATOM 2643 N PRO A 336 13.880 6.745 3.156 1.00 0.00 ATOM 2644 CA PRO A 336 14.337 5.389 2.816 1.00 0.00 ATOM 2645 CB PRO A 336 14.697 5.478 1.331 1.00 0.00 ATOM 2646 CG PRO A 336 13.942 6.667 0.836 1.00 0.00 ATOM 2647 CD PRO A 336 13.878 7.629 1.988 1.00 0.00 ATOM 2648 O PRO A 336 15.803 3.663 3.564 1.00 0.00 ATOM 2649 C PRO A 336 15.536 4.864 3.586 1.00 0.00 ATOM 2650 N GLN A 337 16.215 5.807 4.439 1.00 0.00 ATOM 2651 CA GLN A 337 17.281 5.351 5.337 1.00 0.00 ATOM 2652 CB GLN A 337 18.637 5.409 4.632 1.00 0.00 ATOM 2653 CG GLN A 337 18.728 4.538 3.390 1.00 0.00 ATOM 2654 CD GLN A 337 18.823 3.062 3.719 1.00 0.00 ATOM 2655 OE1 GLN A 337 19.432 2.677 4.717 1.00 0.00 ATOM 2656 NE2 GLN A 337 18.222 2.230 2.877 1.00 0.00 ATOM 2657 O GLN A 337 17.352 7.487 6.405 1.00 0.00 ATOM 2658 C GLN A 337 17.438 6.273 6.516 1.00 0.00 ATOM 2659 N ARG A 338 17.745 5.799 7.702 1.00 0.00 ATOM 2660 CA ARG A 338 17.822 6.622 8.911 1.00 0.00 ATOM 2661 CB ARG A 338 18.360 5.822 10.100 1.00 0.00 ATOM 2662 CG ARG A 338 17.369 4.823 10.675 1.00 0.00 ATOM 2663 CD ARG A 338 17.987 4.027 11.813 1.00 0.00 ATOM 2664 NE ARG A 338 18.377 4.881 12.932 1.00 0.00 ATOM 2665 CZ ARG A 338 19.134 4.482 13.948 1.00 0.00 ATOM 2666 NH1 ARG A 338 19.438 5.328 14.922 1.00 0.00 ATOM 2667 NH2 ARG A 338 19.585 3.234 13.989 1.00 0.00 ATOM 2668 O ARG A 338 19.787 7.743 8.104 1.00 0.00 ATOM 2669 C ARG A 338 18.746 7.821 8.758 1.00 0.00 ATOM 2670 N ALA A 339 18.365 8.919 9.401 1.00 0.00 ATOM 2671 CA ALA A 339 19.156 10.139 9.392 1.00 0.00 ATOM 2672 CB ALA A 339 18.543 11.150 8.433 1.00 0.00 ATOM 2673 O ALA A 339 18.316 10.402 11.607 1.00 0.00 ATOM 2674 C ALA A 339 19.101 10.799 10.745 1.00 0.00 ATOM 2675 N ILE A 340 19.957 11.872 10.968 1.00 0.00 ATOM 2676 CA ILE A 340 19.968 12.623 12.215 1.00 0.00 ATOM 2677 CB ILE A 340 21.430 13.014 12.498 1.00 0.00 ATOM 2678 CG1 ILE A 340 21.565 13.592 13.908 1.00 0.00 ATOM 2679 CG2 ILE A 340 21.902 14.062 11.501 1.00 0.00 ATOM 2680 CD1 ILE A 340 22.998 13.771 14.359 1.00 0.00 ATOM 2681 O ILE A 340 19.442 14.861 11.509 1.00 0.00 ATOM 2682 C ILE A 340 19.118 13.885 12.195 1.00 0.00 ATOM 2683 N THR A 341 17.929 13.808 12.840 1.00 0.00 ATOM 2684 CA THR A 341 16.933 14.872 12.766 1.00 0.00 ATOM 2685 CB THR A 341 15.689 14.417 11.983 1.00 0.00 ATOM 2686 CG2 THR A 341 16.056 14.081 10.546 1.00 0.00 ATOM 2687 OG1 THR A 341 15.130 13.252 12.604 1.00 0.00 ATOM 2688 O THR A 341 15.221 15.565 14.276 1.00 0.00 ATOM 2689 C THR A 341 16.424 15.352 14.120 1.00 0.00 ATOM 2690 N PRO A 342 17.310 15.579 15.086 1.00 0.00 ATOM 2691 CA PRO A 342 16.848 15.992 16.416 1.00 0.00 ATOM 2692 CB PRO A 342 18.131 16.061 17.248 1.00 0.00 ATOM 2693 CG PRO A 342 19.060 15.105 16.579 1.00 0.00 ATOM 2694 CD PRO A 342 18.794 15.225 15.105 1.00 0.00 ATOM 2695 O PRO A 342 15.285 17.607 17.256 1.00 0.00 ATOM 2696 C PRO A 342 16.138 17.349 16.399 1.00 0.00 ATOM 2697 N GLY A 343 16.447 18.191 15.419 1.00 0.00 ATOM 2698 CA GLY A 343 15.851 19.515 15.378 1.00 0.00 ATOM 2699 O GLY A 343 17.129 21.411 14.697 1.00 0.00 ATOM 2700 C GLY A 343 16.510 20.406 14.344 1.00 0.00 ATOM 2701 N GLN A 344 16.134 20.313 13.082 1.00 0.00 ATOM 2702 CA GLN A 344 16.735 21.122 12.029 1.00 0.00 ATOM 2703 CB GLN A 344 18.058 20.482 11.404 1.00 0.00 ATOM 2704 CG GLN A 344 19.182 19.981 12.295 1.00 0.00 ATOM 2705 CD GLN A 344 20.085 19.109 11.377 1.00 0.00 ATOM 2706 OE1 GLN A 344 20.374 17.974 11.684 1.00 0.00 ATOM 2707 NE2 GLN A 344 20.482 19.621 10.198 1.00 0.00 ATOM 2708 O GLN A 344 14.756 21.751 10.848 1.00 0.00 ATOM 2709 C GLN A 344 15.983 21.778 10.902 1.00 0.00 ATOM 2710 N ALA A 345 16.775 22.405 9.942 1.00 0.00 ATOM 2711 CA ALA A 345 16.204 23.060 8.771 1.00 0.00 ATOM 2712 CB ALA A 345 16.589 24.523 8.612 1.00 0.00 ATOM 2713 O ALA A 345 17.967 22.013 7.522 1.00 0.00 ATOM 2714 C ALA A 345 16.764 22.274 7.590 1.00 0.00 ATOM 2715 N VAL A 346 15.895 22.129 6.589 1.00 0.00 ATOM 2716 CA VAL A 346 16.275 21.442 5.350 1.00 0.00 ATOM 2717 CB VAL A 346 15.896 19.952 5.393 1.00 0.00 ATOM 2718 CG1 VAL A 346 16.673 19.233 6.486 1.00 0.00 ATOM 2719 CG2 VAL A 346 14.408 19.786 5.672 1.00 0.00 ATOM 2720 O VAL A 346 14.827 22.930 4.166 1.00 0.00 ATOM 2721 C VAL A 346 15.630 21.990 4.097 1.00 0.00 ATOM 2722 N VAL A 347 15.894 21.243 2.954 1.00 0.00 ATOM 2723 CA VAL A 347 15.297 21.629 1.678 1.00 0.00 ATOM 2724 CB VAL A 347 16.339 22.259 0.735 1.00 0.00 ATOM 2725 CG1 VAL A 347 16.916 23.526 1.350 1.00 0.00 ATOM 2726 CG2 VAL A 347 17.481 21.286 0.479 1.00 0.00 ATOM 2727 O VAL A 347 15.137 19.247 1.387 1.00 0.00 ATOM 2728 C VAL A 347 14.750 20.372 1.033 1.00 0.00 ATOM 2729 N PHE A 348 13.882 20.554 0.051 1.00 0.00 ATOM 2730 CA PHE A 348 13.249 19.514 -0.708 1.00 0.00 ATOM 2731 CB PHE A 348 11.748 19.484 -0.408 1.00 0.00 ATOM 2732 CG PHE A 348 11.424 19.208 1.035 1.00 0.00 ATOM 2733 CD1 PHE A 348 11.237 20.249 1.927 1.00 0.00 ATOM 2734 CD2 PHE A 348 11.308 17.908 1.496 1.00 0.00 ATOM 2735 CE1 PHE A 348 10.939 19.995 3.253 1.00 0.00 ATOM 2736 CE2 PHE A 348 11.009 17.656 2.822 1.00 0.00 ATOM 2737 CZ PHE A 348 10.825 18.692 3.698 1.00 0.00 ATOM 2738 O PHE A 348 13.186 20.924 -2.650 1.00 0.00 ATOM 2739 C PHE A 348 13.485 19.817 -2.184 1.00 0.00 ATOM 2740 N TYR A 349 14.039 18.847 -2.904 1.00 0.00 ATOM 2741 CA TYR A 349 14.313 19.020 -4.326 1.00 0.00 ATOM 2742 CB TYR A 349 15.774 18.684 -4.605 1.00 0.00 ATOM 2743 CG TYR A 349 16.692 19.718 -3.984 1.00 0.00 ATOM 2744 CD1 TYR A 349 16.560 21.068 -4.310 1.00 0.00 ATOM 2745 CD2 TYR A 349 17.625 19.365 -3.008 1.00 0.00 ATOM 2746 CE1 TYR A 349 17.320 22.044 -3.675 1.00 0.00 ATOM 2747 CE2 TYR A 349 18.398 20.336 -2.360 1.00 0.00 ATOM 2748 CZ TYR A 349 18.233 21.676 -2.701 1.00 0.00 ATOM 2749 OH TYR A 349 18.945 22.654 -2.050 1.00 0.00 ATOM 2750 O TYR A 349 13.433 16.818 -4.665 1.00 0.00 ATOM 2751 C TYR A 349 13.638 17.934 -5.133 1.00 0.00 ATOM 2752 N ASP A 350 13.253 18.281 -6.353 1.00 0.00 ATOM 2753 CA ASP A 350 12.653 17.305 -7.238 1.00 0.00 ATOM 2754 CB ASP A 350 11.144 17.308 -7.051 1.00 0.00 ATOM 2755 CG ASP A 350 10.476 16.179 -7.822 1.00 0.00 ATOM 2756 OD1 ASP A 350 10.663 16.097 -9.054 1.00 0.00 ATOM 2757 OD2 ASP A 350 9.767 15.366 -7.190 1.00 0.00 ATOM 2758 O ASP A 350 12.579 18.925 -9.012 1.00 0.00 ATOM 2759 C ASP A 350 12.907 17.789 -8.667 1.00 0.00 ATOM 2760 N GLY A 351 13.560 16.949 -9.464 1.00 0.00 ATOM 2761 CA GLY A 351 13.855 17.309 -10.845 1.00 0.00 ATOM 2762 O GLY A 351 14.743 19.182 -12.056 1.00 0.00 ATOM 2763 C GLY A 351 14.795 18.491 -11.033 1.00 0.00 ATOM 2764 N GLU A 352 15.768 18.734 -10.016 1.00 0.00 ATOM 2765 CA GLU A 352 16.713 19.835 -10.104 1.00 0.00 ATOM 2766 CB GLU A 352 17.206 20.006 -11.542 1.00 0.00 ATOM 2767 CG GLU A 352 17.972 18.807 -12.082 1.00 0.00 ATOM 2768 CD GLU A 352 18.428 19.006 -13.513 1.00 0.00 ATOM 2769 OE1 GLU A 352 18.143 20.079 -14.086 1.00 0.00 ATOM 2770 OE2 GLU A 352 19.070 18.087 -14.063 1.00 0.00 ATOM 2771 O GLU A 352 16.758 22.220 -9.924 1.00 0.00 ATOM 2772 C GLU A 352 16.145 21.178 -9.680 1.00 0.00 ATOM 2773 N GLU A 353 14.943 21.111 -9.054 1.00 0.00 ATOM 2774 CA GLU A 353 14.316 22.344 -8.581 1.00 0.00 ATOM 2775 CB GLU A 353 12.954 22.542 -9.248 1.00 0.00 ATOM 2776 CG GLU A 353 13.025 22.788 -10.746 1.00 0.00 ATOM 2777 CD GLU A 353 11.662 23.037 -11.362 1.00 0.00 ATOM 2778 OE1 GLU A 353 10.659 23.000 -10.618 1.00 0.00 ATOM 2779 OE2 GLU A 353 11.596 23.268 -12.588 1.00 0.00 ATOM 2780 O GLU A 353 13.749 21.205 -6.554 1.00 0.00 ATOM 2781 C GLU A 353 14.125 22.262 -7.069 1.00 0.00 ATOM 2782 N CYS A 354 14.345 23.376 -6.378 1.00 0.00 ATOM 2783 CA CYS A 354 14.138 23.435 -4.932 1.00 0.00 ATOM 2784 CB CYS A 354 14.945 24.581 -4.321 1.00 0.00 ATOM 2785 SG CYS A 354 14.744 24.770 -2.534 1.00 0.00 ATOM 2786 O CYS A 354 12.140 24.771 -4.940 1.00 0.00 ATOM 2787 C CYS A 354 12.638 23.661 -4.750 1.00 0.00 ATOM 2788 N LEU A 355 11.913 22.620 -4.343 1.00 0.00 ATOM 2789 CA LEU A 355 10.465 22.759 -4.204 1.00 0.00 ATOM 2790 CB LEU A 355 9.796 21.420 -4.624 1.00 0.00 ATOM 2791 CG LEU A 355 10.146 20.912 -6.035 1.00 0.00 ATOM 2792 CD1 LEU A 355 9.306 19.673 -6.360 1.00 0.00 ATOM 2793 CD2 LEU A 355 9.867 22.005 -7.073 1.00 0.00 ATOM 2794 O LEU A 355 8.838 23.648 -2.685 1.00 0.00 ATOM 2795 C LEU A 355 9.968 23.170 -2.829 1.00 0.00 ATOM 2796 N GLY A 356 10.789 22.951 -1.805 1.00 0.00 ATOM 2797 CA GLY A 356 10.377 23.312 -0.461 1.00 0.00 ATOM 2798 O GLY A 356 12.692 23.228 0.194 1.00 0.00 ATOM 2799 C GLY A 356 11.553 23.650 0.432 1.00 0.00 ATOM 2800 N GLY A 357 11.301 24.441 1.473 1.00 0.00 ATOM 2801 CA GLY A 357 12.264 24.672 2.544 1.00 0.00 ATOM 2802 O GLY A 357 10.427 25.012 4.042 1.00 0.00 ATOM 2803 C GLY A 357 11.487 24.427 3.824 1.00 0.00 ATOM 2804 N GLY A 358 12.009 23.573 4.686 1.00 0.00 ATOM 2805 CA GLY A 358 11.260 23.270 5.885 1.00 0.00 ATOM 2806 O GLY A 358 13.280 23.125 7.212 1.00 0.00 ATOM 2807 C GLY A 358 12.042 23.046 7.175 1.00 0.00 ATOM 2808 N LEU A 359 11.306 22.797 8.218 1.00 0.00 ATOM 2809 CA LEU A 359 11.894 22.566 9.544 1.00 0.00 ATOM 2810 CB LEU A 359 11.275 23.512 10.578 1.00 0.00 ATOM 2811 CG LEU A 359 11.756 23.344 12.021 1.00 0.00 ATOM 2812 CD1 LEU A 359 13.233 23.684 12.137 1.00 0.00 ATOM 2813 CD2 LEU A 359 10.981 24.262 12.953 1.00 0.00 ATOM 2814 O LEU A 359 10.374 20.753 9.693 1.00 0.00 ATOM 2815 C LEU A 359 11.542 21.106 9.801 1.00 0.00 ATOM 2816 N ILE A 360 12.550 20.280 10.077 1.00 0.00 ATOM 2817 CA ILE A 360 12.419 18.857 10.337 1.00 0.00 ATOM 2818 CB ILE A 360 13.410 18.035 9.494 1.00 0.00 ATOM 2819 CG1 ILE A 360 13.223 18.338 8.007 1.00 0.00 ATOM 2820 CG2 ILE A 360 13.189 16.545 9.714 1.00 0.00 ATOM 2821 CD1 ILE A 360 11.840 18.015 7.486 1.00 0.00 ATOM 2822 O ILE A 360 13.762 18.938 12.350 1.00 0.00 ATOM 2823 C ILE A 360 12.706 18.610 11.839 1.00 0.00 ATOM 2824 N ASP A 361 11.727 18.060 12.571 1.00 0.00 ATOM 2825 CA ASP A 361 11.829 17.820 13.999 1.00 0.00 ATOM 2826 CB ASP A 361 10.729 18.574 14.749 1.00 0.00 ATOM 2827 CG ASP A 361 11.030 18.723 16.227 1.00 0.00 ATOM 2828 OD1 ASP A 361 12.112 18.274 16.662 1.00 0.00 ATOM 2829 OD2 ASP A 361 10.185 19.287 16.952 1.00 0.00 ATOM 2830 O ASP A 361 11.078 15.530 13.690 1.00 0.00 ATOM 2831 C ASP A 361 11.695 16.355 14.380 1.00 0.00 ATOM 2832 N ASN A 362 12.274 16.040 15.528 1.00 0.00 ATOM 2833 CA ASN A 362 12.179 14.687 16.067 1.00 0.00 ATOM 2834 CB ASN A 362 13.220 13.775 15.415 1.00 0.00 ATOM 2835 CG ASN A 362 13.039 12.318 15.794 1.00 0.00 ATOM 2836 ND2 ASN A 362 14.010 11.772 16.515 1.00 0.00 ATOM 2837 OD1 ASN A 362 12.036 11.696 15.440 1.00 0.00 ATOM 2838 O ASN A 362 13.290 15.389 18.069 1.00 0.00 ATOM 2839 C ASN A 362 12.418 14.677 17.570 1.00 0.00 ATOM 2840 N ALA A 363 11.601 13.926 18.289 1.00 0.00 ATOM 2841 CA ALA A 363 11.753 13.769 19.739 1.00 0.00 ATOM 2842 CB ALA A 363 10.619 14.470 20.471 1.00 0.00 ATOM 2843 O ALA A 363 10.864 11.561 19.546 1.00 0.00 ATOM 2844 C ALA A 363 11.728 12.283 20.058 1.00 0.00 ATOM 2845 N TYR A 364 12.668 11.824 20.885 1.00 0.00 ATOM 2846 CA TYR A 364 12.741 10.440 21.236 1.00 0.00 ATOM 2847 CB TYR A 364 13.616 9.680 20.239 1.00 0.00 ATOM 2848 CG TYR A 364 15.061 10.124 20.227 1.00 0.00 ATOM 2849 CD1 TYR A 364 16.002 9.507 21.040 1.00 0.00 ATOM 2850 CD2 TYR A 364 15.478 11.163 19.402 1.00 0.00 ATOM 2851 CE1 TYR A 364 17.326 9.908 21.036 1.00 0.00 ATOM 2852 CE2 TYR A 364 16.798 11.576 19.386 1.00 0.00 ATOM 2853 CZ TYR A 364 17.722 10.938 20.213 1.00 0.00 ATOM 2854 OH TYR A 364 19.036 11.339 20.207 1.00 0.00 ATOM 2855 O TYR A 364 13.941 11.218 23.168 1.00 0.00 ATOM 2856 C TYR A 364 13.336 10.290 22.628 1.00 0.00 ATOM 2857 N ARG A 365 13.109 9.121 23.203 1.00 0.00 ATOM 2858 CA ARG A 365 13.608 8.781 24.525 1.00 0.00 ATOM 2859 CB ARG A 365 12.449 8.603 25.509 1.00 0.00 ATOM 2860 CG ARG A 365 12.885 8.400 26.951 1.00 0.00 ATOM 2861 CD ARG A 365 11.687 8.280 27.878 1.00 0.00 ATOM 2862 NE ARG A 365 12.086 8.012 29.258 1.00 0.00 ATOM 2863 CZ ARG A 365 11.234 7.854 30.266 1.00 0.00 ATOM 2864 NH1 ARG A 365 11.688 7.613 31.487 1.00 0.00 ATOM 2865 NH2 ARG A 365 9.930 7.939 30.049 1.00 0.00 ATOM 2866 O ARG A 365 13.756 6.429 24.115 1.00 0.00 ATOM 2867 C ARG A 365 14.359 7.470 24.374 1.00 0.00 ATOM 2868 N ASP A 366 15.774 7.594 24.519 1.00 0.00 ATOM 2869 CA ASP A 366 16.642 6.435 24.382 1.00 0.00 ATOM 2870 CB ASP A 366 16.451 5.496 25.574 1.00 0.00 ATOM 2871 CG ASP A 366 16.846 6.136 26.890 1.00 0.00 ATOM 2872 OD1 ASP A 366 17.955 6.707 26.962 1.00 0.00 ATOM 2873 OD2 ASP A 366 16.048 6.067 27.849 1.00 0.00 ATOM 2874 O ASP A 366 16.382 4.475 23.020 1.00 0.00 ATOM 2875 C ASP A 366 16.427 5.703 23.062 1.00 0.00 ATOM 2876 N GLY A 367 16.303 6.453 22.023 1.00 0.00 ATOM 2877 CA GLY A 367 16.117 5.876 20.704 1.00 0.00 ATOM 2878 O GLY A 367 14.499 5.389 19.069 1.00 0.00 ATOM 2879 C GLY A 367 14.697 5.611 20.271 1.00 0.00 ATOM 2880 N GLN A 368 13.718 5.639 21.175 1.00 0.00 ATOM 2881 CA GLN A 368 12.328 5.365 20.803 1.00 0.00 ATOM 2882 CB GLN A 368 11.581 4.727 21.976 1.00 0.00 ATOM 2883 CG GLN A 368 10.141 4.351 21.664 1.00 0.00 ATOM 2884 CD GLN A 368 9.439 3.707 22.841 1.00 0.00 ATOM 2885 OE1 GLN A 368 10.045 3.476 23.887 1.00 0.00 ATOM 2886 NE2 GLN A 368 8.154 3.413 22.674 1.00 0.00 ATOM 2887 O GLN A 368 11.652 7.609 21.226 1.00 0.00 ATOM 2888 C GLN A 368 11.667 6.679 20.415 1.00 0.00 ATOM 2889 N VAL A 369 11.120 6.810 19.197 1.00 0.00 ATOM 2890 CA VAL A 369 10.444 8.047 18.806 1.00 0.00 ATOM 2891 CB VAL A 369 10.004 8.029 17.330 1.00 0.00 ATOM 2892 CG1 VAL A 369 9.154 9.249 17.010 1.00 0.00 ATOM 2893 CG2 VAL A 369 11.219 8.037 16.414 1.00 0.00 ATOM 2894 O VAL A 369 8.407 7.387 19.863 1.00 0.00 ATOM 2895 C VAL A 369 9.188 8.304 19.615 1.00 0.00 ATOM 2896 N CYS A 370 9.037 9.542 20.052 1.00 0.00 ATOM 2897 CA CYS A 370 7.822 9.978 20.722 1.00 0.00 ATOM 2898 CB CYS A 370 8.087 11.244 21.542 1.00 0.00 ATOM 2899 SG CYS A 370 9.314 11.039 22.854 1.00 0.00 ATOM 2900 O CYS A 370 6.989 10.593 18.566 1.00 0.00 ATOM 2901 C CYS A 370 6.714 10.345 19.742 1.00 0.00 ATOM 2902 N GLN A 371 5.484 10.504 20.239 1.00 0.00 ATOM 2903 CA GLN A 371 4.382 10.856 19.350 1.00 0.00 ATOM 2904 CB GLN A 371 3.111 10.963 20.194 1.00 0.00 ATOM 2905 CG GLN A 371 2.570 9.627 20.675 1.00 0.00 ATOM 2906 CD GLN A 371 1.356 9.776 21.570 1.00 0.00 ATOM 2907 OE1 GLN A 371 0.931 10.891 21.872 1.00 0.00 ATOM 2908 NE2 GLN A 371 0.795 8.652 21.997 1.00 0.00 ATOM 2909 O GLN A 371 4.036 12.526 17.665 1.00 0.00 ATOM 2910 C GLN A 371 4.634 12.205 18.696 1.00 0.00 ATOM 2911 N TYR A 372 5.499 13.148 19.258 1.00 0.00 ATOM 2912 CA TYR A 372 5.685 14.469 18.679 1.00 0.00 ATOM 2913 CB TYR A 372 6.821 15.212 19.389 1.00 0.00 ATOM 2914 CG TYR A 372 6.454 15.721 20.766 1.00 0.00 ATOM 2915 CD1 TYR A 372 6.925 15.085 21.908 1.00 0.00 ATOM 2916 CD2 TYR A 372 5.637 16.834 20.917 1.00 0.00 ATOM 2917 CE1 TYR A 372 6.592 15.543 23.169 1.00 0.00 ATOM 2918 CE2 TYR A 372 5.298 17.307 22.170 1.00 0.00 ATOM 2919 CZ TYR A 372 5.782 16.650 23.300 1.00 0.00 ATOM 2920 OH TYR A 372 5.452 17.108 24.555 1.00 0.00 ATOM 2921 O TYR A 372 5.468 14.973 16.333 1.00 0.00 ATOM 2922 C TYR A 372 6.027 14.299 17.196 1.00 0.00 ATOM 2923 N ILE A 373 6.938 13.373 16.906 1.00 0.00 ATOM 2924 CA ILE A 373 7.363 13.144 15.524 1.00 0.00 ATOM 2925 CB ILE A 373 8.910 13.290 15.425 1.00 0.00 ATOM 2926 CG1 ILE A 373 9.320 14.703 15.882 1.00 0.00 ATOM 2927 CG2 ILE A 373 9.387 13.058 13.933 1.00 0.00 ATOM 2928 CD1 ILE A 373 8.709 15.803 15.075 1.00 0.00 ATOM 2929 O ILE A 373 6.925 10.842 15.838 1.00 0.00 ATOM 2930 C ILE A 373 6.971 11.768 15.015 1.00 0.00 ENDMDL EXPDTA 2hmaA MODEL 2 REMARK 44 REMARK 44 model 2 is called 2hmaA ATOM 1 N SER 2 17.672 35.697 36.692 1.00 0.00 ATOM 2 CA SER 2 18.888 34.961 37.179 1.00 0.00 ATOM 3 CB SER 2 19.203 35.300 38.660 1.00 0.00 ATOM 4 OG SER 2 18.088 35.079 39.519 1.00 0.00 ATOM 5 O SER 2 19.649 32.677 37.508 1.00 0.00 ATOM 6 C SER 2 18.853 33.433 36.931 1.00 0.00 ATOM 7 N ASP 3 17.933 32.996 36.074 1.00 0.00 ATOM 8 CA ASP 3 17.825 31.590 35.695 1.00 0.00 ATOM 9 CB ASP 3 16.416 31.295 35.143 1.00 0.00 ATOM 10 CG ASP 3 16.042 29.803 35.209 1.00 0.00 ATOM 11 OD1 ASP 3 16.834 28.950 34.717 1.00 0.00 ATOM 12 OD2 ASP 3 14.938 29.496 35.738 1.00 0.00 ATOM 13 O ASP 3 19.899 30.622 34.906 1.00 0.00 ATOM 14 C ASP 3 18.903 31.319 34.641 1.00 0.00 ATOM 15 N ASN 4 18.722 31.921 33.466 1.00 0.00 ATOM 16 CA ASN 4 19.695 31.838 32.387 1.00 0.00 ATOM 17 CB ASN 4 19.089 32.379 31.102 1.00 0.00 ATOM 18 CG ASN 4 17.997 31.485 30.552 1.00 0.00 ATOM 19 ND2 ASN 4 17.992 30.212 30.954 1.00 0.00 ATOM 20 OD1 ASN 4 17.173 31.932 29.762 1.00 0.00 ATOM 21 O ASN 4 22.033 32.250 32.051 1.00 0.00 ATOM 22 C ASN 4 21.020 32.541 32.689 1.00 0.00 ATOM 23 N SER 5 21.015 33.439 33.676 1.00 0.00 ATOM 24 CA SER 5 22.206 34.222 34.043 1.00 0.00 ATOM 25 CB SER 5 21.839 35.340 35.013 1.00 0.00 ATOM 26 OG SER 5 21.475 34.818 36.277 1.00 0.00 ATOM 27 O SER 5 24.487 33.813 34.655 1.00 0.00 ATOM 28 C SER 5 23.343 33.369 34.597 1.00 0.00 ATOM 29 N LYS 6 23.002 32.135 34.963 1.00 0.00 ATOM 30 CA LYS 6 23.968 31.126 35.384 1.00 0.00 ATOM 31 CB LYS 6 23.350 30.197 36.444 1.00 0.00 ATOM 32 CG LYS 6 23.474 30.780 37.865 1.00 0.00 ATOM 33 CD LYS 6 23.042 29.819 38.993 1.00 0.00 ATOM 34 CE LYS 6 21.512 29.808 39.167 1.00 0.00 ATOM 35 NZ LYS 6 21.145 29.545 40.607 1.00 0.00 ATOM 36 O LYS 6 25.463 29.505 34.447 1.00 0.00 ATOM 37 C LYS 6 24.556 30.308 34.234 1.00 0.00 ATOM 38 N THR 7 24.030 30.509 33.026 1.00 0.00 ATOM 39 CA THR 7 24.521 29.843 31.839 1.00 0.00 ATOM 40 CB THR 7 23.368 29.255 31.018 1.00 0.00 ATOM 41 CG2 THR 7 23.866 28.501 29.823 1.00 0.00 ATOM 42 OG1 THR 7 22.658 28.328 31.832 1.00 0.00 ATOM 43 O THR 7 24.806 31.833 30.533 1.00 0.00 ATOM 44 C THR 7 25.333 30.829 31.012 1.00 0.00 ATOM 45 N ARG 8 26.624 30.536 30.875 1.00 0.00 ATOM 46 CA ARG 8 27.495 31.336 30.028 1.00 0.00 ATOM 47 CB ARG 8 28.941 31.392 30.568 1.00 0.00 ATOM 48 CG ARG 8 29.854 32.214 29.663 1.00 0.00 ATOM 49 CD ARG 8 31.142 32.589 30.351 1.00 0.00 ATOM 50 NE ARG 8 30.914 33.372 31.556 1.00 0.00 ATOM 51 CZ ARG 8 31.770 33.412 32.575 1.00 0.00 ATOM 52 NH1 ARG 8 32.907 32.734 32.526 1.00 0.00 ATOM 53 NH2 ARG 8 31.485 34.125 33.647 1.00 0.00 ATOM 54 O ARG 8 27.813 29.633 28.366 1.00 0.00 ATOM 55 C ARG 8 27.496 30.801 28.602 1.00 0.00 ATOM 56 N VAL 9 27.167 31.679 27.662 1.00 0.00 ATOM 57 CA VAL 9 27.149 31.355 26.240 1.00 0.00 ATOM 58 CB VAL 9 25.737 31.606 25.626 1.00 0.00 ATOM 59 CG1 VAL 9 25.696 31.225 24.147 1.00 0.00 ATOM 60 CG2 VAL 9 24.676 30.826 26.407 1.00 0.00 ATOM 61 O VAL 9 28.116 33.474 25.640 1.00 0.00 ATOM 62 C VAL 9 28.166 32.239 25.535 1.00 0.00 ATOM 63 N VAL 10 29.117 31.608 24.855 1.00 0.00 ATOM 64 CA VAL 10 30.018 32.349 24.000 1.00 0.00 ATOM 65 CB VAL 10 31.463 31.826 24.076 1.00 0.00 ATOM 66 CG1 VAL 10 32.317 32.490 23.011 1.00 0.00 ATOM 67 CG2 VAL 10 32.038 32.079 25.466 1.00 0.00 ATOM 68 O VAL 10 29.287 31.257 22.000 1.00 0.00 ATOM 69 C VAL 10 29.478 32.324 22.588 1.00 0.00 ATOM 70 N VAL 11 29.203 33.508 22.051 1.00 0.00 ATOM 71 CA VAL 11 28.679 33.647 20.687 1.00 0.00 ATOM 72 CB VAL 11 27.427 34.643 20.624 1.00 0.00 ATOM 73 CG1 VAL 11 27.689 35.894 21.342 1.00 0.00 ATOM 74 CG2 VAL 11 26.991 34.935 19.183 1.00 0.00 ATOM 75 O VAL 11 30.462 34.990 19.882 1.00 0.00 ATOM 76 C VAL 11 29.756 34.015 19.692 1.00 0.00 ATOM 77 N GLY 12 29.892 33.242 18.625 1.00 0.00 ATOM 78 CA GLY 12 30.701 33.667 17.495 1.00 0.00 ATOM 79 O GLY 12 29.007 34.868 16.311 1.00 0.00 ATOM 80 C GLY 12 30.112 34.907 16.841 1.00 0.00 ATOM 81 N MET 13 30.832 36.012 16.906 1.00 0.00 ATOM 82 CA MET 13 30.417 37.232 16.241 1.00 0.00 ATOM 83 CB MET 13 30.339 38.392 17.253 1.00 0.00 ATOM 84 CG MET 13 29.098 38.289 18.179 1.00 0.00 ATOM 85 SD MET 13 29.066 39.705 19.469 1.00 0.00 ATOM 86 CE MET 13 28.117 41.014 18.402 1.00 0.00 ATOM 87 O MET 13 32.513 37.898 15.195 1.00 0.00 ATOM 88 C MET 13 31.313 37.576 15.045 1.00 0.00 ATOM 89 N SER 14 30.719 37.532 13.856 1.00 0.00 ATOM 90 CA SER 14 31.459 37.756 12.629 1.00 0.00 ATOM 91 CB SER 14 30.869 36.904 11.526 1.00 0.00 ATOM 92 OG SER 14 29.542 37.331 11.289 1.00 0.00 ATOM 93 O SER 14 32.263 39.586 11.341 1.00 0.00 ATOM 94 C SER 14 31.458 39.207 12.181 1.00 0.00 ATOM 95 N GLY 15 30.555 40.010 12.733 1.00 0.00 ATOM 96 CA GLY 15 30.322 41.366 12.261 1.00 0.00 ATOM 97 O GLY 15 28.690 42.527 10.974 1.00 0.00 ATOM 98 C GLY 15 29.095 41.443 11.362 1.00 0.00 ATOM 99 N GLY 16 28.498 40.300 11.041 1.00 0.00 ATOM 100 CA GLY 16 27.277 40.241 10.226 1.00 0.00 ATOM 101 O GLY 16 25.982 40.457 12.241 1.00 0.00 ATOM 102 C GLY 16 25.982 40.420 11.004 1.00 0.00 ATOM 103 N VAL 17 24.860 40.532 10.287 1.00 0.00 ATOM 104 CA VAL 17 23.568 40.747 10.956 1.00 0.00 ATOM 105 CB VAL 17 22.500 41.309 10.000 1.00 0.00 ATOM 106 CG1 VAL 17 22.015 40.207 9.034 1.00 0.00 ATOM 107 CG2 VAL 17 21.342 41.923 10.803 1.00 0.00 ATOM 108 O VAL 17 22.535 39.615 12.799 1.00 0.00 ATOM 109 C VAL 17 23.080 39.501 11.711 1.00 0.00 ATOM 110 N ASP 18 23.339 38.316 11.169 1.00 0.00 ATOM 111 CA ASP 18 22.948 37.075 11.846 1.00 0.00 ATOM 112 CB ASP 18 23.252 35.874 10.942 1.00 0.00 ATOM 113 CG ASP 18 22.513 35.961 9.583 1.00 0.00 ATOM 114 OD1 ASP 18 21.435 36.610 9.503 1.00 0.00 ATOM 115 OD2 ASP 18 23.004 35.387 8.575 1.00 0.00 ATOM 116 O ASP 18 22.818 36.775 14.246 1.00 0.00 ATOM 117 C ASP 18 23.547 36.927 13.254 1.00 0.00 ATOM 118 N SER 19 24.875 37.008 13.350 1.00 0.00 ATOM 119 CA SER 19 25.548 36.896 14.653 1.00 0.00 ATOM 120 CB SER 19 27.073 36.646 14.511 1.00 0.00 ATOM 121 OG SER 19 27.715 37.538 13.611 1.00 0.00 ATOM 122 O SER 19 25.162 37.885 16.799 1.00 0.00 ATOM 123 C SER 19 25.230 38.056 15.585 1.00 0.00 ATOM 124 N SER 20 25.008 39.241 15.029 1.00 0.00 ATOM 125 CA SER 20 24.600 40.388 15.852 1.00 0.00 ATOM 126 CB SER 20 24.495 41.659 15.009 1.00 0.00 ATOM 127 OG SER 20 25.645 41.825 14.164 1.00 0.00 ATOM 128 O SER 20 23.073 40.403 17.679 1.00 0.00 ATOM 129 C SER 20 23.272 40.122 16.495 1.00 0.00 ATOM 130 N VAL 21 22.335 39.586 15.708 1.00 0.00 ATOM 131 CA VAL 21 21.019 39.290 16.237 1.00 0.00 ATOM 132 CB VAL 21 19.973 39.084 15.098 1.00 0.00 ATOM 133 CG1 VAL 21 18.666 38.474 15.644 1.00 0.00 ATOM 134 CG2 VAL 21 19.684 40.425 14.400 1.00 0.00 ATOM 135 O VAL 21 20.416 38.091 18.226 1.00 0.00 ATOM 136 C VAL 21 21.112 38.105 17.214 1.00 0.00 ATOM 137 N THR 22 21.979 37.136 16.918 1.00 0.00 ATOM 138 CA THR 22 22.178 35.955 17.781 1.00 0.00 ATOM 139 CB THR 22 23.262 35.032 17.198 1.00 0.00 ATOM 140 CG2 THR 22 23.568 33.888 18.102 1.00 0.00 ATOM 141 OG1 THR 22 22.808 34.511 15.960 1.00 0.00 ATOM 142 O THR 22 21.950 35.988 20.181 1.00 0.00 ATOM 143 C THR 22 22.571 36.412 19.183 1.00 0.00 ATOM 144 N ALA 23 23.560 37.305 19.254 1.00 0.00 ATOM 145 CA ALA 23 23.972 37.933 20.497 1.00 0.00 ATOM 146 CB ALA 23 25.199 38.844 20.255 1.00 0.00 ATOM 147 O ALA 23 22.698 38.614 22.418 1.00 0.00 ATOM 148 C ALA 23 22.848 38.716 21.205 1.00 0.00 ATOM 149 N LEU 24 22.087 39.526 20.479 1.00 0.00 ATOM 150 CA LEU 24 21.003 40.317 21.086 1.00 0.00 ATOM 151 CB LEU 24 20.359 41.235 20.043 1.00 0.00 ATOM 152 CG LEU 24 18.951 41.829 20.252 1.00 0.00 ATOM 153 CD1 LEU 24 18.966 43.079 21.119 1.00 0.00 ATOM 154 CD2 LEU 24 18.270 42.128 18.888 1.00 0.00 ATOM 155 O LEU 24 19.527 39.590 22.807 1.00 0.00 ATOM 156 C LEU 24 19.951 39.388 21.679 1.00 0.00 ATOM 157 N LEU 25 19.542 38.354 20.938 1.00 0.00 ATOM 158 CA LEU 25 18.507 37.436 21.440 1.00 0.00 ATOM 159 CB LEU 25 18.112 36.398 20.396 1.00 0.00 ATOM 160 CG LEU 25 17.543 37.057 19.162 1.00 0.00 ATOM 161 CD1 LEU 25 17.179 36.000 18.174 1.00 0.00 ATOM 162 CD2 LEU 25 16.339 37.985 19.549 1.00 0.00 ATOM 163 O LEU 25 18.148 36.650 23.667 1.00 0.00 ATOM 164 C LEU 25 18.935 36.735 22.722 1.00 0.00 ATOM 165 N LEU 26 20.191 36.275 22.765 1.00 0.00 ATOM 166 CA LEU 26 20.716 35.614 23.944 1.00 0.00 ATOM 167 CB LEU 26 22.095 35.034 23.666 1.00 0.00 ATOM 168 CG LEU 26 22.194 33.758 22.828 1.00 0.00 ATOM 169 CD1 LEU 26 23.662 33.588 22.460 1.00 0.00 ATOM 170 CD2 LEU 26 21.633 32.534 23.570 1.00 0.00 ATOM 171 O LEU 26 20.594 36.119 26.278 1.00 0.00 ATOM 172 C LEU 26 20.812 36.547 25.134 1.00 0.00 ATOM 173 N LYS 27 21.184 37.802 24.888 1.00 0.00 ATOM 174 CA LYS 27 21.262 38.781 25.967 1.00 0.00 ATOM 175 CB LYS 27 21.871 40.095 25.476 1.00 0.00 ATOM 176 CG LYS 27 21.761 41.280 26.440 1.00 0.00 ATOM 177 CD LYS 27 22.931 41.324 27.386 1.00 0.00 ATOM 178 CE LYS 27 22.727 42.375 28.476 1.00 0.00 ATOM 179 NZ LYS 27 23.527 42.023 29.703 1.00 0.00 ATOM 180 O LYS 27 19.632 38.950 27.709 1.00 0.00 ATOM 181 C LYS 27 19.857 38.996 26.514 1.00 0.00 ATOM 182 N GLU 28 18.905 39.172 25.609 1.00 0.00 ATOM 183 CA GLU 28 17.520 39.471 25.974 1.00 0.00 ATOM 184 CB GLU 28 16.695 39.739 24.709 1.00 0.00 ATOM 185 CG GLU 28 16.802 41.173 24.191 1.00 0.00 ATOM 186 CD GLU 28 15.987 41.404 22.905 1.00 0.00 ATOM 187 OE1 GLU 28 15.931 42.579 22.455 1.00 0.00 ATOM 188 OE2 GLU 28 15.374 40.432 22.354 1.00 0.00 ATOM 189 O GLU 28 16.109 38.632 27.693 1.00 0.00 ATOM 190 C GLU 28 16.906 38.354 26.813 1.00 0.00 ATOM 191 N GLN 29 17.322 37.107 26.553 1.00 0.00 ATOM 192 CA GLN 29 16.871 35.927 27.291 1.00 0.00 ATOM 193 CB GLN 29 17.010 34.674 26.440 1.00 0.00 ATOM 194 CG GLN 29 15.942 34.576 25.344 1.00 0.00 ATOM 195 CD GLN 29 16.117 33.332 24.481 1.00 0.00 ATOM 196 OE1 GLN 29 16.718 33.379 23.380 1.00 0.00 ATOM 197 NE2 GLN 29 15.613 32.196 24.979 1.00 0.00 ATOM 198 O GLN 29 17.387 34.732 29.305 1.00 0.00 ATOM 199 C GLN 29 17.601 35.730 28.612 1.00 0.00 ATOM 200 N GLY 30 18.463 36.678 28.968 1.00 0.00 ATOM 201 CA GLY 30 19.073 36.670 30.272 1.00 0.00 ATOM 202 O GLY 30 20.804 35.601 31.492 1.00 0.00 ATOM 203 C GLY 30 20.321 35.823 30.391 1.00 0.00 ATOM 204 N TYR 31 20.870 35.347 29.286 1.00 0.00 ATOM 205 CA TYR 31 22.114 34.582 29.383 1.00 0.00 ATOM 206 CB TYR 31 22.362 33.816 28.110 1.00 0.00 ATOM 207 CG TYR 31 21.410 32.690 27.897 1.00 0.00 ATOM 208 CD1 TYR 31 21.620 31.477 28.526 1.00 0.00 ATOM 209 CD2 TYR 31 20.312 32.822 27.041 1.00 0.00 ATOM 210 CE1 TYR 31 20.761 30.421 28.337 1.00 0.00 ATOM 211 CE2 TYR 31 19.456 31.769 26.832 1.00 0.00 ATOM 212 CZ TYR 31 19.684 30.569 27.501 1.00 0.00 ATOM 213 OH TYR 31 18.864 29.490 27.341 1.00 0.00 ATOM 214 O TYR 31 23.320 36.675 29.551 1.00 0.00 ATOM 215 C TYR 31 23.337 35.453 29.722 1.00 0.00 ATOM 216 N ASP 32 24.366 34.810 30.258 1.00 0.00 ATOM 217 CA ASP 32 25.657 35.421 30.496 1.00 0.00 ATOM 218 CB ASP 32 26.344 34.614 31.596 1.00 0.00 ATOM 219 CG ASP 32 27.724 35.129 31.971 1.00 0.00 ATOM 220 OD1 ASP 32 28.193 36.172 31.466 1.00 0.00 ATOM 221 OD2 ASP 32 28.359 34.449 32.804 1.00 0.00 ATOM 222 O ASP 32 27.025 34.282 28.862 1.00 0.00 ATOM 223 C ASP 32 26.419 35.317 29.161 1.00 0.00 ATOM 224 N VAL 33 26.375 36.390 28.368 1.00 0.00 ATOM 225 CA VAL 33 26.815 36.356 26.971 1.00 0.00 ATOM 226 CB VAL 33 25.754 36.996 26.044 1.00 0.00 ATOM 227 CG1 VAL 33 26.118 36.788 24.541 1.00 0.00 ATOM 228 CG2 VAL 33 24.379 36.417 26.353 1.00 0.00 ATOM 229 O VAL 33 28.430 38.106 27.225 1.00 0.00 ATOM 230 C VAL 33 28.165 37.011 26.739 1.00 0.00 ATOM 231 N ILE 34 29.044 36.312 26.030 1.00 0.00 ATOM 232 CA ILE 34 30.347 36.882 25.634 1.00 0.00 ATOM 233 CB ILE 34 31.521 36.161 26.316 1.00 0.00 ATOM 234 CG1 ILE 34 31.426 36.279 27.837 1.00 0.00 ATOM 235 CG2 ILE 34 32.919 36.689 25.817 1.00 0.00 ATOM 236 CD1 ILE 34 32.457 35.377 28.543 1.00 0.00 ATOM 237 O ILE 34 30.317 35.669 23.584 1.00 0.00 ATOM 238 C ILE 34 30.464 36.764 24.128 1.00 0.00 ATOM 239 N GLY 35 30.695 37.890 23.448 1.00 0.00 ATOM 240 CA GLY 35 30.891 37.870 21.974 1.00 0.00 ATOM 241 O GLY 35 33.222 38.336 22.213 1.00 0.00 ATOM 242 C GLY 35 32.345 37.688 21.618 1.00 0.00 ATOM 243 N ILE 36 32.631 36.778 20.691 1.00 0.00 ATOM 244 CA ILE 36 34.021 36.549 20.251 1.00 0.00 ATOM 245 CB ILE 36 34.611 35.198 20.736 1.00 0.00 ATOM 246 CG1 ILE 36 34.428 34.996 22.231 1.00 0.00 ATOM 247 CG2 ILE 36 36.129 35.106 20.413 1.00 0.00 ATOM 248 CD1 ILE 36 35.434 35.673 23.054 1.00 0.00 ATOM 249 O ILE 36 33.368 35.904 18.018 1.00 0.00 ATOM 250 C ILE 36 34.132 36.587 18.739 1.00 0.00 ATOM 251 N PHE 37 35.094 37.386 18.274 1.00 0.00 ATOM 252 CA PHE 37 35.414 37.514 16.865 1.00 0.00 ATOM 253 CB PHE 37 35.662 38.991 16.536 1.00 0.00 ATOM 254 CG PHE 37 36.084 39.242 15.097 1.00 0.00 ATOM 255 CD1 PHE 37 35.149 39.263 14.078 1.00 0.00 ATOM 256 CD2 PHE 37 37.420 39.457 14.776 1.00 0.00 ATOM 257 CE1 PHE 37 35.532 39.470 12.781 1.00 0.00 ATOM 258 CE2 PHE 37 37.820 39.682 13.461 1.00 0.00 ATOM 259 CZ PHE 37 36.875 39.684 12.465 1.00 0.00 ATOM 260 O PHE 37 37.687 36.817 17.120 1.00 0.00 ATOM 261 C PHE 37 36.638 36.664 16.514 1.00 0.00 ATOM 262 N MET 38 36.523 35.776 15.528 1.00 0.00 ATOM 263 CA MET 38 37.719 35.059 15.061 1.00 0.00 ATOM 264 CB MET 38 37.410 33.619 14.689 1.00 0.00 ATOM 265 CG MET 38 37.045 32.743 15.848 1.00 0.00 ATOM 266 SD MET 38 36.370 31.080 15.151 1.00 0.00 ATOM 267 CE MET 38 34.481 31.467 14.933 1.00 0.00 ATOM 268 O MET 38 37.690 36.035 12.897 1.00 0.00 ATOM 269 C MET 38 38.361 35.730 13.866 1.00 0.00 ATOM 270 N LYS 39 39.661 35.956 13.934 1.00 0.00 ATOM 271 CA LYS 39 40.412 36.260 12.746 1.00 0.00 ATOM 272 CB LYS 39 41.381 37.415 12.954 1.00 0.00 ATOM 273 CG LYS 39 41.820 38.004 11.626 1.00 0.00 ATOM 274 CD LYS 39 43.009 38.935 11.732 1.00 0.00 ATOM 275 CE LYS 39 43.464 39.308 10.322 1.00 0.00 ATOM 276 NZ LYS 39 44.149 40.634 10.282 1.00 0.00 ATOM 277 O LYS 39 42.080 34.556 12.968 1.00 0.00 ATOM 278 C LYS 39 41.145 35.009 12.312 1.00 0.00 ATOM 279 N ASN 40 40.704 34.455 11.188 1.00 0.00 ATOM 280 CA ASN 40 41.237 33.185 10.683 1.00 0.00 ATOM 281 CB ASN 40 40.113 32.148 10.591 1.00 0.00 ATOM 282 CG ASN 40 39.459 31.894 11.936 1.00 0.00 ATOM 283 ND2 ASN 40 38.238 31.411 11.912 1.00 0.00 ATOM 284 OD1 ASN 40 40.052 32.147 12.985 1.00 0.00 ATOM 285 O ASN 40 42.528 32.323 8.891 1.00 0.00 ATOM 286 C ASN 40 41.959 33.294 9.361 1.00 0.00 ATOM 287 N TRP 41 41.942 34.482 8.773 1.00 0.00 ATOM 288 CA TRP 41 42.579 34.714 7.491 1.00 0.00 ATOM 289 CB TRP 41 41.549 34.557 6.355 1.00 0.00 ATOM 290 CG TRP 41 42.203 34.589 5.022 1.00 0.00 ATOM 291 CD1 TRP 41 42.291 35.653 4.182 1.00 0.00 ATOM 292 CD2 TRP 41 42.917 33.519 4.394 1.00 0.00 ATOM 293 CE2 TRP 41 43.397 34.010 3.160 1.00 0.00 ATOM 294 CE3 TRP 41 43.171 32.184 4.739 1.00 0.00 ATOM 295 NE1 TRP 41 43.002 35.317 3.060 1.00 0.00 ATOM 296 CZ2 TRP 41 44.134 33.219 2.273 1.00 0.00 ATOM 297 CZ3 TRP 41 43.911 31.393 3.859 1.00 0.00 ATOM 298 CH2 TRP 41 44.387 31.917 2.642 1.00 0.00 ATOM 299 O TRP 41 42.626 37.083 7.792 1.00 0.00 ATOM 300 C TRP 41 43.247 36.088 7.453 1.00 0.00 ATOM 301 N ASP 42 44.507 36.137 7.047 1.00 0.00 ATOM 302 CA ASP 42 45.226 37.410 6.909 1.00 0.00 ATOM 303 CB ASP 42 46.675 37.279 7.382 1.00 0.00 ATOM 304 CG ASP 42 47.377 38.635 7.515 1.00 0.00 ATOM 305 OD1 ASP 42 46.708 39.623 7.934 1.00 0.00 ATOM 306 OD2 ASP 42 48.599 38.698 7.202 1.00 0.00 ATOM 307 O ASP 42 45.878 37.465 4.571 1.00 0.00 ATOM 308 C ASP 42 45.180 37.959 5.473 1.00 0.00 ATOM 309 N ASP 43 44.377 39.013 5.303 1.00 0.00 ATOM 310 CA ASP 43 43.952 39.514 3.994 1.00 0.00 ATOM 311 CB ASP 43 42.440 39.275 3.866 1.00 0.00 ATOM 312 CG ASP 43 42.019 38.879 2.458 1.00 0.00 ATOM 313 OD1 ASP 43 40.820 39.063 2.130 1.00 0.00 ATOM 314 OD2 ASP 43 42.874 38.375 1.687 1.00 0.00 ATOM 315 O ASP 43 43.311 41.796 3.522 1.00 0.00 ATOM 316 C ASP 43 44.237 41.016 3.796 1.00 0.00 ATOM 317 N THR 44 45.499 41.422 3.926 1.00 0.00 ATOM 318 CA THR 44 45.841 42.854 3.966 1.00 0.00 ATOM 319 CB THR 44 47.004 43.140 4.999 1.00 0.00 ATOM 320 CG2 THR 44 47.576 44.574 4.886 1.00 0.00 ATOM 321 OG1 THR 44 46.512 42.948 6.334 1.00 0.00 ATOM 322 O THR 44 46.595 42.768 1.662 1.00 0.00 ATOM 323 C THR 44 46.109 43.458 2.569 1.00 0.00 ATOM 324 N ASP 45 45.761 44.743 2.417 1.00 0.00 ATOM 325 CA ASP 45 46.017 45.538 1.199 1.00 0.00 ATOM 326 CB ASP 45 45.304 46.900 1.292 1.00 0.00 ATOM 327 CG ASP 45 43.847 46.849 0.825 1.00 0.00 ATOM 328 OD1 ASP 45 43.224 45.759 0.820 1.00 0.00 ATOM 329 OD2 ASP 45 43.321 47.925 0.466 1.00 0.00 ATOM 330 O ASP 45 47.909 46.731 0.289 1.00 0.00 ATOM 331 C ASP 45 47.511 45.757 0.938 1.00 0.00 ATOM 332 N CYS 50 42.600 43.401 7.678 1.00 0.00 ATOM 333 CA CYS 50 42.087 44.540 6.920 1.00 0.00 ATOM 334 CB CYS 50 42.823 44.684 5.592 1.00 0.00 ATOM 335 SG CYS 50 42.433 46.233 4.719 1.00 0.00 ATOM 336 O CYS 50 39.822 45.346 6.953 1.00 0.00 ATOM 337 C CYS 50 40.588 44.419 6.663 1.00 0.00 ATOM 338 N THR 51 40.176 43.283 6.100 1.00 0.00 ATOM 339 CA THR 51 38.762 42.907 6.061 1.00 0.00 ATOM 340 CB THR 51 38.555 41.609 5.260 1.00 0.00 ATOM 341 CG2 THR 51 37.051 41.366 4.947 1.00 0.00 ATOM 342 OG1 THR 51 39.327 41.664 4.051 1.00 0.00 ATOM 343 O THR 51 37.217 43.145 7.904 1.00 0.00 ATOM 344 C THR 51 38.292 42.678 7.499 1.00 0.00 ATOM 345 N ALA 52 39.126 41.967 8.259 1.00 0.00 ATOM 346 CA ALA 52 38.872 41.644 9.656 1.00 0.00 ATOM 347 CB ALA 52 39.952 40.715 10.186 1.00 0.00 ATOM 348 O ALA 52 38.007 42.894 11.504 1.00 0.00 ATOM 349 C ALA 52 38.755 42.888 10.528 1.00 0.00 ATOM 350 N THR 53 39.486 43.935 10.160 1.00 0.00 ATOM 351 CA THR 53 39.478 45.199 10.885 1.00 0.00 ATOM 352 CB THR 53 40.606 46.171 10.368 1.00 0.00 ATOM 353 CG2 THR 53 40.787 47.395 11.289 1.00 0.00 ATOM 354 OG1 THR 53 41.847 45.459 10.307 1.00 0.00 ATOM 355 O THR 53 37.572 46.194 11.944 1.00 0.00 ATOM 356 C THR 53 38.088 45.852 10.880 1.00 0.00 ATOM 357 N GLU 54 37.467 46.018 9.718 1.00 0.00 ATOM 358 CA GLU 54 36.159 46.688 9.681 1.00 0.00 ATOM 359 CB GLU 54 35.836 47.241 8.282 1.00 0.00 ATOM 360 CG GLU 54 36.099 48.768 8.091 1.00 0.00 ATOM 361 CD GLU 54 37.511 49.247 8.511 1.00 0.00 ATOM 362 OE1 GLU 54 38.529 48.730 7.974 1.00 0.00 ATOM 363 OE2 GLU 54 37.594 50.167 9.369 1.00 0.00 ATOM 364 O GLU 54 34.066 46.373 10.808 1.00 0.00 ATOM 365 C GLU 54 35.017 45.830 10.251 1.00 0.00 ATOM 366 N ASP 55 35.129 44.502 10.134 1.00 0.00 ATOM 367 CA ASP 55 34.165 43.582 10.751 1.00 0.00 ATOM 368 CB ASP 55 34.397 42.157 10.259 1.00 0.00 ATOM 369 CG ASP 55 33.946 41.934 8.817 1.00 0.00 ATOM 370 OD1 ASP 55 33.277 42.811 8.216 1.00 0.00 ATOM 371 OD2 ASP 55 34.262 40.849 8.273 1.00 0.00 ATOM 372 O ASP 55 33.232 43.556 12.962 1.00 0.00 ATOM 373 C ASP 55 34.261 43.594 12.268 1.00 0.00 ATOM 374 N TYR 56 35.488 43.658 12.788 1.00 0.00 ATOM 375 CA TYR 56 35.679 43.776 14.227 1.00 0.00 ATOM 376 CB TYR 56 37.147 43.590 14.629 1.00 0.00 ATOM 377 CG TYR 56 37.375 43.399 16.125 1.00 0.00 ATOM 378 CD1 TYR 56 36.761 42.347 16.817 1.00 0.00 ATOM 379 CD2 TYR 56 38.203 44.271 16.850 1.00 0.00 ATOM 380 CE1 TYR 56 36.942 42.164 18.195 1.00 0.00 ATOM 381 CE2 TYR 56 38.413 44.093 18.231 1.00 0.00 ATOM 382 CZ TYR 56 37.780 43.024 18.897 1.00 0.00 ATOM 383 OH TYR 56 37.964 42.819 20.265 1.00 0.00 ATOM 384 O TYR 56 34.629 45.089 15.919 1.00 0.00 ATOM 385 C TYR 56 35.074 45.069 14.777 1.00 0.00 ATOM 386 N LYS 57 35.054 46.128 13.965 1.00 0.00 ATOM 387 CA LYS 57 34.407 47.401 14.318 1.00 0.00 ATOM 388 CB LYS 57 34.625 48.453 13.215 1.00 0.00 ATOM 389 CG LYS 57 35.722 49.505 13.497 1.00 0.00 ATOM 390 CD LYS 57 37.141 48.908 13.583 1.00 0.00 ATOM 391 CE LYS 57 38.129 49.814 14.362 1.00 0.00 ATOM 392 NZ LYS 57 39.241 50.353 13.521 1.00 0.00 ATOM 393 O LYS 57 32.329 47.724 15.468 1.00 0.00 ATOM 394 C LYS 57 32.919 47.192 14.533 1.00 0.00 ATOM 395 N ASP 58 32.325 46.387 13.668 1.00 0.00 ATOM 396 CA ASP 58 30.914 46.079 13.738 1.00 0.00 ATOM 397 CB ASP 58 30.495 45.418 12.442 1.00 0.00 ATOM 398 CG ASP 58 30.469 46.391 11.293 1.00 0.00 ATOM 399 OD1 ASP 58 30.217 47.594 11.521 1.00 0.00 ATOM 400 OD2 ASP 58 30.693 45.957 10.156 1.00 0.00 ATOM 401 O ASP 58 29.596 45.426 15.613 1.00 0.00 ATOM 402 C ASP 58 30.590 45.195 14.929 1.00 0.00 ATOM 403 N VAL 59 31.445 44.206 15.188 1.00 0.00 ATOM 404 CA VAL 59 31.331 43.398 16.391 1.00 0.00 ATOM 405 CB VAL 59 32.481 42.358 16.509 1.00 0.00 ATOM 406 CG1 VAL 59 32.435 41.631 17.870 1.00 0.00 ATOM 407 CG2 VAL 59 32.413 41.386 15.362 1.00 0.00 ATOM 408 O VAL 59 30.389 44.304 18.359 1.00 0.00 ATOM 409 C VAL 59 31.317 44.339 17.576 1.00 0.00 ATOM 410 N VAL 60 32.309 45.220 17.677 1.00 0.00 ATOM 411 CA VAL 60 32.435 46.164 18.817 1.00 0.00 ATOM 412 CB VAL 60 33.769 47.030 18.733 1.00 0.00 ATOM 413 CG1 VAL 60 33.823 48.110 19.796 1.00 0.00 ATOM 414 CG2 VAL 60 35.022 46.148 18.809 1.00 0.00 ATOM 415 O VAL 60 30.629 47.212 20.003 1.00 0.00 ATOM 416 C VAL 60 31.200 47.082 18.935 1.00 0.00 ATOM 417 N ALA 61 30.804 47.725 17.843 1.00 0.00 ATOM 418 CA ALA 61 29.637 48.596 17.842 1.00 0.00 ATOM 419 CB ALA 61 29.396 49.158 16.453 1.00 0.00 ATOM 420 O ALA 61 27.658 48.365 19.157 1.00 0.00 ATOM 421 C ALA 61 28.401 47.846 18.339 1.00 0.00 ATOM 422 N VAL 62 28.220 46.603 17.904 1.00 0.00 ATOM 423 CA VAL 62 27.036 45.835 18.308 1.00 0.00 ATOM 424 CB VAL 62 26.697 44.679 17.309 1.00 0.00 ATOM 425 CG1 VAL 62 25.682 43.701 17.907 1.00 0.00 ATOM 426 CG2 VAL 62 26.158 45.281 16.022 1.00 0.00 ATOM 427 O VAL 62 26.159 45.540 20.515 1.00 0.00 ATOM 428 C VAL 62 27.111 45.369 19.756 1.00 0.00 ATOM 429 N ALA 63 28.254 44.826 20.145 1.00 0.00 ATOM 430 CA ALA 63 28.477 44.373 21.493 1.00 0.00 ATOM 431 CB ALA 63 29.862 43.825 21.596 1.00 0.00 ATOM 432 O ALA 63 27.697 45.325 23.564 1.00 0.00 ATOM 433 C ALA 63 28.260 45.525 22.472 1.00 0.00 ATOM 434 N ASP 64 28.682 46.733 22.092 1.00 0.00 ATOM 435 CA ASP 64 28.426 47.899 22.927 1.00 0.00 ATOM 436 CB ASP 64 29.316 49.075 22.525 1.00 0.00 ATOM 437 CG ASP 64 30.761 48.941 23.035 1.00 0.00 ATOM 438 OD1 ASP 64 31.029 48.144 23.972 1.00 0.00 ATOM 439 OD2 ASP 64 31.636 49.666 22.492 1.00 0.00 ATOM 440 O ASP 64 26.472 48.751 23.981 1.00 0.00 ATOM 441 C ASP 64 26.951 48.331 22.948 1.00 0.00 ATOM 442 N GLN 65 26.271 48.208 21.805 1.00 0.00 ATOM 443 CA GLN 65 24.855 48.573 21.644 1.00 0.00 ATOM 444 CB GLN 65 24.409 48.450 20.164 1.00 0.00 ATOM 445 CG GLN 65 24.985 49.552 19.247 1.00 0.00 ATOM 446 CD GLN 65 24.586 49.465 17.759 1.00 0.00 ATOM 447 OE1 GLN 65 24.722 48.423 17.099 1.00 0.00 ATOM 448 NE2 GLN 65 24.139 50.602 17.218 1.00 0.00 ATOM 449 O GLN 65 23.037 48.215 23.171 1.00 0.00 ATOM 450 C GLN 65 23.970 47.715 22.550 1.00 0.00 ATOM 451 N ILE 66 24.287 46.426 22.636 1.00 0.00 ATOM 452 CA ILE 66 23.550 45.510 23.493 1.00 0.00 ATOM 453 CB ILE 66 23.249 44.183 22.784 1.00 0.00 ATOM 454 CG1 ILE 66 24.401 43.210 22.914 1.00 0.00 ATOM 455 CG2 ILE 66 22.931 44.444 21.317 1.00 0.00 ATOM 456 CD1 ILE 66 24.347 42.089 21.937 1.00 0.00 ATOM 457 O ILE 66 23.544 44.748 25.771 1.00 0.00 ATOM 458 C ILE 66 24.169 45.325 24.882 1.00 0.00 ATOM 459 N GLY 67 25.375 45.841 25.083 1.00 0.00 ATOM 460 CA GLY 67 25.998 45.766 26.395 1.00 0.00 ATOM 461 O GLY 67 26.090 43.848 27.825 1.00 0.00 ATOM 462 C GLY 67 26.457 44.367 26.773 1.00 0.00 ATOM 463 N ILE 68 27.250 43.749 25.907 1.00 0.00 ATOM 464 CA ILE 68 27.966 42.520 26.264 1.00 0.00 ATOM 465 CB ILE 68 27.474 41.271 25.458 1.00 0.00 ATOM 466 CG1 ILE 68 27.601 41.479 23.934 1.00 0.00 ATOM 467 CG2 ILE 68 26.055 40.886 25.864 1.00 0.00 ATOM 468 CD1 ILE 68 27.732 40.191 23.153 1.00 0.00 ATOM 469 O ILE 68 29.973 43.550 25.393 1.00 0.00 ATOM 470 C ILE 68 29.493 42.685 26.134 1.00 0.00 ATOM 471 N PRO 69 30.266 41.884 26.892 1.00 0.00 ATOM 472 CA PRO 69 31.704 41.890 26.572 1.00 0.00 ATOM 473 CB PRO 69 32.351 41.113 27.722 1.00 0.00 ATOM 474 CG PRO 69 31.265 40.378 28.390 1.00 0.00 ATOM 475 CD PRO 69 29.932 41.017 28.039 1.00 0.00 ATOM 476 O PRO 69 31.242 40.418 24.705 1.00 0.00 ATOM 477 C PRO 69 32.009 41.252 25.212 1.00 0.00 ATOM 478 N TYR 70 33.104 41.697 24.603 1.00 0.00 ATOM 479 CA TYR 70 33.572 41.161 23.338 1.00 0.00 ATOM 480 CB TYR 70 33.223 42.134 22.200 1.00 0.00 ATOM 481 CG TYR 70 33.878 43.479 22.354 1.00 0.00 ATOM 482 CD1 TYR 70 35.174 43.695 21.882 1.00 0.00 ATOM 483 CD2 TYR 70 33.236 44.524 23.008 1.00 0.00 ATOM 484 CE1 TYR 70 35.806 44.904 22.046 1.00 0.00 ATOM 485 CE2 TYR 70 33.875 45.773 23.184 1.00 0.00 ATOM 486 CZ TYR 70 35.156 45.943 22.678 1.00 0.00 ATOM 487 OH TYR 70 35.831 47.139 22.820 1.00 0.00 ATOM 488 O TYR 70 35.833 41.677 24.066 1.00 0.00 ATOM 489 C TYR 70 35.103 40.930 23.413 1.00 0.00 ATOM 490 N TYR 71 35.571 39.874 22.761 1.00 0.00 ATOM 491 CA TYR 71 36.996 39.620 22.627 1.00 0.00 ATOM 492 CB TYR 71 37.496 38.588 23.656 1.00 0.00 ATOM 493 CG TYR 71 37.182 39.008 25.069 1.00 0.00 ATOM 494 CD1 TYR 71 38.011 39.922 25.757 1.00 0.00 ATOM 495 CD2 TYR 71 36.041 38.532 25.711 1.00 0.00 ATOM 496 CE1 TYR 71 37.707 40.341 27.037 1.00 0.00 ATOM 497 CE2 TYR 71 35.716 38.948 27.002 1.00 0.00 ATOM 498 CZ TYR 71 36.545 39.844 27.659 1.00 0.00 ATOM 499 OH TYR 71 36.215 40.235 28.938 1.00 0.00 ATOM 500 O TYR 71 36.346 38.972 20.425 1.00 0.00 ATOM 501 C TYR 71 37.265 39.161 21.216 1.00 0.00 ATOM 502 N SER 72 38.536 38.936 20.934 1.00 0.00 ATOM 503 CA SER 72 39.028 38.724 19.593 1.00 0.00 ATOM 504 CB SER 72 39.723 40.015 19.163 1.00 0.00 ATOM 505 OG SER 72 40.053 39.976 17.813 1.00 0.00 ATOM 506 O SER 72 41.053 37.793 20.452 1.00 0.00 ATOM 507 C SER 72 40.078 37.639 19.697 1.00 0.00 ATOM 508 N VAL 73 39.897 36.544 18.975 1.00 0.00 ATOM 509 CA VAL 73 40.911 35.496 18.955 1.00 0.00 ATOM 510 CB VAL 73 40.420 34.224 19.708 1.00 0.00 ATOM 511 CG1 VAL 73 39.294 33.517 18.947 1.00 0.00 ATOM 512 CG2 VAL 73 41.599 33.268 19.994 1.00 0.00 ATOM 513 O VAL 73 40.639 35.311 16.563 1.00 0.00 ATOM 514 C VAL 73 41.392 35.179 17.511 1.00 0.00 ATOM 515 N ASN 74 42.637 34.763 17.368 1.00 0.00 ATOM 516 CA ASN 74 43.233 34.486 16.076 1.00 0.00 ATOM 517 CB ASN 74 44.541 35.270 15.962 1.00 0.00 ATOM 518 CG ASN 74 45.079 35.295 14.566 1.00 0.00 ATOM 519 ND2 ASN 74 45.168 36.488 13.994 1.00 0.00 ATOM 520 OD1 ASN 74 45.410 34.256 13.997 1.00 0.00 ATOM 521 O ASN 74 44.311 32.418 16.597 1.00 0.00 ATOM 522 C ASN 74 43.523 32.992 15.872 1.00 0.00 ATOM 523 N PHE 75 42.880 32.379 14.885 1.00 0.00 ATOM 524 CA PHE 75 43.066 30.967 14.558 1.00 0.00 ATOM 525 CB PHE 75 41.733 30.192 14.699 1.00 0.00 ATOM 526 CG PHE 75 41.227 30.072 16.111 1.00 0.00 ATOM 527 CD1 PHE 75 42.080 29.713 17.152 1.00 0.00 ATOM 528 CD2 PHE 75 39.881 30.274 16.397 1.00 0.00 ATOM 529 CE1 PHE 75 41.603 29.596 18.461 1.00 0.00 ATOM 530 CE2 PHE 75 39.396 30.152 17.705 1.00 0.00 ATOM 531 CZ PHE 75 40.247 29.827 18.728 1.00 0.00 ATOM 532 O PHE 75 43.268 29.810 12.453 1.00 0.00 ATOM 533 C PHE 75 43.578 30.806 13.120 1.00 0.00 ATOM 534 N GLU 76 44.331 31.797 12.637 1.00 0.00 ATOM 535 CA GLU 76 44.935 31.742 11.299 1.00 0.00 ATOM 536 CB GLU 76 45.899 32.903 11.055 1.00 0.00 ATOM 537 CG GLU 76 45.206 34.201 10.709 1.00 0.00 ATOM 538 CD GLU 76 46.154 35.378 10.703 1.00 0.00 ATOM 539 OE1 GLU 76 45.697 36.495 11.016 1.00 0.00 ATOM 540 OE2 GLU 76 47.356 35.202 10.397 1.00 0.00 ATOM 541 O GLU 76 45.530 29.835 10.047 1.00 0.00 ATOM 542 C GLU 76 45.676 30.452 11.088 1.00 0.00 ATOM 543 N LYS 77 46.465 30.039 12.078 1.00 0.00 ATOM 544 CA LYS 77 47.254 28.818 11.930 1.00 0.00 ATOM 545 CB LYS 77 48.177 28.603 13.124 1.00 0.00 ATOM 546 CG LYS 77 49.254 27.566 12.884 1.00 0.00 ATOM 547 CD LYS 77 49.672 26.916 14.200 1.00 0.00 ATOM 548 CE LYS 77 51.098 26.354 14.153 1.00 0.00 ATOM 549 NZ LYS 77 51.297 25.427 13.006 1.00 0.00 ATOM 550 O LYS 77 46.512 26.859 10.759 1.00 0.00 ATOM 551 C LYS 77 46.349 27.601 11.726 1.00 0.00 ATOM 552 N GLU 78 45.401 27.423 12.640 1.00 0.00 ATOM 553 CA GLU 78 44.527 26.272 12.676 1.00 0.00 ATOM 554 CB GLU 78 43.612 26.363 13.896 1.00 0.00 ATOM 555 CG GLU 78 44.305 26.126 15.240 1.00 0.00 ATOM 556 CD GLU 78 44.868 27.395 15.891 1.00 0.00 ATOM 557 OE1 GLU 78 45.092 28.433 15.209 1.00 0.00 ATOM 558 OE2 GLU 78 45.109 27.337 17.120 1.00 0.00 ATOM 559 O GLU 78 43.473 25.156 10.840 1.00 0.00 ATOM 560 C GLU 78 43.685 26.226 11.420 1.00 0.00 ATOM 561 N TYR 79 43.193 27.396 11.013 1.00 0.00 ATOM 562 CA TYR 79 42.380 27.507 9.833 1.00 0.00 ATOM 563 CB TYR 79 41.814 28.912 9.682 1.00 0.00 ATOM 564 CG TYR 79 40.911 28.987 8.496 1.00 0.00 ATOM 565 CD1 TYR 79 39.527 28.829 8.641 1.00 0.00 ATOM 566 CD2 TYR 79 41.432 29.176 7.210 1.00 0.00 ATOM 567 CE1 TYR 79 38.696 28.869 7.543 1.00 0.00 ATOM 568 CE2 TYR 79 40.606 29.213 6.096 1.00 0.00 ATOM 569 CZ TYR 79 39.246 29.055 6.273 1.00 0.00 ATOM 570 OH TYR 79 38.420 29.090 5.176 1.00 0.00 ATOM 571 O TYR 79 42.721 26.376 7.732 1.00 0.00 ATOM 572 C TYR 79 43.194 27.130 8.597 1.00 0.00 ATOM 573 N TRP 80 44.402 27.681 8.503 1.00 0.00 ATOM 574 CA TRP 80 45.290 27.345 7.412 1.00 0.00 ATOM 575 CB TRP 80 46.645 28.044 7.544 1.00 0.00 ATOM 576 CG TRP 80 47.522 27.691 6.401 1.00 0.00 ATOM 577 CD1 TRP 80 48.310 26.576 6.279 1.00 0.00 ATOM 578 CD2 TRP 80 47.662 28.422 5.180 1.00 0.00 ATOM 579 CE2 TRP 80 48.560 27.698 4.364 1.00 0.00 ATOM 580 CE3 TRP 80 47.119 29.623 4.696 1.00 0.00 ATOM 581 NE1 TRP 80 48.928 26.575 5.058 1.00 0.00 ATOM 582 CZ2 TRP 80 48.935 28.137 3.088 1.00 0.00 ATOM 583 CZ3 TRP 80 47.485 30.059 3.431 1.00 0.00 ATOM 584 CH2 TRP 80 48.391 29.317 2.641 1.00 0.00 ATOM 585 O TRP 80 45.316 25.225 6.313 1.00 0.00 ATOM 586 C TRP 80 45.501 25.839 7.363 1.00 0.00 ATOM 587 N ASP 81 45.885 25.263 8.504 1.00 0.00 ATOM 588 CA ASP 81 46.256 23.858 8.613 1.00 0.00 ATOM 589 CB ASP 81 46.904 23.595 9.969 1.00 0.00 ATOM 590 CG ASP 81 48.346 24.079 10.040 1.00 0.00 ATOM 591 OD1 ASP 81 48.939 24.421 8.984 1.00 0.00 ATOM 592 OD2 ASP 81 48.893 24.085 11.163 1.00 0.00 ATOM 593 O ASP 81 45.296 21.792 7.882 1.00 0.00 ATOM 594 C ASP 81 45.105 22.875 8.428 1.00 0.00 ATOM 595 N ARG 82 43.919 23.239 8.890 1.00 0.00 ATOM 596 CA ARG 82 42.817 22.291 8.951 1.00 0.00 ATOM 597 CB ARG 82 42.201 22.290 10.352 1.00 0.00 ATOM 598 CG ARG 82 43.037 21.603 11.424 1.00 0.00 ATOM 599 CD ARG 82 42.216 21.480 12.693 1.00 0.00 ATOM 600 NE ARG 82 42.975 21.946 13.865 1.00 0.00 ATOM 601 CZ ARG 82 42.439 22.511 14.949 1.00 0.00 ATOM 602 NH1 ARG 82 41.126 22.682 15.056 1.00 0.00 ATOM 603 NH2 ARG 82 43.231 22.910 15.936 1.00 0.00 ATOM 604 O ARG 82 40.912 21.686 7.615 1.00 0.00 ATOM 605 C ARG 82 41.741 22.564 7.906 1.00 0.00 ATOM 606 N VAL 83 41.745 23.774 7.345 1.00 0.00 ATOM 607 CA VAL 83 40.756 24.134 6.336 1.00 0.00 ATOM 608 CB VAL 83 39.771 25.277 6.813 1.00 0.00 ATOM 609 CG1 VAL 83 38.652 25.480 5.807 1.00 0.00 ATOM 610 CG2 VAL 83 39.178 24.919 8.130 1.00 0.00 ATOM 611 O VAL 83 41.080 23.849 3.990 1.00 0.00 ATOM 612 C VAL 83 41.418 24.451 4.998 1.00 0.00 ATOM 613 N PHE 84 42.370 25.379 4.997 1.00 0.00 ATOM 614 CA PHE 84 42.955 25.834 3.746 1.00 0.00 ATOM 615 CB PHE 84 43.692 27.166 3.870 1.00 0.00 ATOM 616 CG PHE 84 43.890 27.841 2.544 1.00 0.00 ATOM 617 CD1 PHE 84 42.804 28.377 1.856 1.00 0.00 ATOM 618 CD2 PHE 84 45.145 27.893 1.952 1.00 0.00 ATOM 619 CE1 PHE 84 42.975 28.987 0.618 1.00 0.00 ATOM 620 CE2 PHE 84 45.317 28.514 0.734 1.00 0.00 ATOM 621 CZ PHE 84 44.227 29.056 0.069 1.00 0.00 ATOM 622 O PHE 84 43.784 24.697 1.822 1.00 0.00 ATOM 623 C PHE 84 43.829 24.800 3.048 1.00 0.00 ATOM 624 N GLU 85 44.623 24.055 3.812 1.00 0.00 ATOM 625 CA GLU 85 45.335 22.923 3.243 1.00 0.00 ATOM 626 CB GLU 85 46.329 22.322 4.220 1.00 0.00 ATOM 627 CG GLU 85 47.427 23.284 4.652 1.00 0.00 ATOM 628 CD GLU 85 48.564 23.462 3.651 1.00 0.00 ATOM 629 OE1 GLU 85 48.393 23.244 2.427 1.00 0.00 ATOM 630 OE2 GLU 85 49.662 23.843 4.105 1.00 0.00 ATOM 631 O GLU 85 44.612 21.316 1.651 1.00 0.00 ATOM 632 C GLU 85 44.372 21.864 2.720 1.00 0.00 ATOM 633 N TYR 86 43.266 21.606 3.427 1.00 0.00 ATOM 634 CA TYR 86 42.258 20.690 2.907 1.00 0.00 ATOM 635 CB TYR 86 41.134 20.418 3.952 1.00 0.00 ATOM 636 CG TYR 86 39.758 20.204 3.319 1.00 0.00 ATOM 637 CD1 TYR 86 39.331 18.927 2.928 1.00 0.00 ATOM 638 CD2 TYR 86 38.914 21.293 3.050 1.00 0.00 ATOM 639 CE1 TYR 86 38.098 18.744 2.311 1.00 0.00 ATOM 640 CE2 TYR 86 37.718 21.121 2.419 1.00 0.00 ATOM 641 CZ TYR 86 37.309 19.841 2.060 1.00 0.00 ATOM 642 OH TYR 86 36.084 19.676 1.430 1.00 0.00 ATOM 643 O TYR 86 41.645 20.456 0.556 1.00 0.00 ATOM 644 C TYR 86 41.735 21.204 1.532 1.00 0.00 ATOM 645 N PHE 87 41.420 22.492 1.481 1.00 0.00 ATOM 646 CA PHE 87 40.885 23.185 0.313 1.00 0.00 ATOM 647 CB PHE 87 40.745 24.667 0.690 1.00 0.00 ATOM 648 CG PHE 87 40.233 25.573 -0.407 1.00 0.00 ATOM 649 CD1 PHE 87 38.869 25.658 -0.687 1.00 0.00 ATOM 650 CD2 PHE 87 41.107 26.402 -1.105 1.00 0.00 ATOM 651 CE1 PHE 87 38.391 26.518 -1.676 1.00 0.00 ATOM 652 CE2 PHE 87 40.646 27.271 -2.101 1.00 0.00 ATOM 653 CZ PHE 87 39.283 27.324 -2.386 1.00 0.00 ATOM 654 O PHE 87 41.406 22.505 -1.946 1.00 0.00 ATOM 655 C PHE 87 41.830 22.969 -0.884 1.00 0.00 ATOM 656 N LEU 88 43.115 23.270 -0.688 1.00 0.00 ATOM 657 CA LEU 88 44.132 23.098 -1.715 1.00 0.00 ATOM 658 CB LEU 88 45.463 23.713 -1.277 1.00 0.00 ATOM 659 CG LEU 88 45.526 25.232 -1.071 1.00 0.00 ATOM 660 CD1 LEU 88 46.977 25.661 -0.812 1.00 0.00 ATOM 661 CD2 LEU 88 44.929 26.030 -2.228 1.00 0.00 ATOM 662 O LEU 88 44.435 21.338 -3.300 1.00 0.00 ATOM 663 C LEU 88 44.325 21.645 -2.114 1.00 0.00 ATOM 664 N ALA 89 44.359 20.751 -1.131 1.00 0.00 ATOM 665 CA ALA 89 44.594 19.343 -1.420 1.00 0.00 ATOM 666 CB ALA 89 44.873 18.550 -0.168 1.00 0.00 ATOM 667 O ALA 89 43.649 17.898 -3.070 1.00 0.00 ATOM 668 C ALA 89 43.432 18.759 -2.214 1.00 0.00 ATOM 669 N GLU 90 42.217 19.254 -1.995 1.00 0.00 ATOM 670 CA GLU 90 41.081 18.823 -2.812 1.00 0.00 ATOM 671 CB GLU 90 39.739 19.383 -2.283 1.00 0.00 ATOM 672 CG GLU 90 39.290 18.706 -0.976 1.00 0.00 ATOM 673 CD GLU 90 39.095 17.215 -1.166 1.00 0.00 ATOM 674 OE1 GLU 90 38.011 16.818 -1.623 1.00 0.00 ATOM 675 OE2 GLU 90 40.034 16.438 -0.910 1.00 0.00 ATOM 676 O GLU 90 41.097 18.268 -5.169 1.00 0.00 ATOM 677 C GLU 90 41.270 19.139 -4.298 1.00 0.00 ATOM 678 N TYR 91 41.644 20.383 -4.567 1.00 0.00 ATOM 679 CA TYR 91 41.925 20.815 -5.922 1.00 0.00 ATOM 680 CB TYR 91 42.192 22.316 -5.977 1.00 0.00 ATOM 681 CG TYR 91 40.927 23.141 -5.880 1.00 0.00 ATOM 682 CD1 TYR 91 39.915 23.014 -6.830 1.00 0.00 ATOM 683 CD2 TYR 91 40.737 24.047 -4.837 1.00 0.00 ATOM 684 CE1 TYR 91 38.750 23.763 -6.756 1.00 0.00 ATOM 685 CE2 TYR 91 39.555 24.811 -4.746 1.00 0.00 ATOM 686 CZ TYR 91 38.576 24.667 -5.710 1.00 0.00 ATOM 687 OH TYR 91 37.431 25.421 -5.633 1.00 0.00 ATOM 688 O TYR 91 42.921 19.647 -7.724 1.00 0.00 ATOM 689 C TYR 91 43.041 20.015 -6.563 1.00 0.00 ATOM 690 N ARG 92 44.098 19.713 -5.805 1.00 0.00 ATOM 691 CA ARG 92 45.211 18.936 -6.337 1.00 0.00 ATOM 692 CB ARG 92 46.383 18.857 -5.357 1.00 0.00 ATOM 693 CG ARG 92 47.189 20.130 -5.338 1.00 0.00 ATOM 694 CD ARG 92 48.535 20.013 -4.614 1.00 0.00 ATOM 695 NE ARG 92 48.373 20.183 -3.173 1.00 0.00 ATOM 696 CZ ARG 92 48.638 21.291 -2.483 1.00 0.00 ATOM 697 NH1 ARG 92 49.111 22.389 -3.061 1.00 0.00 ATOM 698 NH2 ARG 92 48.440 21.276 -1.185 1.00 0.00 ATOM 699 O ARG 92 45.283 16.974 -7.678 1.00 0.00 ATOM 700 C ARG 92 44.744 17.553 -6.740 1.00 0.00 ATOM 701 N ALA 93 43.720 17.048 -6.050 1.00 0.00 ATOM 702 CA ALA 93 43.213 15.686 -6.270 1.00 0.00 ATOM 703 CB ALA 93 42.723 15.078 -4.962 1.00 0.00 ATOM 704 O ALA 93 41.616 14.537 -7.629 1.00 0.00 ATOM 705 C ALA 93 42.119 15.622 -7.334 1.00 0.00 ATOM 706 N GLY 94 41.754 16.781 -7.891 1.00 0.00 ATOM 707 CA GLY 94 40.729 16.882 -8.909 1.00 0.00 ATOM 708 O GLY 94 38.339 16.781 -9.078 1.00 0.00 ATOM 709 C GLY 94 39.329 16.960 -8.356 1.00 0.00 ATOM 710 N ARG 95 39.214 17.238 -7.065 1.00 0.00 ATOM 711 CA ARG 95 37.902 17.307 -6.495 1.00 0.00 ATOM 712 CB ARG 95 37.830 16.425 -5.261 1.00 0.00 ATOM 713 CG ARG 95 38.155 14.960 -5.538 1.00 0.00 ATOM 714 CD ARG 95 37.805 14.050 -4.349 1.00 0.00 ATOM 715 NE ARG 95 38.724 14.275 -3.229 1.00 0.00 ATOM 716 CZ ARG 95 39.881 13.630 -3.067 1.00 0.00 ATOM 717 NH1 ARG 95 40.252 12.679 -3.931 1.00 0.00 ATOM 718 NH2 ARG 95 40.665 13.927 -2.034 1.00 0.00 ATOM 719 O ARG 95 38.273 19.680 -6.443 1.00 0.00 ATOM 720 C ARG 95 37.488 18.758 -6.249 1.00 0.00 ATOM 721 N THR 96 36.228 18.953 -5.881 1.00 0.00 ATOM 722 CA THR 96 35.708 20.276 -5.514 1.00 0.00 ATOM 723 CB THR 96 34.470 20.636 -6.320 1.00 0.00 ATOM 724 CG2 THR 96 33.929 22.040 -5.947 1.00 0.00 ATOM 725 OG1 THR 96 34.835 20.667 -7.702 1.00 0.00 ATOM 726 O THR 96 34.498 19.661 -3.522 1.00 0.00 ATOM 727 C THR 96 35.428 20.326 -4.011 1.00 0.00 ATOM 728 N PRO 97 36.237 21.113 -3.272 1.00 0.00 ATOM 729 CA PRO 97 36.100 21.200 -1.819 1.00 0.00 ATOM 730 CB PRO 97 37.366 21.951 -1.387 1.00 0.00 ATOM 731 CG PRO 97 37.697 22.791 -2.539 1.00 0.00 ATOM 732 CD PRO 97 37.303 21.998 -3.775 1.00 0.00 ATOM 733 O PRO 97 34.249 22.762 -2.071 1.00 0.00 ATOM 734 C PRO 97 34.849 21.958 -1.339 1.00 0.00 ATOM 735 N ASN 98 34.475 21.650 -0.098 1.00 0.00 ATOM 736 CA ASN 98 33.525 22.413 0.699 1.00 0.00 ATOM 737 CB ASN 98 32.323 21.563 1.056 1.00 0.00 ATOM 738 CG ASN 98 31.153 22.395 1.500 1.00 0.00 ATOM 739 ND2 ASN 98 29.979 22.093 0.960 1.00 0.00 ATOM 740 OD1 ASN 98 31.293 23.287 2.344 1.00 0.00 ATOM 741 O ASN 98 34.270 22.148 2.979 1.00 0.00 ATOM 742 C ASN 98 34.253 22.861 1.963 1.00 0.00 ATOM 743 N PRO 99 34.916 24.027 1.886 1.00 0.00 ATOM 744 CA PRO 99 35.674 24.495 3.039 1.00 0.00 ATOM 745 CB PRO 99 36.392 25.743 2.504 1.00 0.00 ATOM 746 CG PRO 99 35.558 26.213 1.364 1.00 0.00 ATOM 747 CD PRO 99 35.028 24.943 0.739 1.00 0.00 ATOM 748 O PRO 99 35.278 24.611 5.405 1.00 0.00 ATOM 749 C PRO 99 34.801 24.802 4.272 1.00 0.00 ATOM 750 N ASP 100 33.542 25.223 4.069 1.00 0.00 ATOM 751 CA ASP 100 32.634 25.509 5.187 1.00 0.00 ATOM 752 CB ASP 100 31.324 26.160 4.739 1.00 0.00 ATOM 753 CG ASP 100 31.541 27.549 4.177 1.00 0.00 ATOM 754 OD1 ASP 100 32.348 28.308 4.775 1.00 0.00 ATOM 755 OD2 ASP 100 30.933 27.873 3.130 1.00 0.00 ATOM 756 O ASP 100 32.307 24.465 7.280 1.00 0.00 ATOM 757 C ASP 100 32.336 24.332 6.066 1.00 0.00 ATOM 758 N VAL 101 32.100 23.182 5.453 1.00 0.00 ATOM 759 CA VAL 101 31.913 21.931 6.194 1.00 0.00 ATOM 760 CB VAL 101 31.650 20.744 5.233 1.00 0.00 ATOM 761 CG1 VAL 101 31.823 19.409 5.910 1.00 0.00 ATOM 762 CG2 VAL 101 30.280 20.868 4.604 1.00 0.00 ATOM 763 O VAL 101 32.997 21.417 8.256 1.00 0.00 ATOM 764 C VAL 101 33.129 21.686 7.069 1.00 0.00 ATOM 765 N MET 102 34.312 21.836 6.489 1.00 0.00 ATOM 766 CA MET 102 35.579 21.599 7.197 1.00 0.00 ATOM 767 CB MET 102 36.719 21.698 6.186 1.00 0.00 ATOM 768 CG MET 102 37.808 20.662 6.335 1.00 0.00 ATOM 769 SD MET 102 37.335 18.961 7.181 1.00 0.00 ATOM 770 CE MET 102 35.847 18.412 6.054 1.00 0.00 ATOM 771 O MET 102 36.150 22.265 9.434 1.00 0.00 ATOM 772 C MET 102 35.774 22.609 8.308 1.00 0.00 ATOM 773 N CYS 103 35.481 23.865 7.978 1.00 0.00 ATOM 774 CA CYS 103 35.560 24.971 8.911 1.00 0.00 ATOM 775 CB CYS 103 35.206 26.270 8.177 1.00 0.00 ATOM 776 SG CYS 103 35.340 27.684 9.237 1.00 0.00 ATOM 777 O CYS 103 35.124 25.005 11.274 1.00 0.00 ATOM 778 C CYS 103 34.667 24.796 10.160 1.00 0.00 ATOM 779 N ASN 104 33.400 24.415 9.972 1.00 0.00 ATOM 780 CA ASN 104 32.509 24.158 11.092 1.00 0.00 ATOM 781 CB ASN 104 31.087 23.870 10.596 1.00 0.00 ATOM 782 CG ASN 104 30.433 25.071 9.984 1.00 0.00 ATOM 783 ND2 ASN 104 29.626 24.855 8.963 1.00 0.00 ATOM 784 OD1 ASN 104 30.643 26.180 10.422 1.00 0.00 ATOM 785 O ASN 104 33.053 23.075 13.185 1.00 0.00 ATOM 786 C ASN 104 33.014 22.993 11.949 1.00 0.00 ATOM 787 N LYS 105 33.447 21.932 11.283 1.00 0.00 ATOM 788 CA LYS 105 33.920 20.732 11.952 1.00 0.00 ATOM 789 CB LYS 105 34.199 19.630 10.929 1.00 0.00 ATOM 790 CG LYS 105 34.746 18.345 11.549 1.00 0.00 ATOM 791 CD LYS 105 35.195 17.356 10.472 1.00 0.00 ATOM 792 CE LYS 105 35.567 15.983 11.085 1.00 0.00 ATOM 793 NZ LYS 105 34.344 15.143 11.368 1.00 0.00 ATOM 794 O LYS 105 35.326 20.409 13.871 1.00 0.00 ATOM 795 C LYS 105 35.173 20.966 12.787 1.00 0.00 ATOM 796 N GLU 106 36.076 21.777 12.273 1.00 0.00 ATOM 797 CA GLU 106 37.425 21.849 12.836 1.00 0.00 ATOM 798 CB GLU 106 38.475 21.644 11.747 1.00 0.00 ATOM 799 CG GLU 106 38.401 20.312 11.016 1.00 0.00 ATOM 800 CD GLU 106 38.848 19.100 11.849 1.00 0.00 ATOM 801 OE1 GLU 106 39.309 19.265 13.001 1.00 0.00 ATOM 802 OE2 GLU 106 38.750 17.967 11.323 1.00 0.00 ATOM 803 O GLU 106 38.606 23.215 14.351 1.00 0.00 ATOM 804 C GLU 106 37.700 23.159 13.521 1.00 0.00 ATOM 805 N ILE 107 36.933 24.205 13.177 1.00 0.00 ATOM 806 CA ILE 107 37.196 25.540 13.688 1.00 0.00 ATOM 807 CB ILE 107 37.543 26.575 12.591 1.00 0.00 ATOM 808 CG1 ILE 107 38.770 26.135 11.751 1.00 0.00 ATOM 809 CG2 ILE 107 37.704 27.971 13.192 1.00 0.00 ATOM 810 CD1 ILE 107 40.102 25.974 12.536 1.00 0.00 ATOM 811 O ILE 107 36.241 26.131 15.747 1.00 0.00 ATOM 812 C ILE 107 36.073 26.027 14.542 1.00 0.00 ATOM 813 N LYS 108 34.911 26.300 13.961 1.00 0.00 ATOM 814 CA LYS 108 33.806 26.860 14.744 1.00 0.00 ATOM 815 CB LYS 108 32.631 27.252 13.867 1.00 0.00 ATOM 816 CG LYS 108 32.993 28.316 12.818 1.00 0.00 ATOM 817 CD LYS 108 31.744 28.938 12.186 1.00 0.00 ATOM 818 CE LYS 108 32.037 29.499 10.798 1.00 0.00 ATOM 819 NZ LYS 108 32.370 28.431 9.788 1.00 0.00 ATOM 820 O LYS 108 32.914 26.479 16.926 1.00 0.00 ATOM 821 C LYS 108 33.378 25.972 15.896 1.00 0.00 ATOM 822 N PHE 109 33.567 24.657 15.770 1.00 0.00 ATOM 823 CA PHE 109 33.064 23.750 16.812 1.00 0.00 ATOM 824 CB PHE 109 31.864 22.936 16.317 1.00 0.00 ATOM 825 CG PHE 109 30.690 23.785 15.934 1.00 0.00 ATOM 826 CD1 PHE 109 29.771 24.205 16.894 1.00 0.00 ATOM 827 CD2 PHE 109 30.516 24.205 14.626 1.00 0.00 ATOM 828 CE1 PHE 109 28.675 25.012 16.536 1.00 0.00 ATOM 829 CE2 PHE 109 29.440 25.014 14.272 1.00 0.00 ATOM 830 CZ PHE 109 28.521 25.415 15.233 1.00 0.00 ATOM 831 O PHE 109 33.813 21.875 18.070 1.00 0.00 ATOM 832 C PHE 109 34.120 22.852 17.393 1.00 0.00 ATOM 833 N LYS 110 35.370 23.196 17.149 1.00 0.00 ATOM 834 CA LYS 110 36.461 22.497 17.774 1.00 0.00 ATOM 835 CB LYS 110 37.187 21.615 16.758 1.00 0.00 ATOM 836 CG LYS 110 37.778 20.321 17.316 1.00 0.00 ATOM 837 CD LYS 110 37.984 19.334 16.158 1.00 0.00 ATOM 838 CE LYS 110 39.463 18.984 15.943 1.00 0.00 ATOM 839 NZ LYS 110 39.986 18.081 17.036 1.00 0.00 ATOM 840 O LYS 110 37.335 23.757 19.578 1.00 0.00 ATOM 841 C LYS 110 37.381 23.546 18.374 1.00 0.00 ATOM 842 N ALA 111 38.192 24.220 17.551 1.00 0.00 ATOM 843 CA ALA 111 39.078 25.278 18.050 1.00 0.00 ATOM 844 CB ALA 111 39.832 25.918 16.903 1.00 0.00 ATOM 845 O ALA 111 38.687 26.684 19.995 1.00 0.00 ATOM 846 C ALA 111 38.304 26.342 18.868 1.00 0.00 ATOM 847 N PHE 112 37.200 26.826 18.311 1.00 0.00 ATOM 848 CA PHE 112 36.439 27.894 18.934 1.00 0.00 ATOM 849 CB PHE 112 35.444 28.464 17.939 1.00 0.00 ATOM 850 CG PHE 112 34.624 29.606 18.477 1.00 0.00 ATOM 851 CD1 PHE 112 35.229 30.827 18.823 1.00 0.00 ATOM 852 CD2 PHE 112 33.246 29.482 18.617 1.00 0.00 ATOM 853 CE1 PHE 112 34.464 31.895 19.291 1.00 0.00 ATOM 854 CE2 PHE 112 32.471 30.559 19.093 1.00 0.00 ATOM 855 CZ PHE 112 33.091 31.759 19.431 1.00 0.00 ATOM 856 O PHE 112 35.656 28.148 21.191 1.00 0.00 ATOM 857 C PHE 112 35.725 27.424 20.194 1.00 0.00 ATOM 858 N LEU 113 35.189 26.209 20.138 1.00 0.00 ATOM 859 CA LEU 113 34.531 25.581 21.286 1.00 0.00 ATOM 860 CB LEU 113 33.830 24.286 20.845 1.00 0.00 ATOM 861 CG LEU 113 33.119 23.395 21.866 1.00 0.00 ATOM 862 CD1 LEU 113 32.187 24.210 22.737 1.00 0.00 ATOM 863 CD2 LEU 113 32.328 22.345 21.106 1.00 0.00 ATOM 864 O LEU 113 35.114 25.712 23.605 1.00 0.00 ATOM 865 C LEU 113 35.461 25.349 22.494 1.00 0.00 ATOM 866 N ASP 114 36.624 24.741 22.280 1.00 0.00 ATOM 867 CA ASP 114 37.635 24.606 23.331 1.00 0.00 ATOM 868 CB ASP 114 38.839 23.796 22.849 1.00 0.00 ATOM 869 CG ASP 114 38.453 22.402 22.381 1.00 0.00 ATOM 870 OD1 ASP 114 37.329 21.936 22.730 1.00 0.00 ATOM 871 OD2 ASP 114 39.273 21.783 21.653 1.00 0.00 ATOM 872 O ASP 114 38.409 26.089 25.023 1.00 0.00 ATOM 873 C ASP 114 38.122 25.946 23.839 1.00 0.00 ATOM 874 N TYR 115 38.228 26.921 22.947 1.00 0.00 ATOM 875 CA TYR 115 38.581 28.262 23.347 1.00 0.00 ATOM 876 CB TYR 115 38.739 29.184 22.130 1.00 0.00 ATOM 877 CG TYR 115 39.126 30.600 22.505 1.00 0.00 ATOM 878 CD1 TYR 115 40.404 30.887 22.996 1.00 0.00 ATOM 879 CD2 TYR 115 38.214 31.643 22.382 1.00 0.00 ATOM 880 CE1 TYR 115 40.757 32.176 23.341 1.00 0.00 ATOM 881 CE2 TYR 115 38.555 32.937 22.732 1.00 0.00 ATOM 882 CZ TYR 115 39.814 33.192 23.201 1.00 0.00 ATOM 883 OH TYR 115 40.143 34.476 23.533 1.00 0.00 ATOM 884 O TYR 115 37.842 29.303 25.369 1.00 0.00 ATOM 885 C TYR 115 37.517 28.816 24.298 1.00 0.00 ATOM 886 N ALA 116 36.259 28.737 23.889 1.00 0.00 ATOM 887 CA ALA 116 35.143 29.258 24.647 1.00 0.00 ATOM 888 CB ALA 116 33.862 29.047 23.884 1.00 0.00 ATOM 889 O ALA 116 34.715 29.245 26.996 1.00 0.00 ATOM 890 C ALA 116 35.054 28.596 26.005 1.00 0.00 ATOM 891 N ILE 117 35.378 27.306 26.061 1.00 0.00 ATOM 892 CA ILE 117 35.344 26.576 27.317 1.00 0.00 ATOM 893 CB ILE 117 35.466 25.039 27.072 1.00 0.00 ATOM 894 CG1 ILE 117 34.098 24.478 26.637 1.00 0.00 ATOM 895 CG2 ILE 117 36.011 24.294 28.316 1.00 0.00 ATOM 896 CD1 ILE 117 34.181 23.239 25.750 1.00 0.00 ATOM 897 O ILE 117 36.144 27.138 29.531 1.00 0.00 ATOM 898 C ILE 117 36.379 27.128 28.310 1.00 0.00 ATOM 899 N THR 118 37.505 27.616 27.791 1.00 0.00 ATOM 900 CA THR 118 38.498 28.254 28.654 1.00 0.00 ATOM 901 CB THR 118 39.891 28.404 27.988 1.00 0.00 ATOM 902 CG2 THR 118 40.349 27.105 27.328 1.00 0.00 ATOM 903 OG1 THR 118 39.830 29.432 27.003 1.00 0.00 ATOM 904 O THR 118 38.617 30.223 30.023 1.00 0.00 ATOM 905 C THR 118 38.002 29.614 29.150 1.00 0.00 ATOM 906 N LEU 119 36.902 30.095 28.590 1.00 0.00 ATOM 907 CA LEU 119 36.252 31.278 29.133 1.00 0.00 ATOM 908 CB LEU 119 35.807 32.218 28.010 1.00 0.00 ATOM 909 CG LEU 119 36.985 32.907 27.298 1.00 0.00 ATOM 910 CD1 LEU 119 36.543 33.432 25.947 1.00 0.00 ATOM 911 CD2 LEU 119 37.558 34.028 28.137 1.00 0.00 ATOM 912 O LEU 119 34.272 31.779 30.425 1.00 0.00 ATOM 913 C LEU 119 35.076 30.913 30.056 1.00 0.00 ATOM 914 N GLY 120 35.009 29.633 30.433 1.00 0.00 ATOM 915 CA GLY 120 33.964 29.109 31.296 1.00 0.00 ATOM 916 O GLY 120 31.577 29.137 31.298 1.00 0.00 ATOM 917 C GLY 120 32.612 29.067 30.623 1.00 0.00 ATOM 918 N ALA 121 32.621 28.984 29.295 1.00 0.00 ATOM 919 CA ALA 121 31.416 28.824 28.507 1.00 0.00 ATOM 920 CB ALA 121 31.753 28.868 27.029 1.00 0.00 ATOM 921 O ALA 121 31.358 26.467 28.939 1.00 0.00 ATOM 922 C ALA 121 30.722 27.515 28.816 1.00 0.00 ATOM 923 N ASP 122 29.405 27.597 28.918 1.00 0.00 ATOM 924 CA ASP 122 28.545 26.425 28.941 1.00 0.00 ATOM 925 CB ASP 122 27.301 26.746 29.754 1.00 0.00 ATOM 926 CG ASP 122 27.629 26.934 31.205 1.00 0.00 ATOM 927 OD1 ASP 122 28.258 26.001 31.753 1.00 0.00 ATOM 928 OD2 ASP 122 27.325 28.008 31.789 1.00 0.00 ATOM 929 O ASP 122 28.206 24.794 27.215 1.00 0.00 ATOM 930 C ASP 122 28.192 25.982 27.515 1.00 0.00 ATOM 931 N TYR 123 27.911 26.957 26.648 1.00 0.00 ATOM 932 CA TYR 123 27.560 26.754 25.261 1.00 0.00 ATOM 933 CB TYR 123 26.039 26.999 25.046 1.00 0.00 ATOM 934 CG TYR 123 25.171 26.041 25.820 1.00 0.00 ATOM 935 CD1 TYR 123 24.835 24.804 25.288 1.00 0.00 ATOM 936 CD2 TYR 123 24.732 26.343 27.108 1.00 0.00 ATOM 937 CE1 TYR 123 24.057 23.889 26.000 1.00 0.00 ATOM 938 CE2 TYR 123 23.950 25.431 27.853 1.00 0.00 ATOM 939 CZ TYR 123 23.611 24.204 27.275 1.00 0.00 ATOM 940 OH TYR 123 22.843 23.286 27.961 1.00 0.00 ATOM 941 O TYR 123 28.711 28.822 24.894 1.00 0.00 ATOM 942 C TYR 123 28.355 27.752 24.413 1.00 0.00 ATOM 943 N VAL 124 28.633 27.375 23.160 1.00 0.00 ATOM 944 CA VAL 124 28.877 28.329 22.079 1.00 0.00 ATOM 945 CB VAL 124 29.992 27.869 21.102 1.00 0.00 ATOM 946 CG1 VAL 124 31.286 27.560 21.836 1.00 0.00 ATOM 947 CG2 VAL 124 29.554 26.651 20.325 1.00 0.00 ATOM 948 O VAL 124 26.753 27.605 21.187 1.00 0.00 ATOM 949 C VAL 124 27.567 28.526 21.289 1.00 0.00 ATOM 950 N ALA 125 27.361 29.733 20.763 1.00 0.00 ATOM 951 CA ALA 125 26.282 29.982 19.858 1.00 0.00 ATOM 952 CB ALA 125 25.235 30.908 20.496 1.00 0.00 ATOM 953 O ALA 125 27.857 31.300 18.628 1.00 0.00 ATOM 954 C ALA 125 26.843 30.592 18.594 1.00 0.00 ATOM 955 N THR 126 26.190 30.293 17.471 1.00 0.00 ATOM 956 CA THR 126 26.484 30.937 16.203 1.00 0.00 ATOM 957 CB THR 126 27.139 29.984 15.208 1.00 0.00 ATOM 958 CG2 THR 126 28.467 29.403 15.730 1.00 0.00 ATOM 959 OG1 THR 126 26.216 28.935 14.931 1.00 0.00 ATOM 960 O THR 126 24.095 30.844 16.035 1.00 0.00 ATOM 961 C THR 126 25.162 31.317 15.589 1.00 0.00 ATOM 962 N GLY 127 25.238 32.151 14.541 1.00 0.00 ATOM 963 CA GLY 127 24.054 32.551 13.802 1.00 0.00 ATOM 964 O GLY 127 23.086 32.034 11.703 1.00 0.00 ATOM 965 C GLY 127 23.718 31.612 12.653 1.00 0.00 ATOM 966 N HIS 128 24.138 30.351 12.713 1.00 0.00 ATOM 967 CA HIS 128 23.708 29.353 11.768 1.00 0.00 ATOM 968 CB HIS 128 24.388 28.006 12.059 1.00 0.00 ATOM 969 CG HIS 128 25.800 27.915 11.563 1.00 0.00 ATOM 970 CD2 HIS 128 26.302 27.752 10.310 1.00 0.00 ATOM 971 ND1 HIS 128 26.894 28.023 12.404 1.00 0.00 ATOM 972 CE1 HIS 128 28.004 27.902 11.695 1.00 0.00 ATOM 973 NE2 HIS 128 27.670 27.748 10.425 1.00 0.00 ATOM 974 O HIS 128 21.610 29.132 12.964 1.00 0.00 ATOM 975 C HIS 128 22.180 29.161 11.856 1.00 0.00 ATOM 976 N TYR 129 21.547 29.016 10.692 1.00 0.00 ATOM 977 CA TYR 129 20.145 28.654 10.562 1.00 0.00 ATOM 978 CB TYR 129 19.602 29.187 9.239 1.00 0.00 ATOM 979 CG TYR 129 19.504 30.714 9.269 1.00 0.00 ATOM 980 CD1 TYR 129 20.613 31.510 8.988 1.00 0.00 ATOM 981 CD2 TYR 129 18.303 31.351 9.621 1.00 0.00 ATOM 982 CE1 TYR 129 20.543 32.911 9.030 1.00 0.00 ATOM 983 CE2 TYR 129 18.205 32.737 9.658 1.00 0.00 ATOM 984 CZ TYR 129 19.332 33.514 9.373 1.00 0.00 ATOM 985 OH TYR 129 19.251 34.890 9.416 1.00 0.00 ATOM 986 O TYR 129 19.987 26.431 9.693 1.00 0.00 ATOM 987 C TYR 129 19.977 27.150 10.686 1.00 0.00 ATOM 988 N ALA 130 19.875 26.680 11.931 1.00 0.00 ATOM 989 CA ALA 130 19.786 25.244 12.253 1.00 0.00 ATOM 990 CB ALA 130 21.179 24.578 12.251 1.00 0.00 ATOM 991 O ALA 130 19.112 26.114 14.340 1.00 0.00 ATOM 992 C ALA 130 19.161 25.144 13.612 1.00 0.00 ATOM 993 N ARG 131 18.685 23.973 13.970 1.00 0.00 ATOM 994 CA ARG 131 18.150 23.772 15.302 1.00 0.00 ATOM 995 CB ARG 131 16.631 23.565 15.246 1.00 0.00 ATOM 996 CG ARG 131 15.855 24.783 14.800 1.00 0.00 ATOM 997 CD ARG 131 14.400 24.428 14.636 1.00 0.00 ATOM 998 NE ARG 131 14.169 23.768 13.357 1.00 0.00 ATOM 999 CZ ARG 131 13.105 23.027 13.056 1.00 0.00 ATOM 1000 NH1 ARG 131 12.154 22.835 13.955 1.00 0.00 ATOM 1001 NH2 ARG 131 12.998 22.472 11.844 1.00 0.00 ATOM 1002 O ARG 131 19.234 21.635 15.251 1.00 0.00 ATOM 1003 C ARG 131 18.798 22.562 15.943 1.00 0.00 ATOM 1004 N VAL 132 18.854 22.592 17.270 1.00 0.00 ATOM 1005 CA VAL 132 19.171 21.424 18.090 1.00 0.00 ATOM 1006 CB VAL 132 20.480 21.623 18.890 1.00 0.00 ATOM 1007 CG1 VAL 132 21.670 21.522 17.930 1.00 0.00 ATOM 1008 CG2 VAL 132 20.515 22.991 19.520 1.00 0.00 ATOM 1009 O VAL 132 17.413 21.964 19.650 1.00 0.00 ATOM 1010 C VAL 132 17.980 21.085 18.993 1.00 0.00 ATOM 1011 N ALA 133 17.566 19.824 18.973 1.00 0.00 ATOM 1012 CA ALA 133 16.523 19.356 19.868 1.00 0.00 ATOM 1013 CB ALA 133 15.359 18.780 19.083 1.00 0.00 ATOM 1014 O ALA 133 17.862 17.439 20.334 1.00 0.00 ATOM 1015 C ALA 133 17.116 18.309 20.786 1.00 0.00 ATOM 1016 N ARG 134 16.810 18.417 22.080 1.00 0.00 ATOM 1017 CA ARG 134 17.253 17.430 23.077 1.00 0.00 ATOM 1018 CB ARG 134 17.633 18.096 24.406 1.00 0.00 ATOM 1019 CG ARG 134 18.988 18.818 24.403 1.00 0.00 ATOM 1020 CD ARG 134 18.861 20.363 24.296 1.00 0.00 ATOM 1021 NE ARG 134 19.970 20.993 23.564 1.00 0.00 ATOM 1022 CZ ARG 134 21.250 21.037 23.965 1.00 0.00 ATOM 1023 NH1 ARG 134 21.627 20.466 25.120 1.00 0.00 ATOM 1024 NH2 ARG 134 22.169 21.645 23.195 1.00 0.00 ATOM 1025 O ARG 134 15.000 16.669 23.393 1.00 0.00 ATOM 1026 C ARG 134 16.186 16.359 23.295 1.00 0.00 ATOM 1027 N ASP 135 16.616 15.099 23.352 1.00 0.00 ATOM 1028 CA ASP 135 15.717 13.962 23.618 1.00 0.00 ATOM 1029 CB ASP 135 16.394 12.636 23.248 1.00 0.00 ATOM 1030 CG ASP 135 15.759 11.965 22.049 1.00 0.00 ATOM 1031 OD1 ASP 135 16.418 11.090 21.437 1.00 0.00 ATOM 1032 OD2 ASP 135 14.602 12.312 21.718 1.00 0.00 ATOM 1033 O ASP 135 15.844 14.570 25.935 1.00 0.00 ATOM 1034 C ASP 135 15.298 13.871 25.073 1.00 0.00 ATOM 1035 N GLU 136 14.330 12.986 25.326 1.00 0.00 ATOM 1036 CA GLU 136 13.992 12.533 26.673 1.00 0.00 ATOM 1037 CB GLU 136 12.960 11.391 26.632 1.00 0.00 ATOM 1038 CG GLU 136 11.631 11.731 25.922 1.00 0.00 ATOM 1039 CD GLU 136 11.679 11.567 24.381 1.00 0.00 ATOM 1040 OE1 GLU 136 11.031 10.618 23.871 1.00 0.00 ATOM 1041 OE2 GLU 136 12.346 12.377 23.676 1.00 0.00 ATOM 1042 O GLU 136 15.655 12.574 28.413 1.00 0.00 ATOM 1043 C GLU 136 15.288 12.068 27.343 1.00 0.00 ATOM 1044 N ASP 137 15.993 11.147 26.670 1.00 0.00 ATOM 1045 CA ASP 137 17.284 10.602 27.134 1.00 0.00 ATOM 1046 CB ASP 137 17.761 9.451 26.229 1.00 0.00 ATOM 1047 CG ASP 137 17.012 9.393 24.908 1.00 0.00 ATOM 1048 OD1 ASP 137 17.572 9.825 23.860 1.00 0.00 ATOM 1049 OD2 ASP 137 15.846 8.926 24.929 1.00 0.00 ATOM 1050 O ASP 137 19.398 11.403 27.955 1.00 0.00 ATOM 1051 C ASP 137 18.395 11.645 27.276 1.00 0.00 ATOM 1052 N GLY 138 18.213 12.801 26.643 1.00 0.00 ATOM 1053 CA GLY 138 19.216 13.859 26.691 1.00 0.00 ATOM 1054 O GLY 138 21.082 14.588 25.392 1.00 0.00 ATOM 1055 C GLY 138 20.102 13.842 25.461 1.00 0.00 ATOM 1056 N THR 139 19.759 12.978 24.503 1.00 0.00 ATOM 1057 CA THR 139 20.445 12.908 23.217 1.00 0.00 ATOM 1058 CB THR 139 20.153 11.586 22.496 1.00 0.00 ATOM 1059 CG2 THR 139 20.665 11.602 21.047 1.00 0.00 ATOM 1060 OG1 THR 139 20.796 10.522 23.198 1.00 0.00 ATOM 1061 O THR 139 18.820 14.323 22.165 1.00 0.00 ATOM 1062 C THR 139 20.009 14.074 22.337 1.00 0.00 ATOM 1063 N VAL 140 20.982 14.790 21.792 1.00 0.00 ATOM 1064 CA VAL 140 20.702 15.933 20.944 1.00 0.00 ATOM 1065 CB VAL 140 21.757 17.037 21.161 1.00 0.00 ATOM 1066 CG1 VAL 140 21.433 18.270 20.357 1.00 0.00 ATOM 1067 CG2 VAL 140 21.799 17.409 22.594 1.00 0.00 ATOM 1068 O VAL 140 21.461 14.695 19.001 1.00 0.00 ATOM 1069 C VAL 140 20.644 15.498 19.471 1.00 0.00 ATOM 1070 N HIS 141 19.663 16.047 18.762 1.00 0.00 ATOM 1071 CA HIS 141 19.494 15.849 17.332 1.00 0.00 ATOM 1072 CB HIS 141 18.143 15.182 17.048 1.00 0.00 ATOM 1073 CG HIS 141 17.993 13.829 17.677 1.00 0.00 ATOM 1074 CD2 HIS 141 17.790 13.461 18.964 1.00 0.00 ATOM 1075 ND1 HIS 141 18.061 12.658 16.954 1.00 0.00 ATOM 1076 CE1 HIS 141 17.903 11.628 17.765 1.00 0.00 ATOM 1077 NE2 HIS 141 17.743 12.088 18.992 1.00 0.00 ATOM 1078 O HIS 141 19.207 18.225 17.253 1.00 0.00 ATOM 1079 C HIS 141 19.585 17.220 16.652 1.00 0.00 ATOM 1080 N MET 142 20.110 17.262 15.424 1.00 0.00 ATOM 1081 CA MET 142 20.135 18.503 14.649 1.00 0.00 ATOM 1082 CB MET 142 21.435 18.644 13.872 1.00 0.00 ATOM 1083 CG MET 142 21.571 19.988 13.239 1.00 0.00 ATOM 1084 SD MET 142 23.393 20.395 12.750 1.00 0.00 ATOM 1085 CE MET 142 23.674 18.981 11.478 1.00 0.00 ATOM 1086 O MET 142 18.747 17.644 12.936 1.00 0.00 ATOM 1087 C MET 142 18.972 18.573 13.686 1.00 0.00 ATOM 1088 N LEU 143 18.250 19.683 13.705 1.00 0.00 ATOM 1089 CA LEU 143 17.133 19.900 12.798 1.00 0.00 ATOM 1090 CB LEU 143 15.883 20.264 13.604 1.00 0.00 ATOM 1091 CG LEU 143 14.987 19.184 14.250 1.00 0.00 ATOM 1092 CD1 LEU 143 15.719 17.873 14.597 1.00 0.00 ATOM 1093 CD2 LEU 143 14.177 19.710 15.441 1.00 0.00 ATOM 1094 O LEU 143 18.160 21.979 12.128 1.00 0.00 ATOM 1095 C LEU 143 17.437 21.024 11.808 1.00 0.00 ATOM 1096 N ARG 144 16.875 20.917 10.604 1.00 0.00 ATOM 1097 CA ARG 144 16.957 21.991 9.629 1.00 0.00 ATOM 1098 CB ARG 144 16.063 21.679 8.443 1.00 0.00 ATOM 1099 CG ARG 144 16.447 20.467 7.583 1.00 0.00 ATOM 1100 CD ARG 144 15.293 20.215 6.682 1.00 0.00 ATOM 1101 NE ARG 144 15.097 18.817 6.307 1.00 0.00 ATOM 1102 CZ ARG 144 15.269 18.352 5.069 1.00 0.00 ATOM 1103 NH1 ARG 144 15.677 19.170 4.108 1.00 0.00 ATOM 1104 NH2 ARG 144 15.052 17.069 4.801 1.00 0.00 ATOM 1105 O ARG 144 15.495 23.261 11.022 1.00 0.00 ATOM 1106 C ARG 144 16.460 23.283 10.248 1.00 0.00 ATOM 1107 N GLY 145 17.096 24.407 9.908 1.00 0.00 ATOM 1108 CA GLY 145 16.469 25.709 10.171 1.00 0.00 ATOM 1109 O GLY 145 14.842 25.195 8.481 1.00 0.00 ATOM 1110 C GLY 145 15.080 25.774 9.534 1.00 0.00 ATOM 1111 N VAL 146 14.150 26.470 10.168 1.00 0.00 ATOM 1112 CA VAL 146 12.819 26.607 9.597 1.00 0.00 ATOM 1113 CB VAL 146 11.794 27.189 10.602 1.00 0.00 ATOM 1114 CG1 VAL 146 11.756 26.335 11.869 1.00 0.00 ATOM 1115 CG2 VAL 146 12.098 28.628 10.901 1.00 0.00 ATOM 1116 O VAL 146 11.907 27.348 7.513 1.00 0.00 ATOM 1117 C VAL 146 12.827 27.445 8.321 1.00 0.00 ATOM 1118 N ASP 147 13.836 28.301 8.174 1.00 0.00 ATOM 1119 CA ASP 147 14.066 29.034 6.934 1.00 0.00 ATOM 1120 CB ASP 147 15.070 30.182 7.170 1.00 0.00 ATOM 1121 CG ASP 147 15.184 31.130 5.971 1.00 0.00 ATOM 1122 OD1 ASP 147 15.199 30.640 4.824 1.00 0.00 ATOM 1123 OD2 ASP 147 15.237 32.373 6.164 1.00 0.00 ATOM 1124 O ASP 147 15.875 27.778 6.015 1.00 0.00 ATOM 1125 C ASP 147 14.668 28.028 5.968 1.00 0.00 ATOM 1126 N ASN 148 13.861 27.448 5.088 1.00 0.00 ATOM 1127 CA ASN 148 14.365 26.377 4.224 1.00 0.00 ATOM 1128 CB ASN 148 13.220 25.475 3.758 1.00 0.00 ATOM 1129 CG ASN 148 13.639 24.017 3.622 1.00 0.00 ATOM 1130 ND2 ASN 148 13.765 23.580 2.379 1.00 0.00 ATOM 1131 OD1 ASN 148 13.824 23.284 4.614 1.00 0.00 ATOM 1132 O ASN 148 15.828 26.037 2.336 1.00 0.00 ATOM 1133 C ASN 148 15.238 26.848 3.039 1.00 0.00 ATOM 1134 N GLY 149 15.329 28.155 2.820 1.00 0.00 ATOM 1135 CA GLY 149 16.335 28.674 1.919 1.00 0.00 ATOM 1136 O GLY 149 18.729 28.764 1.871 1.00 0.00 ATOM 1137 C GLY 149 17.700 28.915 2.546 1.00 0.00 ATOM 1138 N LYS 150 17.709 29.264 3.827 1.00 0.00 ATOM 1139 CA LYS 150 18.943 29.591 4.526 1.00 0.00 ATOM 1140 CB LYS 150 18.756 30.858 5.356 1.00 0.00 ATOM 1141 CG LYS 150 19.953 31.818 5.321 1.00 0.00 ATOM 1142 CD LYS 150 20.136 32.505 3.948 1.00 0.00 ATOM 1143 CE LYS 150 18.951 33.401 3.569 1.00 0.00 ATOM 1144 NZ LYS 150 19.128 34.045 2.237 1.00 0.00 ATOM 1145 O LYS 150 20.581 28.518 5.899 1.00 0.00 ATOM 1146 C LYS 150 19.452 28.448 5.401 1.00 0.00 ATOM 1147 N ASP 151 18.626 27.409 5.577 1.00 0.00 ATOM 1148 CA ASP 151 18.972 26.226 6.372 1.00 0.00 ATOM 1149 CB ASP 151 18.004 25.087 6.106 1.00 0.00 ATOM 1150 CG ASP 151 18.526 23.747 6.623 1.00 0.00 ATOM 1151 OD1 ASP 151 19.198 23.691 7.679 1.00 0.00 ATOM 1152 OD2 ASP 151 18.274 22.732 5.970 1.00 0.00 ATOM 1153 O ASP 151 20.780 25.232 5.114 1.00 0.00 ATOM 1154 C ASP 151 20.406 25.718 6.189 1.00 0.00 ATOM 1155 N GLN 152 21.195 25.782 7.253 1.00 0.00 ATOM 1156 CA GLN 152 22.608 25.467 7.138 1.00 0.00 ATOM 1157 CB GLN 152 23.420 26.580 7.764 1.00 0.00 ATOM 1158 CG GLN 152 23.702 27.710 6.769 1.00 0.00 ATOM 1159 CD GLN 152 23.716 29.080 7.412 1.00 0.00 ATOM 1160 OE1 GLN 152 23.219 29.286 8.501 1.00 0.00 ATOM 1161 NE2 GLN 152 24.301 30.028 6.728 1.00 0.00 ATOM 1162 O GLN 152 24.218 23.813 7.730 1.00 0.00 ATOM 1163 C GLN 152 23.033 24.087 7.649 1.00 0.00 ATOM 1164 N THR 153 22.086 23.207 7.963 1.00 0.00 ATOM 1165 CA THR 153 22.464 21.855 8.370 1.00 0.00 ATOM 1166 CB THR 153 21.238 20.933 8.663 1.00 0.00 ATOM 1167 CG2 THR 153 20.460 21.463 9.840 1.00 0.00 ATOM 1168 OG1 THR 153 20.399 20.851 7.502 1.00 0.00 ATOM 1169 O THR 153 24.292 20.375 7.779 1.00 0.00 ATOM 1170 C THR 153 23.425 21.166 7.375 1.00 0.00 ATOM 1171 N TYR 154 23.271 21.465 6.087 1.00 0.00 ATOM 1172 CA TYR 154 24.143 20.923 5.045 1.00 0.00 ATOM 1173 CB TYR 154 23.785 21.526 3.666 1.00 0.00 ATOM 1174 CG TYR 154 24.612 21.000 2.494 1.00 0.00 ATOM 1175 CD1 TYR 154 24.228 19.837 1.815 1.00 0.00 ATOM 1176 CD2 TYR 154 25.773 21.659 2.077 1.00 0.00 ATOM 1177 CE1 TYR 154 24.978 19.324 0.760 1.00 0.00 ATOM 1178 CE2 TYR 154 26.541 21.164 1.026 1.00 0.00 ATOM 1179 CZ TYR 154 26.133 19.987 0.367 1.00 0.00 ATOM 1180 OH TYR 154 26.880 19.476 -0.688 1.00 0.00 ATOM 1181 O TYR 154 26.447 20.269 5.307 1.00 0.00 ATOM 1182 C TYR 154 25.615 21.162 5.417 1.00 0.00 ATOM 1183 N PHE 155 25.933 22.358 5.893 1.00 0.00 ATOM 1184 CA PHE 155 27.310 22.698 6.186 1.00 0.00 ATOM 1185 CB PHE 155 27.482 24.207 6.075 1.00 0.00 ATOM 1186 CG PHE 155 27.251 24.741 4.694 1.00 0.00 ATOM 1187 CD1 PHE 155 28.193 24.546 3.698 1.00 0.00 ATOM 1188 CD2 PHE 155 26.084 25.458 4.392 1.00 0.00 ATOM 1189 CE1 PHE 155 27.970 25.041 2.408 1.00 0.00 ATOM 1190 CE2 PHE 155 25.854 25.980 3.124 1.00 0.00 ATOM 1191 CZ PHE 155 26.805 25.779 2.123 1.00 0.00 ATOM 1192 O PHE 155 28.945 22.241 7.909 1.00 0.00 ATOM 1193 C PHE 155 27.741 22.228 7.579 1.00 0.00 ATOM 1194 N LEU 156 26.761 21.822 8.383 1.00 0.00 ATOM 1195 CA LEU 156 26.991 21.392 9.752 1.00 0.00 ATOM 1196 CB LEU 156 25.951 22.045 10.682 1.00 0.00 ATOM 1197 CG LEU 156 25.939 23.589 10.730 1.00 0.00 ATOM 1198 CD1 LEU 156 24.629 24.110 11.248 1.00 0.00 ATOM 1199 CD2 LEU 156 27.097 24.135 11.553 1.00 0.00 ATOM 1200 O LEU 156 26.882 19.302 10.955 1.00 0.00 ATOM 1201 C LEU 156 26.924 19.874 9.856 1.00 0.00 ATOM 1202 N SER 157 26.917 19.210 8.707 1.00 0.00 ATOM 1203 CA SER 157 26.675 17.742 8.654 1.00 0.00 ATOM 1204 CB SER 157 26.616 17.256 7.205 1.00 0.00 ATOM 1205 OG SER 157 27.538 17.981 6.391 1.00 0.00 ATOM 1206 O SER 157 27.407 15.785 9.884 1.00 0.00 ATOM 1207 C SER 157 27.708 16.909 9.440 1.00 0.00 ATOM 1208 N GLN 158 28.908 17.476 9.620 1.00 0.00 ATOM 1209 CA GLN 158 29.997 16.756 10.279 1.00 0.00 ATOM 1210 CB GLN 158 31.357 17.202 9.718 1.00 0.00 ATOM 1211 CG GLN 158 31.603 16.824 8.254 1.00 0.00 ATOM 1212 CD GLN 158 31.875 15.335 8.093 1.00 0.00 ATOM 1213 OE1 GLN 158 32.658 14.746 8.849 1.00 0.00 ATOM 1214 NE2 GLN 158 31.223 14.719 7.119 1.00 0.00 ATOM 1215 O GLN 158 30.869 16.253 12.422 1.00 0.00 ATOM 1216 C GLN 158 30.013 16.858 11.808 1.00 0.00 ATOM 1217 N LEU 159 29.093 17.609 12.417 1.00 0.00 ATOM 1218 CA LEU 159 29.095 17.833 13.874 1.00 0.00 ATOM 1219 CB LEU 159 28.197 19.013 14.292 1.00 0.00 ATOM 1220 CG LEU 159 28.453 20.450 13.756 1.00 0.00 ATOM 1221 CD1 LEU 159 27.710 21.485 14.579 1.00 0.00 ATOM 1222 CD2 LEU 159 29.910 20.839 13.713 1.00 0.00 ATOM 1223 O LEU 159 27.764 15.892 14.273 1.00 0.00 ATOM 1224 C LEU 159 28.703 16.586 14.647 1.00 0.00 ATOM 1225 N SER 160 29.427 16.324 15.727 1.00 0.00 ATOM 1226 CA SER 160 29.244 15.156 16.559 1.00 0.00 ATOM 1227 CB SER 160 30.579 14.780 17.182 1.00 0.00 ATOM 1228 OG SER 160 30.976 15.813 18.070 1.00 0.00 ATOM 1229 O SER 160 27.951 16.627 17.941 1.00 0.00 ATOM 1230 C SER 160 28.262 15.463 17.677 1.00 0.00 ATOM 1231 N GLN 161 27.775 14.409 18.321 1.00 0.00 ATOM 1232 CA GLN 161 26.896 14.508 19.487 1.00 0.00 ATOM 1233 CB GLN 161 26.661 13.097 20.054 1.00 0.00 ATOM 1234 CG GLN 161 25.695 13.024 21.227 1.00 0.00 ATOM 1235 CD GLN 161 24.333 13.566 20.878 1.00 0.00 ATOM 1236 OE1 GLN 161 23.925 13.556 19.705 1.00 0.00 ATOM 1237 NE2 GLN 161 23.618 14.057 21.887 1.00 0.00 ATOM 1238 O GLN 161 26.845 16.234 21.169 1.00 0.00 ATOM 1239 C GLN 161 27.514 15.385 20.570 1.00 0.00 ATOM 1240 N GLU 162 28.809 15.184 20.775 1.00 0.00 ATOM 1241 CA GLU 162 29.576 15.884 21.785 1.00 0.00 ATOM 1242 CB GLU 162 30.936 15.192 21.941 1.00 0.00 ATOM 1243 CG GLU 162 30.871 13.761 22.548 1.00 0.00 ATOM 1244 CD GLU 162 30.223 12.682 21.642 1.00 0.00 ATOM 1245 OE1 GLU 162 30.362 12.727 20.379 1.00 0.00 ATOM 1246 OE2 GLU 162 29.584 11.767 22.232 1.00 0.00 ATOM 1247 O GLU 162 29.857 18.174 22.450 1.00 0.00 ATOM 1248 C GLU 162 29.732 17.393 21.506 1.00 0.00 ATOM 1249 N GLN 163 29.740 17.786 20.226 1.00 0.00 ATOM 1250 CA GLN 163 29.739 19.199 19.811 1.00 0.00 ATOM 1251 CB GLN 163 30.222 19.352 18.355 1.00 0.00 ATOM 1252 CG GLN 163 31.734 19.123 18.177 1.00 0.00 ATOM 1253 CD GLN 163 32.175 18.902 16.734 1.00 0.00 ATOM 1254 OE1 GLN 163 31.632 18.065 16.018 1.00 0.00 ATOM 1255 NE2 GLN 163 33.177 19.640 16.313 1.00 0.00 ATOM 1256 O GLN 163 28.219 20.936 20.452 1.00 0.00 ATOM 1257 C GLN 163 28.353 19.828 19.948 1.00 0.00 ATOM 1258 N LEU 164 27.329 19.113 19.496 1.00 0.00 ATOM 1259 CA LEU 164 25.940 19.561 19.606 1.00 0.00 ATOM 1260 CB LEU 164 25.004 18.612 18.835 1.00 0.00 ATOM 1261 CG LEU 164 25.177 18.584 17.322 1.00 0.00 ATOM 1262 CD1 LEU 164 24.389 17.459 16.679 1.00 0.00 ATOM 1263 CD2 LEU 164 24.840 19.938 16.662 1.00 0.00 ATOM 1264 O LEU 164 24.568 20.557 21.304 1.00 0.00 ATOM 1265 C LEU 164 25.455 19.737 21.041 1.00 0.00 ATOM 1266 N GLN 165 26.009 18.955 21.965 1.00 0.00 ATOM 1267 CA GLN 165 25.676 19.092 23.390 1.00 0.00 ATOM 1268 CB GLN 165 26.395 18.029 24.247 1.00 0.00 ATOM 1269 CG GLN 165 25.888 16.586 24.116 1.00 0.00 ATOM 1270 CD GLN 165 24.558 16.350 24.800 1.00 0.00 ATOM 1271 OE1 GLN 165 24.047 17.211 25.536 1.00 0.00 ATOM 1272 NE2 GLN 165 23.984 15.174 24.567 1.00 0.00 ATOM 1273 O GLN 165 25.473 20.907 24.923 1.00 0.00 ATOM 1274 C GLN 165 26.047 20.462 23.952 1.00 0.00 ATOM 1275 N LYS 166 27.041 21.100 23.364 1.00 0.00 ATOM 1276 CA LYS 166 27.512 22.376 23.852 1.00 0.00 ATOM 1277 CB LYS 166 29.016 22.313 24.130 1.00 0.00 ATOM 1278 CG LYS 166 29.366 21.446 25.341 1.00 0.00 ATOM 1279 CD LYS 166 30.377 22.141 26.221 1.00 0.00 ATOM 1280 CE LYS 166 30.853 21.267 27.364 1.00 0.00 ATOM 1281 NZ LYS 166 29.801 21.161 28.415 1.00 0.00 ATOM 1282 O LYS 166 27.733 24.615 23.029 1.00 0.00 ATOM 1283 C LYS 166 27.178 23.518 22.896 1.00 0.00 ATOM 1284 N THR 167 26.262 23.264 21.957 1.00 0.00 ATOM 1285 CA THR 167 25.902 24.228 20.944 1.00 0.00 ATOM 1286 CB THR 167 25.956 23.562 19.562 1.00 0.00 ATOM 1287 CG2 THR 167 25.483 24.484 18.490 1.00 0.00 ATOM 1288 OG1 THR 167 27.308 23.183 19.275 1.00 0.00 ATOM 1289 O THR 167 23.634 24.083 21.633 1.00 0.00 ATOM 1290 C THR 167 24.512 24.797 21.173 1.00 0.00 ATOM 1291 N MET 168 24.336 26.089 20.865 1.00 0.00 ATOM 1292 CA MET 168 23.018 26.726 20.704 1.00 0.00 ATOM 1293 CB MET 168 22.783 27.782 21.789 1.00 0.00 ATOM 1294 CG MET 168 22.505 27.235 23.125 1.00 0.00 ATOM 1295 SD MET 168 22.269 28.627 24.428 1.00 0.00 ATOM 1296 CE MET 168 20.499 29.277 23.755 1.00 0.00 ATOM 1297 O MET 168 23.915 27.979 18.893 1.00 0.00 ATOM 1298 C MET 168 22.925 27.415 19.359 1.00 0.00 ATOM 1299 N PHE 169 21.744 27.365 18.732 1.00 0.00 ATOM 1300 CA PHE 169 21.467 28.053 17.459 1.00 0.00 ATOM 1301 CB PHE 169 21.160 27.071 16.312 1.00 0.00 ATOM 1302 CG PHE 169 22.325 26.201 15.895 1.00 0.00 ATOM 1303 CD1 PHE 169 23.572 26.773 15.535 1.00 0.00 ATOM 1304 CD2 PHE 169 22.173 24.792 15.836 1.00 0.00 ATOM 1305 CE1 PHE 169 24.637 25.965 15.131 1.00 0.00 ATOM 1306 CE2 PHE 169 23.236 23.964 15.442 1.00 0.00 ATOM 1307 CZ PHE 169 24.476 24.548 15.077 1.00 0.00 ATOM 1308 O PHE 169 19.155 28.550 17.330 1.00 0.00 ATOM 1309 C PHE 169 20.266 28.946 17.639 1.00 0.00 ATOM 1310 N PRO 170 20.469 30.155 18.172 1.00 0.00 ATOM 1311 CA PRO 170 19.323 31.080 18.445 1.00 0.00 ATOM 1312 CB PRO 170 19.993 32.300 19.100 1.00 0.00 ATOM 1313 CG PRO 170 21.319 31.754 19.632 1.00 0.00 ATOM 1314 CD PRO 170 21.763 30.702 18.648 1.00 0.00 ATOM 1315 O PRO 170 17.353 31.964 17.389 1.00 0.00 ATOM 1316 C PRO 170 18.499 31.526 17.224 1.00 0.00 ATOM 1317 N LEU 171 19.059 31.446 16.018 1.00 0.00 ATOM 1318 CA LEU 171 18.288 31.837 14.825 1.00 0.00 ATOM 1319 CB LEU 171 19.186 32.470 13.776 1.00 0.00 ATOM 1320 CG LEU 171 20.045 33.642 14.271 1.00 0.00 ATOM 1321 CD1 LEU 171 20.725 34.221 13.043 1.00 0.00 ATOM 1322 CD2 LEU 171 19.202 34.713 15.047 1.00 0.00 ATOM 1323 O LEU 171 16.806 30.841 13.219 1.00 0.00 ATOM 1324 C LEU 171 17.524 30.667 14.196 1.00 0.00 ATOM 1325 N GLY 172 17.662 29.486 14.772 1.00 0.00 ATOM 1326 CA GLY 172 17.120 28.293 14.185 1.00 0.00 ATOM 1327 O GLY 172 15.208 27.618 13.015 1.00 0.00 ATOM 1328 C GLY 172 15.641 28.322 13.893 1.00 0.00 ATOM 1329 N HIS 173 14.862 29.124 14.621 1.00 0.00 ATOM 1330 CA HIS 173 13.412 29.155 14.408 1.00 0.00 ATOM 1331 CB HIS 173 12.648 29.081 15.726 1.00 0.00 ATOM 1332 CG HIS 173 12.563 27.712 16.309 1.00 0.00 ATOM 1333 CD2 HIS 173 11.587 26.771 16.239 1.00 0.00 ATOM 1334 ND1 HIS 173 13.563 27.174 17.089 1.00 0.00 ATOM 1335 CE1 HIS 173 13.206 25.963 17.479 1.00 0.00 ATOM 1336 NE2 HIS 173 12.014 25.690 16.973 1.00 0.00 ATOM 1337 O HIS 173 11.840 30.765 13.631 1.00 0.00 ATOM 1338 C HIS 173 13.013 30.417 13.669 1.00 0.00 ATOM 1339 N LEU 174 14.000 31.103 13.098 1.00 0.00 ATOM 1340 CA LEU 174 13.782 32.383 12.428 1.00 0.00 ATOM 1341 CB LEU 174 14.615 33.480 13.113 1.00 0.00 ATOM 1342 CG LEU 174 14.094 33.887 14.498 1.00 0.00 ATOM 1343 CD1 LEU 174 15.209 34.484 15.329 1.00 0.00 ATOM 1344 CD2 LEU 174 12.894 34.848 14.413 1.00 0.00 ATOM 1345 O LEU 174 14.936 31.558 10.474 1.00 0.00 ATOM 1346 C LEU 174 14.087 32.328 10.936 1.00 0.00 ATOM 1347 N GLU 175 13.377 33.150 10.190 1.00 0.00 ATOM 1348 CA GLU 175 13.673 33.357 8.786 1.00 0.00 ATOM 1349 CB GLU 175 12.378 33.462 7.976 1.00 0.00 ATOM 1350 CG GLU 175 11.611 32.134 7.815 1.00 0.00 ATOM 1351 CD GLU 175 10.161 32.327 7.314 1.00 0.00 ATOM 1352 OE1 GLU 175 9.658 33.471 7.301 1.00 0.00 ATOM 1353 OE2 GLU 175 9.524 31.334 6.913 1.00 0.00 ATOM 1354 O GLU 175 14.319 35.577 9.427 1.00 0.00 ATOM 1355 C GLU 175 14.486 34.640 8.658 1.00 0.00 ATOM 1356 N LYS 176 15.365 34.669 7.678 1.00 0.00 ATOM 1357 CA LYS 176 16.229 35.809 7.396 1.00 0.00 ATOM 1358 CB LYS 176 16.927 35.585 6.046 1.00 0.00 ATOM 1359 CG LYS 176 17.993 36.632 5.714 1.00 0.00 ATOM 1360 CD LYS 176 19.369 36.170 6.226 1.00 0.00 ATOM 1361 CE LYS 176 20.181 37.363 6.713 1.00 0.00 ATOM 1362 NZ LYS 176 21.620 36.996 6.699 1.00 0.00 ATOM 1363 O LYS 176 16.052 38.093 8.182 1.00 0.00 ATOM 1364 C LYS 176 15.565 37.205 7.468 1.00 0.00 ATOM 1365 N PRO 177 14.444 37.416 6.763 1.00 0.00 ATOM 1366 CA PRO 177 13.800 38.747 6.927 1.00 0.00 ATOM 1367 CB PRO 177 12.507 38.620 6.109 1.00 0.00 ATOM 1368 CG PRO 177 12.800 37.565 5.107 1.00 0.00 ATOM 1369 CD PRO 177 13.702 36.572 5.805 1.00 0.00 ATOM 1370 O PRO 177 13.464 40.309 8.684 1.00 0.00 ATOM 1371 C PRO 177 13.454 39.116 8.350 1.00 0.00 ATOM 1372 N GLU 178 13.127 38.129 9.192 1.00 0.00 ATOM 1373 CA GLU 178 12.813 38.421 10.603 1.00 0.00 ATOM 1374 CB GLU 178 12.277 37.189 11.325 1.00 0.00 ATOM 1375 CG GLU 178 10.795 37.049 11.394 1.00 0.00 ATOM 1376 CD GLU 178 10.260 36.737 12.852 1.00 0.00 ATOM 1377 OE1 GLU 178 10.418 37.554 13.825 1.00 0.00 ATOM 1378 OE2 GLU 178 9.622 35.656 12.976 1.00 0.00 ATOM 1379 O GLU 178 14.034 39.879 12.090 1.00 0.00 ATOM 1380 C GLU 178 14.068 38.890 11.345 1.00 0.00 ATOM 1381 N VAL 179 15.162 38.158 11.136 1.00 0.00 ATOM 1382 CA VAL 179 16.471 38.504 11.702 1.00 0.00 ATOM 1383 CB VAL 179 17.542 37.505 11.215 1.00 0.00 ATOM 1384 CG1 VAL 179 18.953 37.989 11.520 1.00 0.00 ATOM 1385 CG2 VAL 179 17.263 36.113 11.813 1.00 0.00 ATOM 1386 O VAL 179 17.176 40.721 12.275 1.00 0.00 ATOM 1387 C VAL 179 16.791 39.982 11.388 1.00 0.00 ATOM 1388 N ARG 180 16.552 40.412 10.147 1.00 0.00 ATOM 1389 CA ARG 180 16.713 41.817 9.772 1.00 0.00 ATOM 1390 CB ARG 180 16.638 41.986 8.259 1.00 0.00 ATOM 1391 CG ARG 180 17.608 41.095 7.538 1.00 0.00 ATOM 1392 CD ARG 180 18.186 41.778 6.329 1.00 0.00 ATOM 1393 NE ARG 180 19.364 42.577 6.666 1.00 0.00 ATOM 1394 CZ ARG 180 20.621 42.285 6.331 1.00 0.00 ATOM 1395 NH1 ARG 180 21.570 43.120 6.699 1.00 0.00 ATOM 1396 NH2 ARG 180 20.920 41.192 5.634 1.00 0.00 ATOM 1397 O ARG 180 16.088 43.872 10.808 1.00 0.00 ATOM 1398 C ARG 180 15.726 42.751 10.450 1.00 0.00 ATOM 1399 N ARG 181 14.483 42.309 10.632 1.00 0.00 ATOM 1400 CA ARG 181 13.508 43.130 11.368 1.00 0.00 ATOM 1401 CB ARG 181 12.094 42.568 11.247 1.00 0.00 ATOM 1402 CG ARG 181 11.038 43.536 11.813 1.00 0.00 ATOM 1403 CD ARG 181 9.708 42.890 12.247 1.00 0.00 ATOM 1404 NE ARG 181 9.849 41.551 12.846 1.00 0.00 ATOM 1405 CZ ARG 181 10.062 41.295 14.132 1.00 0.00 ATOM 1406 NH1 ARG 181 10.189 42.264 15.014 1.00 0.00 ATOM 1407 NH2 ARG 181 10.158 40.047 14.531 1.00 0.00 ATOM 1408 O ARG 181 13.855 44.329 13.424 1.00 0.00 ATOM 1409 C ARG 181 13.915 43.257 12.840 1.00 0.00 ATOM 1410 N LEU 182 14.340 42.154 13.442 1.00 0.00 ATOM 1411 CA LEU 182 14.813 42.192 14.833 1.00 0.00 ATOM 1412 CB LEU 182 15.161 40.790 15.362 1.00 0.00 ATOM 1413 CG LEU 182 13.941 39.876 15.517 1.00 0.00 ATOM 1414 CD1 LEU 182 14.382 38.411 15.558 1.00 0.00 ATOM 1415 CD2 LEU 182 13.177 40.279 16.758 1.00 0.00 ATOM 1416 O LEU 182 16.085 43.857 15.960 1.00 0.00 ATOM 1417 C LEU 182 16.001 43.132 14.986 1.00 0.00 ATOM 1418 N ALA 183 16.904 43.112 14.010 1.00 0.00 ATOM 1419 CA ALA 183 18.083 43.970 14.048 1.00 0.00 ATOM 1420 CB ALA 183 19.076 43.575 12.962 1.00 0.00 ATOM 1421 O ALA 183 18.204 46.298 14.694 1.00 0.00 ATOM 1422 C ALA 183 17.701 45.457 13.944 1.00 0.00 ATOM 1423 N GLU 184 16.804 45.762 13.016 1.00 0.00 ATOM 1424 CA GLU 184 16.401 47.129 12.772 1.00 0.00 ATOM 1425 CB GLU 184 15.537 47.224 11.506 1.00 0.00 ATOM 1426 CG GLU 184 14.840 48.591 11.300 1.00 0.00 ATOM 1427 CD GLU 184 14.108 48.673 9.960 1.00 0.00 ATOM 1428 OE1 GLU 184 12.944 49.123 9.926 1.00 0.00 ATOM 1429 OE2 GLU 184 14.694 48.270 8.939 1.00 0.00 ATOM 1430 O GLU 184 15.961 48.793 14.404 1.00 0.00 ATOM 1431 C GLU 184 15.685 47.665 13.973 1.00 0.00 ATOM 1432 N GLU 185 14.783 46.869 14.555 1.00 0.00 ATOM 1433 CA GLU 185 14.035 47.352 15.742 1.00 0.00 ATOM 1434 CB GLU 185 12.860 46.452 16.084 1.00 0.00 ATOM 1435 CG GLU 185 11.754 46.451 15.043 1.00 0.00 ATOM 1436 CD GLU 185 10.763 45.302 15.261 1.00 0.00 ATOM 1437 OE1 GLU 185 10.992 44.483 16.194 1.00 0.00 ATOM 1438 OE2 GLU 185 9.779 45.200 14.493 1.00 0.00 ATOM 1439 O GLU 185 14.653 48.348 17.816 1.00 0.00 ATOM 1440 C GLU 185 14.933 47.532 16.957 1.00 0.00 ATOM 1441 N ALA 186 16.015 46.771 17.032 1.00 0.00 ATOM 1442 CA ALA 186 16.979 46.942 18.110 1.00 0.00 ATOM 1443 CB ALA 186 17.743 45.659 18.352 1.00 0.00 ATOM 1444 O ALA 186 18.756 48.436 18.669 1.00 0.00 ATOM 1445 C ALA 186 17.939 48.089 17.817 1.00 0.00 ATOM 1446 N GLY 187 17.838 48.671 16.619 1.00 0.00 ATOM 1447 CA GLY 187 18.753 49.726 16.181 1.00 0.00 ATOM 1448 O GLY 187 21.130 50.069 16.292 1.00 0.00 ATOM 1449 C GLY 187 20.216 49.280 16.057 1.00 0.00 ATOM 1450 N LEU 188 20.435 48.024 15.682 1.00 0.00 ATOM 1451 CA LEU 188 21.784 47.509 15.569 1.00 0.00 ATOM 1452 CB LEU 188 21.791 45.986 15.490 1.00 0.00 ATOM 1453 CG LEU 188 21.219 45.137 16.618 1.00 0.00 ATOM 1454 CD1 LEU 188 21.516 43.697 16.327 1.00 0.00 ATOM 1455 CD2 LEU 188 21.794 45.523 17.958 1.00 0.00 ATOM 1456 O LEU 188 21.810 48.120 13.255 1.00 0.00 ATOM 1457 C LEU 188 22.434 48.081 14.324 1.00 0.00 ATOM 1458 N SER 189 23.695 48.502 14.440 1.00 0.00 ATOM 1459 CA SER 189 24.364 49.143 13.297 1.00 0.00 ATOM 1460 CB SER 189 25.661 49.837 13.713 1.00 0.00 ATOM 1461 OG SER 189 26.578 48.904 14.231 1.00 0.00 ATOM 1462 O SER 189 24.700 48.656 10.988 1.00 0.00 ATOM 1463 C SER 189 24.582 48.207 12.117 1.00 0.00 ATOM 1464 N THR 190 24.578 46.904 12.361 1.00 0.00 ATOM 1465 CA THR 190 24.664 45.950 11.280 1.00 0.00 ATOM 1466 CB THR 190 25.309 44.657 11.770 1.00 0.00 ATOM 1467 CG2 THR 190 26.803 44.905 12.135 1.00 0.00 ATOM 1468 OG1 THR 190 24.584 44.182 12.912 1.00 0.00 ATOM 1469 O THR 190 23.298 44.758 9.687 1.00 0.00 ATOM 1470 C THR 190 23.327 45.617 10.583 1.00 0.00 ATOM 1471 N ALA 191 22.240 46.284 10.976 1.00 0.00 ATOM 1472 CA ALA 191 20.880 45.942 10.500 1.00 0.00 ATOM 1473 CB ALA 191 19.836 46.895 11.084 1.00 0.00 ATOM 1474 O ALA 191 20.189 44.916 8.422 1.00 0.00 ATOM 1475 C ALA 191 20.760 45.876 8.989 1.00 0.00 ATOM 1476 N LYS 192 21.330 46.878 8.331 1.00 0.00 ATOM 1477 CA LYS 192 21.330 46.937 6.860 1.00 0.00 ATOM 1478 CB LYS 192 21.049 48.367 6.383 1.00 0.00 ATOM 1479 CG LYS 192 19.697 48.912 6.837 1.00 0.00 ATOM 1480 CD LYS 192 18.564 48.105 6.193 1.00 0.00 ATOM 1481 CE LYS 192 17.241 48.252 6.961 1.00 0.00 ATOM 1482 NZ LYS 192 16.056 48.101 6.026 1.00 0.00 ATOM 1483 O LYS 192 22.684 46.393 4.956 1.00 0.00 ATOM 1484 C LYS 192 22.582 46.351 6.173 1.00 0.00 ATOM 1485 N LYS 193 23.512 45.800 6.941 1.00 0.00 ATOM 1486 CA LYS 193 24.755 45.279 6.388 1.00 0.00 ATOM 1487 CB LYS 193 25.755 45.006 7.505 1.00 0.00 ATOM 1488 CG LYS 193 27.094 44.501 7.050 1.00 0.00 ATOM 1489 CD LYS 193 28.098 44.518 8.198 1.00 0.00 ATOM 1490 CE LYS 193 29.416 43.913 7.737 1.00 0.00 ATOM 1491 NZ LYS 193 30.349 43.678 8.859 1.00 0.00 ATOM 1492 O LYS 193 24.009 43.023 6.072 1.00 0.00 ATOM 1493 C LYS 193 24.527 44.019 5.568 1.00 0.00 ATOM 1494 N LYS 194 24.934 44.075 4.301 1.00 0.00 ATOM 1495 CA LYS 194 24.790 42.967 3.367 1.00 0.00 ATOM 1496 CB LYS 194 24.974 43.463 1.922 1.00 0.00 ATOM 1497 CG LYS 194 24.015 44.612 1.507 1.00 0.00 ATOM 1498 CD LYS 194 22.555 44.130 1.430 1.00 0.00 ATOM 1499 CE LYS 194 21.550 45.287 1.229 1.00 0.00 ATOM 1500 NZ LYS 194 21.261 46.140 2.458 1.00 0.00 ATOM 1501 O LYS 194 26.895 42.101 4.091 1.00 0.00 ATOM 1502 C LYS 194 25.769 41.856 3.684 1.00 0.00 ATOM 1503 N ASP 195 25.338 40.619 3.509 1.00 0.00 ATOM 1504 CA ASP 195 26.200 39.494 3.832 1.00 0.00 ATOM 1505 CB ASP 195 25.384 38.219 4.074 1.00 0.00 ATOM 1506 CG ASP 195 24.265 38.418 5.119 1.00 0.00 ATOM 1507 OD1 ASP 195 23.083 38.317 4.723 1.00 0.00 ATOM 1508 OD2 ASP 195 24.563 38.698 6.315 1.00 0.00 ATOM 1509 O ASP 195 26.952 39.475 1.550 1.00 0.00 ATOM 1510 C ASP 195 27.232 39.289 2.740 1.00 0.00 ATOM 1511 N SER 196 28.441 38.943 3.159 1.00 0.00 ATOM 1512 CA SER 196 29.528 38.692 2.227 1.00 0.00 ATOM 1513 CB SER 196 30.876 38.590 2.963 1.00 0.00 ATOM 1514 OG SER 196 30.707 38.087 4.289 1.00 0.00 ATOM 1515 O SER 196 28.709 36.449 2.091 1.00 0.00 ATOM 1516 C SER 196 29.206 37.409 1.490 1.00 0.00 ATOM 1517 N THR 197 29.445 37.420 0.181 1.00 0.00 ATOM 1518 CA THR 197 29.208 36.243 -0.650 1.00 0.00 ATOM 1519 CB THR 197 28.540 36.612 -1.989 1.00 0.00 ATOM 1520 CG2 THR 197 27.200 37.310 -1.739 1.00 0.00 ATOM 1521 OG1 THR 197 29.405 37.476 -2.742 1.00 0.00 ATOM 1522 O THR 197 31.622 35.989 -0.702 1.00 0.00 ATOM 1523 C THR 197 30.509 35.465 -0.892 1.00 0.00 ATOM 1524 N GLY 198 30.357 34.206 -1.292 1.00 0.00 ATOM 1525 CA GLY 198 31.501 33.350 -1.581 1.00 0.00 ATOM 1526 O GLY 198 31.763 33.248 0.799 1.00 0.00 ATOM 1527 C GLY 198 32.198 32.909 -0.309 1.00 0.00 ATOM 1528 N ILE 199 33.282 32.151 -0.475 1.00 0.00 ATOM 1529 CA ILE 199 34.077 31.698 0.662 1.00 0.00 ATOM 1530 CB ILE 199 35.240 30.719 0.257 1.00 0.00 ATOM 1531 CG1 ILE 199 34.901 29.866 -1.000 1.00 0.00 ATOM 1532 CG2 ILE 199 35.680 29.891 1.475 1.00 0.00 ATOM 1533 CD1 ILE 199 33.638 28.938 -0.899 1.00 0.00 ATOM 1534 O ILE 199 34.998 33.926 0.727 1.00 0.00 ATOM 1535 C ILE 199 34.662 32.917 1.371 1.00 0.00 ATOM 1536 N CYS 200 34.770 32.803 2.695 1.00 0.00 ATOM 1537 CA CYS 200 35.266 33.862 3.569 1.00 0.00 ATOM 1538 CB CYS 200 35.324 33.351 5.035 1.00 0.00 ATOM 1539 SG CYS 200 36.529 31.980 5.436 1.00 0.00 ATOM 1540 O CYS 200 36.691 35.704 2.899 1.00 0.00 ATOM 1541 C CYS 200 36.604 34.486 3.106 1.00 0.00 ATOM 1542 N PHE 201 37.616 33.637 2.904 1.00 0.00 ATOM 1543 CA PHE 201 38.980 34.071 2.583 1.00 0.00 ATOM 1544 CB PHE 201 39.991 32.952 2.878 1.00 0.00 ATOM 1545 CG PHE 201 39.688 31.645 2.204 1.00 0.00 ATOM 1546 CD1 PHE 201 39.316 30.544 2.949 1.00 0.00 ATOM 1547 CD2 PHE 201 39.791 31.502 0.830 1.00 0.00 ATOM 1548 CE1 PHE 201 39.030 29.317 2.333 1.00 0.00 ATOM 1549 CE2 PHE 201 39.499 30.288 0.205 1.00 0.00 ATOM 1550 CZ PHE 201 39.123 29.197 0.959 1.00 0.00 ATOM 1551 O PHE 201 40.160 35.396 0.950 1.00 0.00 ATOM 1552 C PHE 201 39.200 34.643 1.168 1.00 0.00 ATOM 1553 N ILE 202 38.342 34.281 0.208 1.00 0.00 ATOM 1554 CA ILE 202 38.397 34.898 -1.137 1.00 0.00 ATOM 1555 CB ILE 202 38.171 33.868 -2.365 1.00 0.00 ATOM 1556 CG1 ILE 202 37.424 34.500 -3.556 1.00 0.00 ATOM 1557 CG2 ILE 202 37.526 32.555 -1.926 1.00 0.00 ATOM 1558 CD1 ILE 202 35.895 34.328 -3.541 1.00 0.00 ATOM 1559 O ILE 202 37.971 37.166 -1.901 1.00 0.00 ATOM 1560 C ILE 202 37.591 36.226 -1.191 1.00 0.00 ATOM 1561 N GLY 203 36.504 36.294 -0.417 1.00 0.00 ATOM 1562 CA GLY 203 35.734 37.530 -0.256 1.00 0.00 ATOM 1563 O GLY 203 34.503 37.446 -2.308 1.00 0.00 ATOM 1564 C GLY 203 35.240 38.108 -1.570 1.00 0.00 ATOM 1565 N GLU 204 35.630 39.345 -1.859 1.00 0.00 ATOM 1566 CA GLU 204 35.211 40.011 -3.094 1.00 0.00 ATOM 1567 CB GLU 204 34.577 41.384 -2.792 1.00 0.00 ATOM 1568 CG GLU 204 33.030 41.407 -2.783 1.00 0.00 ATOM 1569 CD GLU 204 32.393 40.426 -1.799 1.00 0.00 ATOM 1570 OE1 GLU 204 32.452 40.670 -0.577 1.00 0.00 ATOM 1571 OE2 GLU 204 31.812 39.417 -2.253 1.00 0.00 ATOM 1572 O GLU 204 36.257 40.876 -5.094 1.00 0.00 ATOM 1573 C GLU 204 36.338 40.094 -4.140 1.00 0.00 ATOM 1574 N LYS 205 37.383 39.283 -3.955 1.00 0.00 ATOM 1575 CA LYS 205 38.436 39.125 -4.971 1.00 0.00 ATOM 1576 CB LYS 205 39.863 39.100 -4.373 1.00 0.00 ATOM 1577 CG LYS 205 40.099 38.147 -3.203 1.00 0.00 ATOM 1578 CD LYS 205 41.440 38.425 -2.486 1.00 0.00 ATOM 1579 CE LYS 205 41.623 37.473 -1.279 1.00 0.00 ATOM 1580 NZ LYS 205 43.058 37.290 -0.839 1.00 0.00 ATOM 1581 O LYS 205 37.480 37.033 -5.683 1.00 0.00 ATOM 1582 C LYS 205 38.165 38.010 -5.980 1.00 0.00 ATOM 1583 N ASN 206 38.675 38.224 -7.187 1.00 0.00 ATOM 1584 CA ASN 206 38.525 37.333 -8.317 1.00 0.00 ATOM 1585 CB ASN 206 39.286 37.948 -9.491 1.00 0.00 ATOM 1586 CG ASN 206 39.071 37.214 -10.789 1.00 0.00 ATOM 1587 ND2 ASN 206 38.211 37.761 -11.640 1.00 0.00 ATOM 1588 OD1 ASN 206 39.704 36.193 -11.050 1.00 0.00 ATOM 1589 O ASN 206 40.158 35.738 -7.558 1.00 0.00 ATOM 1590 C ASN 206 39.022 35.917 -7.993 1.00 0.00 ATOM 1591 N PHE 207 38.158 34.923 -8.195 1.00 0.00 ATOM 1592 CA PHE 207 38.454 33.555 -7.799 1.00 0.00 ATOM 1593 CB PHE 207 37.229 32.662 -7.953 1.00 0.00 ATOM 1594 CG PHE 207 37.489 31.240 -7.574 1.00 0.00 ATOM 1595 CD1 PHE 207 37.424 30.843 -6.239 1.00 0.00 ATOM 1596 CD2 PHE 207 37.851 30.299 -8.545 1.00 0.00 ATOM 1597 CE1 PHE 207 37.694 29.527 -5.876 1.00 0.00 ATOM 1598 CE2 PHE 207 38.118 28.970 -8.188 1.00 0.00 ATOM 1599 CZ PHE 207 38.042 28.589 -6.853 1.00 0.00 ATOM 1600 O PHE 207 40.467 32.237 -7.947 1.00 0.00 ATOM 1601 C PHE 207 39.635 32.926 -8.542 1.00 0.00 ATOM 1602 N LYS 208 39.693 33.153 -9.847 1.00 0.00 ATOM 1603 CA LYS 208 40.735 32.584 -10.650 1.00 0.00 ATOM 1604 CB LYS 208 40.492 32.897 -12.128 1.00 0.00 ATOM 1605 CG LYS 208 41.345 32.062 -13.082 1.00 0.00 ATOM 1606 CD LYS 208 41.710 32.823 -14.327 1.00 0.00 ATOM 1607 CE LYS 208 42.557 31.947 -15.230 1.00 0.00 ATOM 1608 NZ LYS 208 43.068 32.719 -16.402 1.00 0.00 ATOM 1609 O LYS 208 43.088 32.398 -10.121 1.00 0.00 ATOM 1610 C LYS 208 42.089 33.129 -10.189 1.00 0.00 ATOM 1611 N ASN 209 42.105 34.422 -9.879 1.00 0.00 ATOM 1612 CA ASN 209 43.310 35.108 -9.459 1.00 0.00 ATOM 1613 CB ASN 209 43.072 36.618 -9.408 1.00 0.00 ATOM 1614 CG ASN 209 43.007 37.256 -10.795 1.00 0.00 ATOM 1615 ND2 ASN 209 42.408 38.445 -10.859 1.00 0.00 ATOM 1616 OD1 ASN 209 43.490 36.697 -11.791 1.00 0.00 ATOM 1617 O ASN 209 44.925 34.317 -7.889 1.00 0.00 ATOM 1618 C ASN 209 43.748 34.599 -8.105 1.00 0.00 ATOM 1619 N PHE 210 42.785 34.458 -7.209 1.00 0.00 ATOM 1620 CA PHE 210 43.047 33.975 -5.868 1.00 0.00 ATOM 1621 CB PHE 210 41.748 33.872 -5.050 1.00 0.00 ATOM 1622 CG PHE 210 41.961 33.303 -3.682 1.00 0.00 ATOM 1623 CD1 PHE 210 42.488 34.096 -2.663 1.00 0.00 ATOM 1624 CD2 PHE 210 41.684 31.958 -3.420 1.00 0.00 ATOM 1625 CE1 PHE 210 42.731 33.571 -1.390 1.00 0.00 ATOM 1626 CE2 PHE 210 41.909 31.421 -2.164 1.00 0.00 ATOM 1627 CZ PHE 210 42.440 32.237 -1.134 1.00 0.00 ATOM 1628 O PHE 210 44.838 32.490 -5.266 1.00 0.00 ATOM 1629 C PHE 210 43.764 32.629 -5.858 1.00 0.00 ATOM 1630 N LEU 211 43.129 31.658 -6.507 1.00 0.00 ATOM 1631 CA LEU 211 43.557 30.267 -6.538 1.00 0.00 ATOM 1632 CB LEU 211 42.472 29.437 -7.221 1.00 0.00 ATOM 1633 CG LEU 211 42.511 27.938 -6.990 1.00 0.00 ATOM 1634 CD1 LEU 211 42.630 27.676 -5.504 1.00 0.00 ATOM 1635 CD2 LEU 211 41.232 27.347 -7.536 1.00 0.00 ATOM 1636 O LEU 211 45.727 29.288 -6.775 1.00 0.00 ATOM 1637 C LEU 211 44.894 30.063 -7.226 1.00 0.00 ATOM 1638 N SER 212 45.103 30.795 -8.308 1.00 0.00 ATOM 1639 CA SER 212 46.366 30.764 -9.023 1.00 0.00 ATOM 1640 CB SER 212 46.235 31.468 -10.381 1.00 0.00 ATOM 1641 OG SER 212 45.918 32.839 -10.198 1.00 0.00 ATOM 1642 O SER 212 48.700 31.139 -8.642 1.00 0.00 ATOM 1643 C SER 212 47.558 31.326 -8.232 1.00 0.00 ATOM 1644 N ASN 213 47.294 32.031 -7.133 1.00 0.00 ATOM 1645 CA ASN 213 48.355 32.444 -6.208 1.00 0.00 ATOM 1646 CB ASN 213 47.861 33.529 -5.237 1.00 0.00 ATOM 1647 CG ASN 213 47.490 34.833 -5.937 1.00 0.00 ATOM 1648 ND2 ASN 213 46.465 35.503 -5.422 1.00 0.00 ATOM 1649 OD1 ASN 213 48.118 35.234 -6.916 1.00 0.00 ATOM 1650 O ASN 213 50.016 31.305 -4.891 1.00 0.00 ATOM 1651 C ASN 213 48.907 31.249 -5.416 1.00 0.00 ATOM 1652 N TYR 214 48.128 30.171 -5.345 1.00 0.00 ATOM 1653 CA TYR 214 48.486 29.006 -4.533 1.00 0.00 ATOM 1654 CB TYR 214 47.414 28.734 -3.465 1.00 0.00 ATOM 1655 CG TYR 214 47.178 29.915 -2.566 1.00 0.00 ATOM 1656 CD1 TYR 214 48.053 30.202 -1.503 1.00 0.00 ATOM 1657 CD2 TYR 214 46.106 30.769 -2.793 1.00 0.00 ATOM 1658 CE1 TYR 214 47.846 31.308 -0.679 1.00 0.00 ATOM 1659 CE2 TYR 214 45.882 31.874 -1.970 1.00 0.00 ATOM 1660 CZ TYR 214 46.753 32.141 -0.918 1.00 0.00 ATOM 1661 OH TYR 214 46.516 33.240 -0.122 1.00 0.00 ATOM 1662 O TYR 214 49.524 26.924 -4.980 1.00 0.00 ATOM 1663 C TYR 214 48.706 27.758 -5.344 1.00 0.00 ATOM 1664 N LEU 215 47.964 27.611 -6.433 1.00 0.00 ATOM 1665 CA LEU 215 48.102 26.416 -7.239 1.00 0.00 ATOM 1666 CB LEU 215 46.800 25.628 -7.248 1.00 0.00 ATOM 1667 CG LEU 215 46.399 25.005 -5.915 1.00 0.00 ATOM 1668 CD1 LEU 215 44.982 24.450 -6.012 1.00 0.00 ATOM 1669 CD2 LEU 215 47.425 23.948 -5.453 1.00 0.00 ATOM 1670 O LEU 215 47.984 27.672 -9.253 1.00 0.00 ATOM 1671 C LEU 215 48.530 26.746 -8.647 1.00 0.00 ATOM 1672 N PRO 216 49.512 25.989 -9.180 1.00 0.00 ATOM 1673 CA PRO 216 49.877 26.244 -10.564 1.00 0.00 ATOM 1674 CB PRO 216 51.084 25.330 -10.796 1.00 0.00 ATOM 1675 CG PRO 216 50.960 24.258 -9.769 1.00 0.00 ATOM 1676 CD PRO 216 50.275 24.875 -8.592 1.00 0.00 ATOM 1677 O PRO 216 48.118 24.742 -11.265 1.00 0.00 ATOM 1678 C PRO 216 48.698 25.837 -11.440 1.00 0.00 ATOM 1679 N ALA 217 48.295 26.742 -12.324 1.00 0.00 ATOM 1680 CA ALA 217 47.293 26.386 -13.308 1.00 0.00 ATOM 1681 CB ALA 217 46.384 27.559 -13.667 1.00 0.00 ATOM 1682 O ALA 217 49.061 26.411 -14.990 1.00 0.00 ATOM 1683 C ALA 217 48.039 25.861 -14.523 1.00 0.00 ATOM 1684 N GLN 218 47.531 24.740 -14.988 1.00 0.00 ATOM 1685 CA GLN 218 48.086 24.064 -16.101 1.00 0.00 ATOM 1686 CB GLN 218 48.671 22.718 -15.651 1.00 0.00 ATOM 1687 CG GLN 218 48.058 22.159 -14.348 1.00 0.00 ATOM 1688 CD GLN 218 48.986 21.208 -13.565 1.00 0.00 ATOM 1689 OE1 GLN 218 50.109 20.906 -13.983 1.00 0.00 ATOM 1690 NE2 GLN 218 48.504 20.746 -12.415 1.00 0.00 ATOM 1691 O GLN 218 46.030 23.093 -16.842 1.00 0.00 ATOM 1692 C GLN 218 46.895 23.951 -17.034 1.00 0.00 ATOM 1693 N PRO 219 46.793 24.896 -17.995 1.00 0.00 ATOM 1694 CA PRO 219 45.795 24.786 -19.061 1.00 0.00 ATOM 1695 CB PRO 219 46.118 25.971 -19.994 1.00 0.00 ATOM 1696 CG PRO 219 47.443 26.483 -19.563 1.00 0.00 ATOM 1697 CD PRO 219 47.587 26.136 -18.119 1.00 0.00 ATOM 1698 O PRO 219 47.072 22.944 -19.898 1.00 0.00 ATOM 1699 C PRO 219 45.956 23.466 -19.792 1.00 0.00 ATOM 1700 N GLY 220 44.843 22.913 -20.252 1.00 0.00 ATOM 1701 CA GLY 220 44.875 21.674 -21.007 1.00 0.00 ATOM 1702 O GLY 220 43.304 22.749 -22.406 1.00 0.00 ATOM 1703 C GLY 220 43.799 21.689 -22.048 1.00 0.00 ATOM 1704 N ARG 221 43.416 20.509 -22.516 1.00 0.00 ATOM 1705 CA ARG 221 42.495 20.388 -23.641 1.00 0.00 ATOM 1706 CB ARG 221 42.925 19.297 -24.637 1.00 0.00 ATOM 1707 CG ARG 221 44.323 19.446 -25.265 1.00 0.00 ATOM 1708 CD ARG 221 44.694 20.873 -25.658 1.00 0.00 ATOM 1709 NE ARG 221 43.765 21.441 -26.631 1.00 0.00 ATOM 1710 CZ ARG 221 43.843 22.671 -27.143 1.00 0.00 ATOM 1711 NH1 ARG 221 44.815 23.497 -26.787 1.00 0.00 ATOM 1712 NH2 ARG 221 42.942 23.071 -28.028 1.00 0.00 ATOM 1713 O ARG 221 40.762 19.523 -22.230 1.00 0.00 ATOM 1714 C ARG 221 41.055 20.178 -23.210 1.00 0.00 ATOM 1715 N MET 222 40.160 20.731 -23.992 1.00 0.00 ATOM 1716 CA MET 222 38.756 20.650 -23.731 1.00 0.00 ATOM 1717 CB MET 222 38.214 22.054 -23.897 1.00 0.00 ATOM 1718 CG MET 222 36.969 22.372 -23.227 1.00 0.00 ATOM 1719 SD MET 222 36.713 24.326 -23.375 1.00 0.00 ATOM 1720 CE MET 222 37.386 24.954 -21.711 1.00 0.00 ATOM 1721 O MET 222 38.631 19.895 -25.982 1.00 0.00 ATOM 1722 C MET 222 38.251 19.730 -24.837 1.00 0.00 ATOM 1723 N MET 223 37.419 18.754 -24.501 1.00 0.00 ATOM 1724 CA MET 223 36.980 17.737 -25.463 1.00 0.00 ATOM 1725 CB MET 223 37.687 16.374 -25.250 1.00 0.00 ATOM 1726 CG MET 223 39.190 16.389 -25.198 1.00 0.00 ATOM 1727 SD MET 223 39.967 16.609 -26.924 1.00 0.00 ATOM 1728 CE MET 223 41.809 16.069 -26.494 1.00 0.00 ATOM 1729 O MET 223 34.973 17.618 -24.210 1.00 0.00 ATOM 1730 C MET 223 35.509 17.496 -25.294 1.00 0.00 ATOM 1731 N THR 224 34.850 17.138 -26.375 1.00 0.00 ATOM 1732 CA THR 224 33.515 16.606 -26.251 1.00 0.00 ATOM 1733 CB THR 224 32.681 16.742 -27.529 1.00 0.00 ATOM 1734 CG2 THR 224 32.651 18.187 -28.039 1.00 0.00 ATOM 1735 OG1 THR 224 33.212 15.858 -28.528 1.00 0.00 ATOM 1736 O THR 224 34.758 14.550 -26.086 1.00 0.00 ATOM 1737 C THR 224 33.665 15.139 -25.948 1.00 0.00 ATOM 1738 N VAL 225 32.547 14.552 -25.536 1.00 0.00 ATOM 1739 CA VAL 225 32.471 13.135 -25.179 1.00 0.00 ATOM 1740 CB VAL 225 31.098 12.832 -24.492 1.00 0.00 ATOM 1741 CG1 VAL 225 30.821 11.376 -24.399 1.00 0.00 ATOM 1742 CG2 VAL 225 31.108 13.403 -23.080 1.00 0.00 ATOM 1743 O VAL 225 33.224 11.058 -26.089 1.00 0.00 ATOM 1744 C VAL 225 32.834 12.191 -26.342 1.00 0.00 ATOM 1745 N ASP 226 32.740 12.659 -27.595 1.00 0.00 ATOM 1746 CA ASP 226 33.139 11.849 -28.778 1.00 0.00 ATOM 1747 CB ASP 226 32.246 12.063 -30.014 1.00 0.00 ATOM 1748 CG ASP 226 30.783 12.245 -29.678 1.00 0.00 ATOM 1749 OD1 ASP 226 30.197 11.397 -28.954 1.00 0.00 ATOM 1750 OD2 ASP 226 30.215 13.263 -30.146 1.00 0.00 ATOM 1751 O ASP 226 35.005 11.764 -30.285 1.00 0.00 ATOM 1752 C ASP 226 34.560 12.165 -29.196 1.00 0.00 ATOM 1753 N GLY 227 35.260 12.908 -28.353 1.00 0.00 ATOM 1754 CA GLY 227 36.682 13.122 -28.514 1.00 0.00 ATOM 1755 O GLY 227 38.287 14.451 -29.612 1.00 0.00 ATOM 1756 C GLY 227 37.109 14.321 -29.322 1.00 0.00 ATOM 1757 N ARG 228 36.176 15.200 -29.692 1.00 0.00 ATOM 1758 CA ARG 228 36.525 16.353 -30.534 1.00 0.00 ATOM 1759 CB ARG 228 35.325 16.829 -31.359 1.00 0.00 ATOM 1760 CG ARG 228 35.669 17.494 -32.696 1.00 0.00 ATOM 1761 CD ARG 228 35.977 19.006 -32.604 1.00 0.00 ATOM 1762 NE ARG 228 37.420 19.325 -32.600 1.00 0.00 ATOM 1763 CZ ARG 228 38.057 20.081 -33.502 1.00 0.00 ATOM 1764 NH1 ARG 228 37.393 20.657 -34.517 1.00 0.00 ATOM 1765 NH2 ARG 228 39.363 20.297 -33.367 1.00 0.00 ATOM 1766 O ARG 228 36.406 17.947 -28.725 1.00 0.00 ATOM 1767 C ARG 228 37.070 17.497 -29.678 1.00 0.00 ATOM 1768 N ASP 229 38.279 17.948 -30.031 1.00 0.00 ATOM 1769 CA ASP 229 38.964 19.024 -29.321 1.00 0.00 ATOM 1770 CB ASP 229 40.406 19.196 -29.809 1.00 0.00 ATOM 1771 CG ASP 229 41.221 20.134 -28.906 1.00 0.00 ATOM 1772 OD1 ASP 229 42.050 19.636 -28.119 1.00 0.00 ATOM 1773 OD2 ASP 229 41.019 21.370 -28.965 1.00 0.00 ATOM 1774 O ASP 229 37.926 20.774 -30.584 1.00 0.00 ATOM 1775 C ASP 229 38.204 20.344 -29.474 1.00 0.00 ATOM 1776 N MET 230 37.915 20.989 -28.354 1.00 0.00 ATOM 1777 CA MET 230 37.063 22.153 -28.340 1.00 0.00 ATOM 1778 CB MET 230 35.891 21.950 -27.375 1.00 0.00 ATOM 1779 CG MET 230 34.885 20.916 -27.833 1.00 0.00 ATOM 1780 SD MET 230 33.925 21.411 -29.484 1.00 0.00 ATOM 1781 CE MET 230 35.032 20.677 -30.807 1.00 0.00 ATOM 1782 O MET 230 37.214 24.455 -27.815 1.00 0.00 ATOM 1783 C MET 230 37.820 23.405 -27.965 1.00 0.00 ATOM 1784 N GLY 231 39.138 23.297 -27.812 1.00 0.00 ATOM 1785 CA GLY 231 39.947 24.423 -27.349 1.00 0.00 ATOM 1786 O GLY 231 40.684 23.002 -25.524 1.00 0.00 ATOM 1787 C GLY 231 40.656 24.142 -26.036 1.00 0.00 ATOM 1788 N GLU 232 41.245 25.195 -25.493 1.00 0.00 ATOM 1789 CA GLU 232 42.001 25.111 -24.256 1.00 0.00 ATOM 1790 CB GLU 232 43.219 26.012 -24.398 1.00 0.00 ATOM 1791 CG GLU 232 44.228 25.926 -23.296 1.00 0.00 ATOM 1792 CD GLU 232 45.428 26.800 -23.600 1.00 0.00 ATOM 1793 OE1 GLU 232 45.303 28.028 -23.454 1.00 0.00 ATOM 1794 OE2 GLU 232 46.491 26.268 -24.001 1.00 0.00 ATOM 1795 O GLU 232 40.487 26.579 -23.137 1.00 0.00 ATOM 1796 C GLU 232 41.155 25.549 -23.066 1.00 0.00 ATOM 1797 N HIS 233 41.165 24.771 -21.986 1.00 0.00 ATOM 1798 CA HIS 233 40.635 25.250 -20.705 1.00 0.00 ATOM 1799 CB HIS 233 39.954 24.145 -19.896 1.00 0.00 ATOM 1800 CG HIS 233 40.877 23.047 -19.474 1.00 0.00 ATOM 1801 CD2 HIS 233 41.149 21.846 -20.035 1.00 0.00 ATOM 1802 ND1 HIS 233 41.659 23.128 -18.345 1.00 0.00 ATOM 1803 CE1 HIS 233 42.381 22.026 -18.232 1.00 0.00 ATOM 1804 NE2 HIS 233 42.086 21.231 -19.242 1.00 0.00 ATOM 1805 O HIS 233 42.938 25.756 -20.252 1.00 0.00 ATOM 1806 C HIS 233 41.762 25.898 -19.898 1.00 0.00 ATOM 1807 N ALA 234 41.392 26.597 -18.822 1.00 0.00 ATOM 1808 CA ALA 234 42.335 27.432 -18.062 1.00 0.00 ATOM 1809 CB ALA 234 41.621 28.670 -17.534 1.00 0.00 ATOM 1810 O ALA 234 44.115 27.138 -16.429 1.00 0.00 ATOM 1811 C ALA 234 43.071 26.679 -16.927 1.00 0.00 ATOM 1812 N GLY 235 42.540 25.509 -16.579 1.00 0.00 ATOM 1813 CA GLY 235 43.054 24.634 -15.535 1.00 0.00 ATOM 1814 O GLY 235 40.795 24.710 -14.787 1.00 0.00 ATOM 1815 C GLY 235 41.801 24.020 -14.941 1.00 0.00 ATOM 1816 N LEU 236 41.841 22.739 -14.606 1.00 0.00 ATOM 1817 CA LEU 236 40.639 22.005 -14.199 1.00 0.00 ATOM 1818 CB LEU 236 40.934 20.491 -14.108 1.00 0.00 ATOM 1819 CG LEU 236 41.248 19.744 -15.424 1.00 0.00 ATOM 1820 CD1 LEU 236 41.408 18.257 -15.192 1.00 0.00 ATOM 1821 CD2 LEU 236 40.148 19.973 -16.424 1.00 0.00 ATOM 1822 O LEU 236 38.783 22.372 -12.676 1.00 0.00 ATOM 1823 C LEU 236 40.005 22.518 -12.901 1.00 0.00 ATOM 1824 N MET 237 40.827 23.108 -12.038 1.00 0.00 ATOM 1825 CA MET 237 40.318 23.640 -10.774 1.00 0.00 ATOM 1826 CB MET 237 41.451 24.035 -9.811 1.00 0.00 ATOM 1827 CG MET 237 42.353 25.173 -10.243 1.00 0.00 ATOM 1828 SD MET 237 43.619 25.034 -11.044 1.00 0.00 ATOM 1829 CE MET 237 44.735 26.849 -9.873 1.00 0.00 ATOM 1830 O MET 237 38.398 24.945 -10.157 1.00 0.00 ATOM 1831 C MET 237 39.281 24.751 -10.987 1.00 0.00 ATOM 1832 N TYR 238 39.338 25.410 -12.136 1.00 0.00 ATOM 1833 CA TYR 238 38.410 26.505 -12.442 1.00 0.00 ATOM 1834 CB TYR 238 39.051 27.472 -13.440 1.00 0.00 ATOM 1835 CG TYR 238 40.322 27.996 -12.870 1.00 0.00 ATOM 1836 CD1 TYR 238 40.322 28.588 -11.600 1.00 0.00 ATOM 1837 CD2 TYR 238 41.514 27.863 -13.541 1.00 0.00 ATOM 1838 CE1 TYR 238 41.472 29.051 -11.033 1.00 0.00 ATOM 1839 CE2 TYR 238 42.680 28.338 -12.992 1.00 0.00 ATOM 1840 CZ TYR 238 42.640 28.924 -11.724 1.00 0.00 ATOM 1841 OH TYR 238 43.774 29.402 -11.139 1.00 0.00 ATOM 1842 O TYR 238 36.229 26.993 -13.279 1.00 0.00 ATOM 1843 C TYR 238 37.022 26.106 -12.926 1.00 0.00 ATOM 1844 N TYR 239 36.718 24.807 -12.915 1.00 0.00 ATOM 1845 CA TYR 239 35.464 24.283 -13.471 1.00 0.00 ATOM 1846 CB TYR 239 35.712 23.580 -14.819 1.00 0.00 ATOM 1847 CG TYR 239 36.447 24.465 -15.807 1.00 0.00 ATOM 1848 CD1 TYR 239 35.750 25.370 -16.622 1.00 0.00 ATOM 1849 CD2 TYR 239 37.849 24.435 -15.883 1.00 0.00 ATOM 1850 CE1 TYR 239 36.433 26.192 -17.515 1.00 0.00 ATOM 1851 CE2 TYR 239 38.524 25.258 -16.749 1.00 0.00 ATOM 1852 CZ TYR 239 37.811 26.133 -17.559 1.00 0.00 ATOM 1853 OH TYR 239 38.511 26.933 -18.415 1.00 0.00 ATOM 1854 O TYR 239 35.733 22.611 -11.876 1.00 0.00 ATOM 1855 C TYR 239 34.932 23.273 -12.526 1.00 0.00 ATOM 1856 N THR 240 33.610 23.126 -12.462 1.00 0.00 ATOM 1857 CA THR 240 32.995 22.073 -11.661 1.00 0.00 ATOM 1858 CB THR 240 32.067 22.592 -10.486 1.00 0.00 ATOM 1859 CG2 THR 240 31.978 21.558 -9.388 1.00 0.00 ATOM 1860 OG1 THR 240 32.541 23.829 -9.951 1.00 0.00 ATOM 1861 O THR 240 31.410 21.820 -13.405 1.00 0.00 ATOM 1862 C THR 240 32.059 21.271 -12.522 1.00 0.00 ATOM 1863 N ILE 241 31.904 19.997 -12.185 1.00 0.00 ATOM 1864 CA ILE 241 30.948 19.155 -12.883 1.00 0.00 ATOM 1865 CB ILE 241 30.827 17.754 -12.212 1.00 0.00 ATOM 1866 CG1 ILE 241 32.199 17.020 -12.194 1.00 0.00 ATOM 1867 CG2 ILE 241 29.742 16.914 -12.900 1.00 0.00 ATOM 1868 CD1 ILE 241 32.909 16.926 -13.593 1.00 0.00 ATOM 1869 O ILE 241 29.028 20.277 -11.924 1.00 0.00 ATOM 1870 C ILE 241 29.589 19.870 -12.956 1.00 0.00 ATOM 1871 N GLY 242 29.104 20.063 -14.175 1.00 0.00 ATOM 1872 CA GLY 242 27.752 20.523 -14.418 1.00 0.00 ATOM 1873 O GLY 242 26.541 22.444 -15.121 1.00 0.00 ATOM 1874 C GLY 242 27.630 21.974 -14.756 1.00 0.00 ATOM 1875 N GLN 243 28.731 22.702 -14.613 1.00 0.00 ATOM 1876 CA GLN 243 28.673 24.134 -14.749 1.00 0.00 ATOM 1877 CB GLN 243 29.953 24.804 -14.225 1.00 0.00 ATOM 1878 CG GLN 243 31.018 25.134 -15.260 1.00 0.00 ATOM 1879 CD GLN 243 32.215 25.869 -14.676 1.00 0.00 ATOM 1880 OE1 GLN 243 32.604 25.631 -13.532 1.00 0.00 ATOM 1881 NE2 GLN 243 32.820 26.747 -15.467 1.00 0.00 ATOM 1882 O GLN 243 28.833 23.830 -17.079 1.00 0.00 ATOM 1883 C GLN 243 28.388 24.500 -16.186 1.00 0.00 ATOM 1884 N ARG 244 27.617 25.563 -16.381 1.00 0.00 ATOM 1885 CA ARG 244 27.323 26.111 -17.669 1.00 0.00 ATOM 1886 CB ARG 244 25.944 26.762 -17.657 1.00 0.00 ATOM 1887 CG ARG 244 25.569 27.239 -19.007 1.00 0.00 ATOM 1888 CD ARG 244 25.171 28.669 -19.060 1.00 0.00 ATOM 1889 NE ARG 244 23.733 28.695 -19.196 1.00 0.00 ATOM 1890 CZ ARG 244 23.050 29.296 -20.146 1.00 0.00 ATOM 1891 NH1 ARG 244 23.615 30.036 -21.078 1.00 0.00 ATOM 1892 NH2 ARG 244 21.753 29.181 -20.105 1.00 0.00 ATOM 1893 O ARG 244 28.597 28.111 -17.203 1.00 0.00 ATOM 1894 C ARG 244 28.344 27.193 -18.005 1.00 0.00 ATOM 1895 N GLY 245 28.882 27.120 -19.219 1.00 0.00 ATOM 1896 CA GLY 245 29.929 28.031 -19.650 1.00 0.00 ATOM 1897 O GLY 245 31.382 26.903 -18.088 1.00 0.00 ATOM 1898 C GLY 245 31.152 27.918 -18.763 1.00 0.00 ATOM 1899 N GLY 246 31.942 28.973 -18.752 1.00 0.00 ATOM 1900 CA GLY 246 33.166 28.955 -17.975 1.00 0.00 ATOM 1901 O GLY 246 34.079 29.888 -19.946 1.00 0.00 ATOM 1902 C GLY 246 34.287 29.518 -18.798 1.00 0.00 ATOM 1903 N LEU 247 35.475 29.570 -18.202 1.00 0.00 ATOM 1904 CA LEU 247 36.642 30.189 -18.843 1.00 0.00 ATOM 1905 CB LEU 247 37.840 30.204 -17.871 1.00 0.00 ATOM 1906 CG LEU 247 37.643 31.045 -16.603 1.00 0.00 ATOM 1907 CD1 LEU 247 38.608 30.672 -15.463 1.00 0.00 ATOM 1908 CD2 LEU 247 37.716 32.542 -16.957 1.00 0.00 ATOM 1909 O LEU 247 37.317 28.296 -20.167 1.00 0.00 ATOM 1910 C LEU 247 36.978 29.485 -20.162 1.00 0.00 ATOM 1911 N GLY 248 36.841 30.209 -21.273 1.00 0.00 ATOM 1912 CA GLY 248 37.078 29.647 -22.610 1.00 0.00 ATOM 1913 O GLY 248 36.209 27.977 -24.094 1.00 0.00 ATOM 1914 C GLY 248 36.005 28.697 -23.124 1.00 0.00 ATOM 1915 N ILE 249 34.861 28.670 -22.469 1.00 0.00 ATOM 1916 CA ILE 249 33.754 27.898 -22.985 1.00 0.00 ATOM 1917 CB ILE 249 33.024 27.075 -21.900 1.00 0.00 ATOM 1918 CG1 ILE 249 34.010 26.226 -21.104 1.00 0.00 ATOM 1919 CG2 ILE 249 31.993 26.151 -22.534 1.00 0.00 ATOM 1920 CD1 ILE 249 33.359 25.188 -20.265 1.00 0.00 ATOM 1921 O ILE 249 31.787 29.284 -23.246 1.00 0.00 ATOM 1922 C ILE 249 32.817 28.835 -23.753 1.00 0.00 ATOM 1923 N GLY 250 33.276 29.178 -24.957 1.00 0.00 ATOM 1924 CA GLY 250 32.459 29.690 -26.059 1.00 0.00 ATOM 1925 O GLY 250 31.788 28.820 -28.195 1.00 0.00 ATOM 1926 C GLY 250 32.424 28.618 -27.149 1.00 0.00 ATOM 1927 N GLY 251 33.121 27.489 -26.899 1.00 0.00 ATOM 1928 CA GLY 251 33.038 26.264 -27.719 1.00 0.00 ATOM 1929 O GLY 251 32.994 27.146 -29.994 1.00 0.00 ATOM 1930 C GLY 251 33.509 26.354 -29.179 1.00 0.00 ATOM 1931 N ASP 256 26.165 26.257 -33.704 1.00 0.00 ATOM 1932 CA ASP 256 25.092 26.199 -32.692 1.00 0.00 ATOM 1933 CB ASP 256 25.089 24.823 -31.979 1.00 0.00 ATOM 1934 CG ASP 256 23.781 24.534 -31.196 1.00 0.00 ATOM 1935 OD1 ASP 256 23.596 23.383 -30.749 1.00 0.00 ATOM 1936 OD2 ASP 256 22.933 25.426 -31.014 1.00 0.00 ATOM 1937 O ASP 256 26.247 27.785 -31.244 1.00 0.00 ATOM 1938 C ASP 256 25.159 27.348 -31.659 1.00 0.00 ATOM 1939 N ASN 257 23.975 27.814 -31.248 1.00 0.00 ATOM 1940 CA ASN 257 23.818 28.862 -30.239 1.00 0.00 ATOM 1941 CB ASN 257 22.613 29.723 -30.618 1.00 0.00 ATOM 1942 CG ASN 257 22.976 30.846 -31.596 1.00 0.00 ATOM 1943 ND2 ASN 257 22.069 31.156 -32.555 1.00 0.00 ATOM 1944 OD1 ASN 257 24.055 31.447 -31.472 1.00 0.00 ATOM 1945 O ASN 257 23.882 29.177 -27.823 1.00 0.00 ATOM 1946 C ASN 257 23.686 28.379 -28.768 1.00 0.00 ATOM 1947 N ALA 258 23.346 27.095 -28.586 1.00 0.00 ATOM 1948 CA ALA 258 22.991 26.545 -27.274 1.00 0.00 ATOM 1949 CB ALA 258 22.253 25.203 -27.415 1.00 0.00 ATOM 1950 O ALA 258 25.360 26.301 -26.797 1.00 0.00 ATOM 1951 C ALA 258 24.208 26.416 -26.327 1.00 0.00 ATOM 1952 N PRO 259 23.964 26.463 -24.989 1.00 0.00 ATOM 1953 CA PRO 259 25.129 26.515 -24.131 1.00 0.00 ATOM 1954 CB PRO 259 24.581 27.110 -22.829 1.00 0.00 ATOM 1955 CG PRO 259 23.166 26.734 -22.791 1.00 0.00 ATOM 1956 CD PRO 259 22.707 26.530 -24.214 1.00 0.00 ATOM 1957 O PRO 259 25.161 24.097 -24.052 1.00 0.00 ATOM 1958 C PRO 259 25.783 25.160 -23.906 1.00 0.00 ATOM 1959 N TRP 260 27.054 25.244 -23.552 1.00 0.00 ATOM 1960 CA TRP 260 27.871 24.107 -23.254 1.00 0.00 ATOM 1961 CB TRP 260 29.235 24.295 -23.885 1.00 0.00 ATOM 1962 CG TRP 260 29.168 24.183 -25.353 1.00 0.00 ATOM 1963 CD1 TRP 260 28.824 25.172 -26.237 1.00 0.00 ATOM 1964 CD2 TRP 260 29.441 23.004 -26.151 1.00 0.00 ATOM 1965 CE2 TRP 260 29.250 23.361 -27.495 1.00 0.00 ATOM 1966 CE3 TRP 260 29.820 21.694 -25.852 1.00 0.00 ATOM 1967 NE1 TRP 260 28.874 24.682 -27.519 1.00 0.00 ATOM 1968 CZ2 TRP 260 29.431 22.447 -28.550 1.00 0.00 ATOM 1969 CZ3 TRP 260 29.992 20.766 -26.909 1.00 0.00 ATOM 1970 CH2 TRP 260 29.804 21.153 -28.230 1.00 0.00 ATOM 1971 O TRP 260 27.807 24.979 -21.033 1.00 0.00 ATOM 1972 C TRP 260 27.959 23.984 -21.743 1.00 0.00 ATOM 1973 N PHE 261 28.135 22.748 -21.278 1.00 0.00 ATOM 1974 CA PHE 261 28.302 22.427 -19.866 1.00 0.00 ATOM 1975 CB PHE 261 27.105 21.637 -19.328 1.00 0.00 ATOM 1976 CG PHE 261 25.793 22.388 -19.422 1.00 0.00 ATOM 1977 CD1 PHE 261 25.265 23.036 -18.313 1.00 0.00 ATOM 1978 CD2 PHE 261 25.083 22.434 -20.620 1.00 0.00 ATOM 1979 CE1 PHE 261 24.054 23.734 -18.399 1.00 0.00 ATOM 1980 CE2 PHE 261 23.861 23.161 -20.721 1.00 0.00 ATOM 1981 CZ PHE 261 23.357 23.796 -19.604 1.00 0.00 ATOM 1982 O PHE 261 30.009 20.961 -20.692 1.00 0.00 ATOM 1983 C PHE 261 29.564 21.593 -19.723 1.00 0.00 ATOM 1984 N VAL 262 30.145 21.632 -18.525 1.00 0.00 ATOM 1985 CA VAL 262 31.218 20.752 -18.149 1.00 0.00 ATOM 1986 CB VAL 262 32.012 21.324 -16.942 1.00 0.00 ATOM 1987 CG1 VAL 262 33.012 20.297 -16.455 1.00 0.00 ATOM 1988 CG2 VAL 262 32.733 22.652 -17.318 1.00 0.00 ATOM 1989 O VAL 262 29.803 19.351 -16.811 1.00 0.00 ATOM 1990 C VAL 262 30.583 19.420 -17.766 1.00 0.00 ATOM 1991 N VAL 263 30.933 18.356 -18.475 1.00 0.00 ATOM 1992 CA VAL 263 30.258 17.070 -18.273 1.00 0.00 ATOM 1993 CB VAL 263 29.512 16.582 -19.565 1.00 0.00 ATOM 1994 CG1 VAL 263 28.457 17.610 -19.982 1.00 0.00 ATOM 1995 CG2 VAL 263 30.486 16.333 -20.695 1.00 0.00 ATOM 1996 O VAL 263 30.732 14.889 -17.445 1.00 0.00 ATOM 1997 C VAL 263 31.172 16.002 -17.735 1.00 0.00 ATOM 1998 N GLY 264 32.447 16.327 -17.557 1.00 0.00 ATOM 1999 CA GLY 264 33.379 15.371 -16.936 1.00 0.00 ATOM 2000 O GLY 264 34.993 17.058 -17.380 1.00 0.00 ATOM 2001 C GLY 264 34.753 15.990 -16.837 1.00 0.00 ATOM 2002 N LYS 265 35.663 15.316 -16.154 1.00 0.00 ATOM 2003 CA LYS 265 37.043 15.756 -16.060 1.00 0.00 ATOM 2004 CB LYS 265 37.288 16.482 -14.743 1.00 0.00 ATOM 2005 CG LYS 265 36.896 17.961 -14.717 1.00 0.00 ATOM 2006 CD LYS 265 36.603 18.352 -13.274 1.00 0.00 ATOM 2007 CE LYS 265 36.946 19.786 -12.923 1.00 0.00 ATOM 2008 NZ LYS 265 37.090 19.891 -11.429 1.00 0.00 ATOM 2009 O LYS 265 37.480 13.434 -15.722 1.00 0.00 ATOM 2010 C LYS 265 37.919 14.529 -16.100 1.00 0.00 ATOM 2011 N ASP 266 39.149 14.715 -16.574 1.00 0.00 ATOM 2012 CA ASP 266 40.171 13.698 -16.495 1.00 0.00 ATOM 2013 CB ASP 266 40.306 12.935 -17.796 1.00 0.00 ATOM 2014 CG ASP 266 41.084 11.632 -17.633 1.00 0.00 ATOM 2015 OD1 ASP 266 41.945 11.488 -16.720 1.00 0.00 ATOM 2016 OD2 ASP 266 40.828 10.735 -18.452 1.00 0.00 ATOM 2017 O ASP 266 42.278 14.706 -16.992 1.00 0.00 ATOM 2018 C ASP 266 41.488 14.331 -16.133 1.00 0.00 ATOM 2019 N LEU 267 41.711 14.415 -14.833 1.00 0.00 ATOM 2020 CA LEU 267 42.915 14.936 -14.237 1.00 0.00 ATOM 2021 CB LEU 267 42.868 14.735 -12.724 1.00 0.00 ATOM 2022 CG LEU 267 43.887 15.470 -11.845 1.00 0.00 ATOM 2023 CD1 LEU 267 43.481 16.933 -11.687 1.00 0.00 ATOM 2024 CD2 LEU 267 44.007 14.803 -10.471 1.00 0.00 ATOM 2025 O LEU 267 45.138 14.986 -15.026 1.00 0.00 ATOM 2026 C LEU 267 44.153 14.294 -14.797 1.00 0.00 ATOM 2027 N SER 268 44.110 12.988 -15.051 1.00 0.00 ATOM 2028 CA SER 268 45.309 12.299 -15.525 1.00 0.00 ATOM 2029 CB SER 268 45.155 10.784 -15.414 1.00 0.00 ATOM 2030 OG SER 268 44.400 10.286 -16.501 1.00 0.00 ATOM 2031 O SER 268 46.933 12.554 -17.280 1.00 0.00 ATOM 2032 C SER 268 45.768 12.710 -16.945 1.00 0.00 ATOM 2033 N LYS 269 44.864 13.243 -17.761 1.00 0.00 ATOM 2034 CA LYS 269 45.236 13.776 -19.071 1.00 0.00 ATOM 2035 CB LYS 269 44.351 13.198 -20.173 1.00 0.00 ATOM 2036 CG LYS 269 44.405 11.692 -20.421 1.00 0.00 ATOM 2037 CD LYS 269 43.012 11.319 -20.934 1.00 0.00 ATOM 2038 CE LYS 269 42.943 9.999 -21.607 1.00 0.00 ATOM 2039 NZ LYS 269 43.012 8.921 -20.608 1.00 0.00 ATOM 2040 O LYS 269 45.311 15.919 -20.142 1.00 0.00 ATOM 2041 C LYS 269 45.086 15.291 -19.103 1.00 0.00 ATOM 2042 N ASN 270 44.683 15.871 -17.972 1.00 0.00 ATOM 2043 CA ASN 270 44.417 17.308 -17.878 1.00 0.00 ATOM 2044 CB ASN 270 45.714 18.113 -18.101 1.00 0.00 ATOM 2045 CG ASN 270 45.607 19.573 -17.642 1.00 0.00 ATOM 2046 ND2 ASN 270 44.692 19.859 -16.729 1.00 0.00 ATOM 2047 OD1 ASN 270 46.361 20.425 -18.110 1.00 0.00 ATOM 2048 O ASN 270 43.277 18.846 -19.399 1.00 0.00 ATOM 2049 C ASN 270 43.265 17.743 -18.823 1.00 0.00 ATOM 2050 N ILE 271 42.268 16.865 -18.965 1.00 0.00 ATOM 2051 CA ILE 271 41.155 17.096 -19.905 1.00 0.00 ATOM 2052 CB ILE 271 40.837 15.852 -20.783 1.00 0.00 ATOM 2053 CG1 ILE 271 41.922 15.667 -21.820 1.00 0.00 ATOM 2054 CG2 ILE 271 39.485 16.017 -21.529 1.00 0.00 ATOM 2055 CD1 ILE 271 41.780 14.417 -22.619 1.00 0.00 ATOM 2056 O ILE 271 39.485 16.991 -18.203 1.00 0.00 ATOM 2057 C ILE 271 39.885 17.549 -19.231 1.00 0.00 ATOM 2058 N LEU 272 39.254 18.554 -19.830 1.00 0.00 ATOM 2059 CA LEU 272 37.914 19.006 -19.456 1.00 0.00 ATOM 2060 CB LEU 272 37.858 20.542 -19.451 1.00 0.00 ATOM 2061 CG LEU 272 36.542 21.110 -18.902 1.00 0.00 ATOM 2062 CD1 LEU 272 36.386 20.826 -17.401 1.00 0.00 ATOM 2063 CD2 LEU 272 36.395 22.585 -19.182 1.00 0.00 ATOM 2064 O LEU 272 37.052 18.773 -21.674 1.00 0.00 ATOM 2065 C LEU 272 36.921 18.488 -20.495 1.00 0.00 ATOM 2066 N TYR 273 35.907 17.749 -20.069 1.00 0.00 ATOM 2067 CA TYR 273 34.915 17.264 -21.033 1.00 0.00 ATOM 2068 CB TYR 273 34.447 15.846 -20.676 1.00 0.00 ATOM 2069 CG TYR 273 35.470 14.792 -20.999 1.00 0.00 ATOM 2070 CD1 TYR 273 35.747 14.458 -22.327 1.00 0.00 ATOM 2071 CD2 TYR 273 36.133 14.095 -19.990 1.00 0.00 ATOM 2072 CE1 TYR 273 36.698 13.480 -22.656 1.00 0.00 ATOM 2073 CE2 TYR 273 37.098 13.079 -20.305 1.00 0.00 ATOM 2074 CZ TYR 273 37.363 12.797 -21.656 1.00 0.00 ATOM 2075 OH TYR 273 38.270 11.833 -22.027 1.00 0.00 ATOM 2076 O TYR 273 33.273 18.595 -19.971 1.00 0.00 ATOM 2077 C TYR 273 33.745 18.220 -21.030 1.00 0.00 ATOM 2078 N VAL 274 33.272 18.596 -22.212 1.00 0.00 ATOM 2079 CA VAL 274 32.148 19.514 -22.333 1.00 0.00 ATOM 2080 CB VAL 274 32.575 20.933 -22.854 1.00 0.00 ATOM 2081 CG1 VAL 274 33.531 21.596 -21.861 1.00 0.00 ATOM 2082 CG2 VAL 274 33.199 20.859 -24.264 1.00 0.00 ATOM 2083 O VAL 274 31.432 18.107 -24.127 1.00 0.00 ATOM 2084 C VAL 274 31.109 18.933 -23.265 1.00 0.00 ATOM 2085 N GLY 275 29.869 19.389 -23.116 1.00 0.00 ATOM 2086 CA GLY 275 28.785 18.866 -23.914 1.00 0.00 ATOM 2087 O GLY 275 27.529 20.581 -22.896 1.00 0.00 ATOM 2088 C GLY 275 27.609 19.784 -23.816 1.00 0.00 ATOM 2089 N GLN 276 26.692 19.675 -24.770 1.00 0.00 ATOM 2090 CA GLN 276 25.506 20.512 -24.788 1.00 0.00 ATOM 2091 CB GLN 276 25.203 20.948 -26.218 1.00 0.00 ATOM 2092 CG GLN 276 26.189 21.970 -26.704 1.00 0.00 ATOM 2093 CD GLN 276 25.823 22.539 -28.018 1.00 0.00 ATOM 2094 OE1 GLN 276 25.670 21.815 -28.991 1.00 0.00 ATOM 2095 NE2 GLN 276 25.681 23.860 -28.074 1.00 0.00 ATOM 2096 O GLN 276 24.213 18.593 -24.174 1.00 0.00 ATOM 2097 C GLN 276 24.311 19.815 -24.153 1.00 0.00 ATOM 2098 N GLY 277 23.413 20.598 -23.565 1.00 0.00 ATOM 2099 CA GLY 277 22.231 20.050 -22.912 1.00 0.00 ATOM 2100 O GLY 277 23.347 19.328 -20.906 1.00 0.00 ATOM 2101 C GLY 277 22.407 19.971 -21.408 1.00 0.00 ATOM 2102 N PHE 278 21.489 20.608 -20.690 1.00 0.00 ATOM 2103 CA PHE 278 21.472 20.569 -19.228 1.00 0.00 ATOM 2104 CB PHE 278 20.263 21.369 -18.675 1.00 0.00 ATOM 2105 CG PHE 278 20.231 21.472 -17.188 1.00 0.00 ATOM 2106 CD1 PHE 278 20.993 22.441 -16.520 1.00 0.00 ATOM 2107 CD2 PHE 278 19.453 20.582 -16.429 1.00 0.00 ATOM 2108 CE1 PHE 278 20.985 22.518 -15.110 1.00 0.00 ATOM 2109 CE2 PHE 278 19.443 20.648 -15.001 1.00 0.00 ATOM 2110 CZ PHE 278 20.202 21.640 -14.343 1.00 0.00 ATOM 2111 O PHE 278 22.149 18.836 -17.746 1.00 0.00 ATOM 2112 C PHE 278 21.476 19.133 -18.721 1.00 0.00 ATOM 2113 N TYR 279 20.739 18.244 -19.378 1.00 0.00 ATOM 2114 CA TYR 279 20.674 16.820 -18.984 1.00 0.00 ATOM 2115 CB TYR 279 19.227 16.321 -19.002 1.00 0.00 ATOM 2116 CG TYR 279 18.312 17.118 -18.119 1.00 0.00 ATOM 2117 CD1 TYR 279 18.269 16.895 -16.745 1.00 0.00 ATOM 2118 CD2 TYR 279 17.494 18.105 -18.658 1.00 0.00 ATOM 2119 CE1 TYR 279 17.421 17.625 -15.931 1.00 0.00 ATOM 2120 CE2 TYR 279 16.640 18.865 -17.844 1.00 0.00 ATOM 2121 CZ TYR 279 16.603 18.607 -16.495 1.00 0.00 ATOM 2122 OH TYR 279 15.764 19.359 -15.688 1.00 0.00 ATOM 2123 O TYR 279 21.302 14.639 -19.870 1.00 0.00 ATOM 2124 C TYR 279 21.580 15.851 -19.783 1.00 0.00 ATOM 2125 N HIS 280 22.665 16.377 -20.339 1.00 0.00 ATOM 2126 CA HIS 280 23.677 15.555 -20.977 1.00 0.00 ATOM 2127 CB HIS 280 25.005 16.300 -20.984 1.00 0.00 ATOM 2128 CG HIS 280 26.000 15.744 -21.948 1.00 0.00 ATOM 2129 CD2 HIS 280 26.273 16.075 -23.228 1.00 0.00 ATOM 2130 ND1 HIS 280 26.851 14.704 -21.629 1.00 0.00 ATOM 2131 CE1 HIS 280 27.615 14.432 -22.666 1.00 0.00 ATOM 2132 NE2 HIS 280 27.282 15.245 -23.651 1.00 0.00 ATOM 2133 O HIS 280 24.016 14.166 -19.037 1.00 0.00 ATOM 2134 C HIS 280 23.838 14.212 -20.262 1.00 0.00 ATOM 2135 N ASP 281 23.797 13.120 -21.016 1.00 0.00 ATOM 2136 CA ASP 281 23.841 11.793 -20.412 1.00 0.00 ATOM 2137 CB ASP 281 23.779 10.686 -21.471 1.00 0.00 ATOM 2138 CG ASP 281 23.445 9.330 -20.873 1.00 0.00 ATOM 2139 OD1 ASP 281 24.124 8.332 -21.221 1.00 0.00 ATOM 2140 OD2 ASP 281 22.511 9.270 -20.035 1.00 0.00 ATOM 2141 O ASP 281 24.967 10.815 -18.530 1.00 0.00 ATOM 2142 C ASP 281 25.048 11.578 -19.502 1.00 0.00 ATOM 2143 N SER 282 26.165 12.233 -19.807 1.00 0.00 ATOM 2144 CA SER 282 27.336 12.127 -18.920 1.00 0.00 ATOM 2145 CB SER 282 28.585 12.687 -19.570 1.00 0.00 ATOM 2146 OG SER 282 29.010 11.863 -20.632 1.00 0.00 ATOM 2147 O SER 282 27.803 12.475 -16.584 1.00 0.00 ATOM 2148 C SER 282 27.118 12.799 -17.556 1.00 0.00 ATOM 2149 N LEU 283 26.165 13.722 -17.474 1.00 0.00 ATOM 2150 CA LEU 283 25.874 14.355 -16.202 1.00 0.00 ATOM 2151 CB LEU 283 25.270 15.752 -16.407 1.00 0.00 ATOM 2152 CG LEU 283 26.285 16.804 -16.854 1.00 0.00 ATOM 2153 CD1 LEU 283 25.632 18.141 -17.135 1.00 0.00 ATOM 2154 CD2 LEU 283 27.423 16.928 -15.829 1.00 0.00 ATOM 2155 O LEU 283 24.870 13.855 -14.112 1.00 0.00 ATOM 2156 C LEU 283 25.024 13.506 -15.263 1.00 0.00 ATOM 2157 N MET 284 24.507 12.376 -15.724 1.00 0.00 ATOM 2158 CA MET 284 23.617 11.580 -14.878 1.00 0.00 ATOM 2159 CB MET 284 22.343 11.194 -15.624 1.00 0.00 ATOM 2160 CG MET 284 21.721 12.308 -16.445 1.00 0.00 ATOM 2161 SD MET 284 21.182 13.870 -15.438 1.00 0.00 ATOM 2162 CE MET 284 19.875 13.088 -14.253 1.00 0.00 ATOM 2163 O MET 284 25.034 9.609 -14.875 1.00 0.00 ATOM 2164 C MET 284 24.267 10.349 -14.235 1.00 0.00 ATOM 2165 N SER 285 23.911 10.131 -12.969 1.00 0.00 ATOM 2166 CA SER 285 24.497 9.111 -12.087 1.00 0.00 ATOM 2167 CB SER 285 25.164 9.819 -10.915 1.00 0.00 ATOM 2168 OG SER 285 26.521 9.889 -11.127 1.00 0.00 ATOM 2169 O SER 285 22.280 8.821 -11.275 1.00 0.00 ATOM 2170 C SER 285 23.398 8.314 -11.440 1.00 0.00 ATOM 2171 N THR 286 23.733 7.125 -10.956 1.00 0.00 ATOM 2172 CA THR 286 22.759 6.304 -10.259 1.00 0.00 ATOM 2173 CB THR 286 22.441 5.030 -11.066 1.00 0.00 ATOM 2174 CG2 THR 286 21.733 5.372 -12.378 1.00 0.00 ATOM 2175 OG1 THR 286 23.654 4.332 -11.338 1.00 0.00 ATOM 2176 O THR 286 22.370 5.406 -8.044 1.00 0.00 ATOM 2177 C THR 286 23.180 5.921 -8.827 1.00 0.00 ATOM 2178 N SER 287 24.445 6.159 -8.493 1.00 0.00 ATOM 2179 CA SER 287 24.945 5.906 -7.146 1.00 0.00 ATOM 2180 CB SER 287 25.191 4.409 -6.907 1.00 0.00 ATOM 2181 OG SER 287 26.345 3.941 -7.595 1.00 0.00 ATOM 2182 O SER 287 26.809 7.202 -7.864 1.00 0.00 ATOM 2183 C SER 287 26.223 6.691 -6.910 1.00 0.00 ATOM 2184 N LEU 288 26.644 6.791 -5.645 1.00 0.00 ATOM 2185 CA LEU 288 27.954 7.336 -5.319 1.00 0.00 ATOM 2186 CB LEU 288 27.874 8.844 -5.010 1.00 0.00 ATOM 2187 CG LEU 288 27.036 9.351 -3.832 1.00 0.00 ATOM 2188 CD1 LEU 288 27.759 9.171 -2.475 1.00 0.00 ATOM 2189 CD2 LEU 288 26.565 10.823 -4.020 1.00 0.00 ATOM 2190 O LEU 288 27.966 5.835 -3.446 1.00 0.00 ATOM 2191 C LEU 288 28.615 6.587 -4.173 1.00 0.00 ATOM 2192 N GLU 289 29.919 6.802 -4.020 1.00 0.00 ATOM 2193 CA GLU 289 30.625 6.446 -2.793 1.00 0.00 ATOM 2194 CB GLU 289 31.819 5.553 -3.090 1.00 0.00 ATOM 2195 CG GLU 289 31.435 4.272 -3.791 1.00 0.00 ATOM 2196 CD GLU 289 32.424 3.162 -3.539 1.00 0.00 ATOM 2197 OE1 GLU 289 32.599 2.285 -4.430 1.00 0.00 ATOM 2198 OE2 GLU 289 33.028 3.172 -2.445 1.00 0.00 ATOM 2199 O GLU 289 31.421 8.714 -2.703 1.00 0.00 ATOM 2200 C GLU 289 31.092 7.701 -2.069 1.00 0.00 ATOM 2201 N ALA 290 31.122 7.623 -0.741 1.00 0.00 ATOM 2202 CA ALA 290 31.503 8.745 0.095 1.00 0.00 ATOM 2203 CB ALA 290 30.258 9.414 0.695 1.00 0.00 ATOM 2204 O ALA 290 32.463 7.223 1.690 1.00 0.00 ATOM 2205 C ALA 290 32.486 8.355 1.181 1.00 0.00 ATOM 2206 N SER 291 33.361 9.290 1.528 1.00 0.00 ATOM 2207 CA SER 291 34.264 9.105 2.651 1.00 0.00 ATOM 2208 CB SER 291 35.718 9.189 2.198 1.00 0.00 ATOM 2209 OG SER 291 36.111 7.959 1.621 1.00 0.00 ATOM 2210 O SER 291 33.162 11.052 3.500 1.00 0.00 ATOM 2211 C SER 291 33.964 10.139 3.726 1.00 0.00 ATOM 2212 N GLN 292 34.603 9.980 4.890 1.00 0.00 ATOM 2213 CA GLN 292 34.447 10.894 6.022 1.00 0.00 ATOM 2214 CB GLN 292 34.926 12.297 5.662 1.00 0.00 ATOM 2215 CG GLN 292 36.299 12.340 5.025 1.00 0.00 ATOM 2216 CD GLN 292 37.283 13.051 5.902 1.00 0.00 ATOM 2217 OE1 GLN 292 37.721 12.510 6.923 1.00 0.00 ATOM 2218 NE2 GLN 292 37.621 14.297 5.532 1.00 0.00 ATOM 2219 O GLN 292 32.492 12.043 6.804 1.00 0.00 ATOM 2220 C GLN 292 32.996 10.967 6.451 1.00 0.00 ATOM 2221 N VAL 293 32.312 9.834 6.384 1.00 0.00 ATOM 2222 CA VAL 293 30.917 9.811 6.758 1.00 0.00 ATOM 2223 CB VAL 293 30.176 8.624 6.149 1.00 0.00 ATOM 2224 CG1 VAL 293 28.736 8.598 6.634 1.00 0.00 ATOM 2225 CG2 VAL 293 30.205 8.724 4.628 1.00 0.00 ATOM 2226 O VAL 293 31.409 9.086 9.008 1.00 0.00 ATOM 2227 C VAL 293 30.808 9.878 8.273 1.00 0.00 ATOM 2228 N HIS 294 30.076 10.877 8.736 1.00 0.00 ATOM 2229 CA HIS 294 30.026 11.188 10.144 1.00 0.00 ATOM 2230 CB HIS 294 30.856 12.443 10.427 1.00 0.00 ATOM 2231 CG HIS 294 31.179 12.641 11.872 1.00 0.00 ATOM 2232 CD2 HIS 294 32.290 12.341 12.589 1.00 0.00 ATOM 2233 ND1 HIS 294 30.285 13.196 12.767 1.00 0.00 ATOM 2234 CE1 HIS 294 30.831 13.233 13.970 1.00 0.00 ATOM 2235 NE2 HIS 294 32.046 12.718 13.891 1.00 0.00 ATOM 2236 O HIS 294 27.808 11.977 9.741 1.00 0.00 ATOM 2237 C HIS 294 28.568 11.390 10.501 1.00 0.00 ATOM 2238 N PHE 295 28.169 10.861 11.643 1.00 0.00 ATOM 2239 CA PHE 295 26.803 11.035 12.105 1.00 0.00 ATOM 2240 CB PHE 295 26.110 9.677 12.238 1.00 0.00 ATOM 2241 CG PHE 295 25.713 9.092 10.926 1.00 0.00 ATOM 2242 CD1 PHE 295 24.461 9.358 10.383 1.00 0.00 ATOM 2243 CD2 PHE 295 26.598 8.303 10.208 1.00 0.00 ATOM 2244 CE1 PHE 295 24.091 8.841 9.148 1.00 0.00 ATOM 2245 CE2 PHE 295 26.238 7.774 8.965 1.00 0.00 ATOM 2246 CZ PHE 295 24.981 8.043 8.437 1.00 0.00 ATOM 2247 O PHE 295 27.727 11.881 14.167 1.00 0.00 ATOM 2248 C PHE 295 26.744 11.834 13.403 1.00 0.00 ATOM 2249 N THR 296 25.591 12.467 13.626 1.00 0.00 ATOM 2250 CA THR 296 25.341 13.264 14.834 1.00 0.00 ATOM 2251 CB THR 296 24.121 14.195 14.671 1.00 0.00 ATOM 2252 CG2 THR 296 24.329 15.143 13.505 1.00 0.00 ATOM 2253 OG1 THR 296 22.948 13.411 14.453 1.00 0.00 ATOM 2254 O THR 296 25.157 12.981 17.211 1.00 0.00 ATOM 2255 C THR 296 25.180 12.435 16.111 1.00 0.00 ATOM 2256 N ARG 297 25.072 11.120 15.964 1.00 0.00 ATOM 2257 CA ARG 297 25.039 10.224 17.102 1.00 0.00 ATOM 2258 CB ARG 297 23.598 9.956 17.571 1.00 0.00 ATOM 2259 CG ARG 297 22.734 9.157 16.613 1.00 0.00 ATOM 2260 CD ARG 297 21.272 9.160 17.051 1.00 0.00 ATOM 2261 NE ARG 297 20.487 8.188 16.292 1.00 0.00 ATOM 2262 CZ ARG 297 19.821 7.156 16.826 1.00 0.00 ATOM 2263 NH1 ARG 297 19.800 6.962 18.148 1.00 0.00 ATOM 2264 NH2 ARG 297 19.146 6.316 16.034 1.00 0.00 ATOM 2265 O ARG 297 26.070 8.616 15.638 1.00 0.00 ATOM 2266 C ARG 297 25.777 8.931 16.800 1.00 0.00 ATOM 2267 N GLU 298 26.096 8.201 17.863 1.00 0.00 ATOM 2268 CA GLU 298 26.670 6.867 17.763 1.00 0.00 ATOM 2269 CB GLU 298 26.792 6.265 19.178 1.00 0.00 ATOM 2270 CG GLU 298 26.867 4.746 19.256 1.00 0.00 ATOM 2271 CD GLU 298 28.154 4.227 19.889 1.00 0.00 ATOM 2272 OE1 GLU 298 29.164 4.062 19.160 1.00 0.00 ATOM 2273 OE2 GLU 298 28.142 3.958 21.112 1.00 0.00 ATOM 2274 O GLU 298 24.604 5.842 17.041 1.00 0.00 ATOM 2275 C GLU 298 25.813 5.992 16.828 1.00 0.00 ATOM 2276 N MET 299 26.448 5.457 15.781 1.00 0.00 ATOM 2277 CA MET 299 25.798 4.545 14.838 1.00 0.00 ATOM 2278 CB MET 299 25.801 5.138 13.416 1.00 0.00 ATOM 2279 CG MET 299 24.789 6.248 13.144 1.00 0.00 ATOM 2280 SD MET 299 22.957 5.939 13.751 1.00 0.00 ATOM 2281 CE MET 299 22.268 4.805 12.327 1.00 0.00 ATOM 2282 O MET 299 27.671 3.082 15.211 1.00 0.00 ATOM 2283 C MET 299 26.501 3.180 14.827 1.00 0.00 ATOM 2284 N PRO 300 25.794 2.115 14.395 1.00 0.00 ATOM 2285 CA PRO 300 26.456 0.808 14.222 1.00 0.00 ATOM 2286 CB PRO 300 25.320 -0.097 13.724 1.00 0.00 ATOM 2287 CG PRO 300 24.061 0.570 14.192 1.00 0.00 ATOM 2288 CD PRO 300 24.351 2.043 14.092 1.00 0.00 ATOM 2289 O PRO 300 27.712 1.722 12.378 1.00 0.00 ATOM 2290 C PRO 300 27.617 0.817 13.210 1.00 0.00 ATOM 2291 N GLU 301 28.495 -0.181 13.309 1.00 0.00 ATOM 2292 CA GLU 301 29.611 -0.408 12.372 1.00 0.00 ATOM 2293 CB GLU 301 30.367 -1.707 12.736 1.00 0.00 ATOM 2294 CG GLU 301 31.772 -1.522 13.331 1.00 0.00 ATOM 2295 CD GLU 301 32.650 -0.624 12.469 1.00 0.00 ATOM 2296 OE1 GLU 301 33.246 -1.119 11.479 1.00 0.00 ATOM 2297 OE2 GLU 301 32.724 0.584 12.789 1.00 0.00 ATOM 2298 O GLU 301 29.801 -0.014 10.013 1.00 0.00 ATOM 2299 C GLU 301 29.161 -0.531 10.925 1.00 0.00 ATOM 2300 N GLU 302 28.061 -1.241 10.732 1.00 0.00 ATOM 2301 CA GLU 302 27.555 -1.574 9.419 1.00 0.00 ATOM 2302 CB GLU 302 28.061 -2.963 9.003 1.00 0.00 ATOM 2303 CG GLU 302 27.485 -3.535 7.712 1.00 0.00 ATOM 2304 CD GLU 302 28.118 -4.873 7.335 1.00 0.00 ATOM 2305 OE1 GLU 302 27.927 -5.868 8.072 1.00 0.00 ATOM 2306 OE2 GLU 302 28.814 -4.932 6.296 1.00 0.00 ATOM 2307 O GLU 302 25.469 -2.146 10.466 1.00 0.00 ATOM 2308 C GLU 302 26.040 -1.541 9.544 1.00 0.00 ATOM 2309 N PHE 303 25.400 -0.800 8.641 1.00 0.00 ATOM 2310 CA PHE 303 23.952 -0.619 8.672 1.00 0.00 ATOM 2311 CB PHE 303 23.530 0.251 9.868 1.00 0.00 ATOM 2312 CG PHE 303 23.993 1.685 9.791 1.00 0.00 ATOM 2313 CD1 PHE 303 23.166 2.671 9.247 1.00 0.00 ATOM 2314 CD2 PHE 303 25.242 2.059 10.286 1.00 0.00 ATOM 2315 CE1 PHE 303 23.585 4.013 9.177 1.00 0.00 ATOM 2316 CE2 PHE 303 25.667 3.402 10.231 1.00 0.00 ATOM 2317 CZ PHE 303 24.831 4.379 9.676 1.00 0.00 ATOM 2318 O PHE 303 24.133 0.667 6.653 1.00 0.00 ATOM 2319 C PHE 303 23.418 -0.031 7.376 1.00 0.00 ATOM 2320 N THR 304 22.160 -0.341 7.085 1.00 0.00 ATOM 2321 CA THR 304 21.459 0.277 5.980 1.00 0.00 ATOM 2322 CB THR 304 20.775 -0.761 5.077 1.00 0.00 ATOM 2323 CG2 THR 304 19.903 -0.086 4.015 1.00 0.00 ATOM 2324 OG1 THR 304 21.787 -1.534 4.418 1.00 0.00 ATOM 2325 O THR 304 19.971 1.235 7.615 1.00 0.00 ATOM 2326 C THR 304 20.482 1.329 6.494 1.00 0.00 ATOM 2327 N LEU 305 20.255 2.336 5.659 1.00 0.00 ATOM 2328 CA LEU 305 19.447 3.493 5.994 1.00 0.00 ATOM 2329 CB LEU 305 20.387 4.667 6.278 1.00 0.00 ATOM 2330 CG LEU 305 20.103 5.776 7.279 1.00 0.00 ATOM 2331 CD1 LEU 305 19.895 5.224 8.679 1.00 0.00 ATOM 2332 CD2 LEU 305 21.289 6.736 7.259 1.00 0.00 ATOM 2333 O LEU 305 19.137 3.945 3.684 1.00 0.00 ATOM 2334 C LEU 305 18.610 3.821 4.775 1.00 0.00 ATOM 2335 N GLU 306 17.305 3.935 4.943 1.00 0.00 ATOM 2336 CA GLU 306 16.479 4.484 3.883 1.00 0.00 ATOM 2337 CB GLU 306 15.270 3.602 3.581 1.00 0.00 ATOM 2338 CG GLU 306 15.362 2.947 2.231 1.00 0.00 ATOM 2339 CD GLU 306 15.510 1.449 2.312 1.00 0.00 ATOM 2340 OE1 GLU 306 16.601 0.936 1.964 1.00 0.00 ATOM 2341 OE2 GLU 306 14.529 0.779 2.716 1.00 0.00 ATOM 2342 O GLU 306 15.292 6.049 5.243 1.00 0.00 ATOM 2343 C GLU 306 16.054 5.880 4.293 1.00 0.00 ATOM 2344 N CYS 307 16.573 6.881 3.589 1.00 0.00 ATOM 2345 CA CYS 307 16.369 8.262 3.977 1.00 0.00 ATOM 2346 CB CYS 307 17.436 8.690 5.018 1.00 0.00 ATOM 2347 SG CYS 307 19.206 8.536 4.515 1.00 0.00 ATOM 2348 O CYS 307 16.159 8.697 1.633 1.00 0.00 ATOM 2349 C CYS 307 16.354 9.167 2.747 1.00 0.00 ATOM 2350 N THR 308 16.521 10.471 2.951 1.00 0.00 ATOM 2351 CA THR 308 16.806 11.369 1.841 1.00 0.00 ATOM 2352 CB THR 308 15.801 12.508 1.740 1.00 0.00 ATOM 2353 CG2 THR 308 14.385 11.997 1.522 1.00 0.00 ATOM 2354 OG1 THR 308 15.850 13.268 2.939 1.00 0.00 ATOM 2355 O THR 308 18.843 11.821 3.044 1.00 0.00 ATOM 2356 C THR 308 18.223 11.938 1.985 1.00 0.00 ATOM 2357 N ALA 309 18.735 12.531 0.910 1.00 0.00 ATOM 2358 CA ALA 309 20.040 13.176 0.926 1.00 0.00 ATOM 2359 CB ALA 309 21.144 12.211 0.494 1.00 0.00 ATOM 2360 O ALA 309 19.264 14.547 -0.873 1.00 0.00 ATOM 2361 C ALA 309 20.061 14.407 0.045 1.00 0.00 ATOM 2362 N LYS 310 21.011 15.283 0.346 1.00 0.00 ATOM 2363 CA LYS 310 21.336 16.425 -0.469 1.00 0.00 ATOM 2364 CB LYS 310 21.301 17.683 0.368 1.00 0.00 ATOM 2365 CG LYS 310 20.013 18.477 0.287 1.00 0.00 ATOM 2366 CD LYS 310 19.963 19.511 1.431 1.00 0.00 ATOM 2367 CE LYS 310 19.333 20.835 1.024 1.00 0.00 ATOM 2368 NZ LYS 310 20.136 22.044 1.618 1.00 0.00 ATOM 2369 O LYS 310 23.598 15.752 -0.200 1.00 0.00 ATOM 2370 C LYS 310 22.748 16.212 -0.953 1.00 0.00 ATOM 2371 N PHE 311 22.985 16.541 -2.218 1.00 0.00 ATOM 2372 CA PHE 311 24.280 16.393 -2.859 1.00 0.00 ATOM 2373 CB PHE 311 24.121 15.579 -4.154 1.00 0.00 ATOM 2374 CG PHE 311 23.364 14.308 -3.952 1.00 0.00 ATOM 2375 CD1 PHE 311 23.925 13.270 -3.188 1.00 0.00 ATOM 2376 CD2 PHE 311 22.073 14.163 -4.459 1.00 0.00 ATOM 2377 CE1 PHE 311 23.226 12.093 -2.971 1.00 0.00 ATOM 2378 CE2 PHE 311 21.362 12.995 -4.246 1.00 0.00 ATOM 2379 CZ PHE 311 21.939 11.952 -3.512 1.00 0.00 ATOM 2380 O PHE 311 26.018 17.887 -3.510 1.00 0.00 ATOM 2381 C PHE 311 24.861 17.756 -3.146 1.00 0.00 ATOM 2382 N ARG 312 24.033 18.772 -2.997 1.00 0.00 ATOM 2383 CA ARG 312 24.481 20.141 -3.113 1.00 0.00 ATOM 2384 CB ARG 312 24.467 20.591 -4.574 1.00 0.00 ATOM 2385 CG ARG 312 23.148 20.295 -5.307 1.00 0.00 ATOM 2386 CD ARG 312 23.287 20.338 -6.817 1.00 0.00 ATOM 2387 NE ARG 312 24.026 21.509 -7.248 1.00 0.00 ATOM 2388 CZ ARG 312 25.134 21.466 -7.985 1.00 0.00 ATOM 2389 NH1 ARG 312 25.645 20.293 -8.411 1.00 0.00 ATOM 2390 NH2 ARG 312 25.719 22.612 -8.311 1.00 0.00 ATOM 2391 O ARG 312 22.486 20.606 -1.858 1.00 0.00 ATOM 2392 C ARG 312 23.602 21.000 -2.229 1.00 0.00 ATOM 2393 N TYR 313 24.129 22.152 -1.840 1.00 0.00 ATOM 2394 CA TYR 313 23.455 22.976 -0.878 1.00 0.00 ATOM 2395 CB TYR 313 24.342 24.148 -0.484 1.00 0.00 ATOM 2396 CG TYR 313 23.672 25.172 0.423 1.00 0.00 ATOM 2397 CD1 TYR 313 23.039 24.788 1.623 1.00 0.00 ATOM 2398 CD2 TYR 313 23.720 26.532 0.115 1.00 0.00 ATOM 2399 CE1 TYR 313 22.441 25.745 2.482 1.00 0.00 ATOM 2400 CE2 TYR 313 23.143 27.502 0.966 1.00 0.00 ATOM 2401 CZ TYR 313 22.487 27.098 2.134 1.00 0.00 ATOM 2402 OH TYR 313 21.916 28.062 2.959 1.00 0.00 ATOM 2403 O TYR 313 21.093 23.413 -0.615 1.00 0.00 ATOM 2404 C TYR 313 22.076 23.437 -1.375 1.00 0.00 ATOM 2405 N ARG 314 21.972 23.802 -2.651 1.00 0.00 ATOM 2406 CA ARG 314 20.788 24.535 -3.109 1.00 0.00 ATOM 2407 CB ARG 314 21.215 25.743 -3.959 1.00 0.00 ATOM 2408 CG ARG 314 22.304 26.562 -3.257 1.00 0.00 ATOM 2409 CD ARG 314 22.794 27.746 -4.054 1.00 0.00 ATOM 2410 NE ARG 314 21.795 28.800 -3.976 1.00 0.00 ATOM 2411 CZ ARG 314 21.713 29.691 -2.999 1.00 0.00 ATOM 2412 NH1 ARG 314 20.732 30.569 -3.018 1.00 0.00 ATOM 2413 NH2 ARG 314 22.597 29.704 -2.014 1.00 0.00 ATOM 2414 O ARG 314 18.801 24.181 -4.431 1.00 0.00 ATOM 2415 C ARG 314 19.694 23.669 -3.756 1.00 0.00 ATOM 2416 N GLN 315 19.735 22.365 -3.501 1.00 0.00 ATOM 2417 CA GLN 315 18.732 21.449 -4.064 1.00 0.00 ATOM 2418 CB GLN 315 19.388 20.302 -4.818 1.00 0.00 ATOM 2419 CG GLN 315 19.911 19.243 -3.850 1.00 0.00 ATOM 2420 CD GLN 315 20.606 18.103 -4.557 1.00 0.00 ATOM 2421 OE1 GLN 315 21.066 17.150 -3.910 1.00 0.00 ATOM 2422 NE2 GLN 315 20.683 18.187 -5.895 1.00 0.00 ATOM 2423 O GLN 315 18.301 20.728 -1.839 1.00 0.00 ATOM 2424 C GLN 315 17.848 20.865 -2.972 1.00 0.00 ATOM 2425 N PRO 316 16.596 20.481 -3.307 1.00 0.00 ATOM 2426 CA PRO 316 15.838 19.707 -2.304 1.00 0.00 ATOM 2427 CB PRO 316 14.444 19.594 -2.899 1.00 0.00 ATOM 2428 CG PRO 316 14.634 19.844 -4.392 1.00 0.00 ATOM 2429 CD PRO 316 15.847 20.694 -4.553 1.00 0.00 ATOM 2430 O PRO 316 17.225 17.862 -2.950 1.00 0.00 ATOM 2431 C PRO 316 16.461 18.320 -2.106 1.00 0.00 ATOM 2432 N ASP 317 16.165 17.676 -0.985 1.00 0.00 ATOM 2433 CA ASP 317 16.737 16.356 -0.723 1.00 0.00 ATOM 2434 CB ASP 317 16.790 16.018 0.777 1.00 0.00 ATOM 2435 CG ASP 317 15.567 16.480 1.520 1.00 0.00 ATOM 2436 OD1 ASP 317 15.298 17.716 1.463 1.00 0.00 ATOM 2437 OD2 ASP 317 14.902 15.634 2.174 1.00 0.00 ATOM 2438 O ASP 317 14.825 15.601 -1.906 1.00 0.00 ATOM 2439 C ASP 317 15.946 15.333 -1.486 1.00 0.00 ATOM 2440 N SER 318 16.538 14.173 -1.709 1.00 0.00 ATOM 2441 CA SER 318 15.864 13.156 -2.503 1.00 0.00 ATOM 2442 CB SER 318 16.259 13.263 -3.975 1.00 0.00 ATOM 2443 OG SER 318 17.655 13.298 -4.096 1.00 0.00 ATOM 2444 O SER 318 17.129 11.580 -1.236 1.00 0.00 ATOM 2445 C SER 318 16.142 11.779 -1.951 1.00 0.00 ATOM 2446 N LYS 319 15.252 10.847 -2.284 1.00 0.00 ATOM 2447 CA LYS 319 15.257 9.522 -1.702 1.00 0.00 ATOM 2448 CB LYS 319 13.990 8.756 -2.071 1.00 0.00 ATOM 2449 CG LYS 319 12.743 9.181 -1.297 1.00 0.00 ATOM 2450 CD LYS 319 11.645 8.113 -1.448 1.00 0.00 ATOM 2451 CE LYS 319 10.248 8.639 -1.089 1.00 0.00 ATOM 2452 NZ LYS 319 9.226 7.534 -1.120 1.00 0.00 ATOM 2453 O LYS 319 17.024 8.831 -3.189 1.00 0.00 ATOM 2454 C LYS 319 16.512 8.740 -2.073 1.00 0.00 ATOM 2455 N VAL 320 16.968 7.942 -1.120 1.00 0.00 ATOM 2456 CA VAL 320 18.302 7.408 -1.116 1.00 0.00 ATOM 2457 CB VAL 320 19.258 8.571 -0.685 1.00 0.00 ATOM 2458 CG1 VAL 320 20.219 8.208 0.390 1.00 0.00 ATOM 2459 CG2 VAL 320 19.943 9.224 -1.912 1.00 0.00 ATOM 2460 O VAL 320 17.696 6.107 0.852 1.00 0.00 ATOM 2461 C VAL 320 18.333 6.149 -0.204 1.00 0.00 ATOM 2462 N THR 321 19.018 5.107 -0.660 1.00 0.00 ATOM 2463 CA THR 321 19.433 4.021 0.206 1.00 0.00 ATOM 2464 CB THR 321 19.215 2.645 -0.448 1.00 0.00 ATOM 2465 CG2 THR 321 19.695 1.531 0.468 1.00 0.00 ATOM 2466 OG1 THR 321 17.823 2.470 -0.723 1.00 0.00 ATOM 2467 O THR 321 21.720 4.350 -0.435 1.00 0.00 ATOM 2468 C THR 321 20.917 4.196 0.488 1.00 0.00 ATOM 2469 N VAL 322 21.289 4.174 1.763 1.00 0.00 ATOM 2470 CA VAL 322 22.706 4.241 2.104 1.00 0.00 ATOM 2471 CB VAL 322 23.152 5.665 2.647 1.00 0.00 ATOM 2472 CG1 VAL 322 21.983 6.620 2.797 1.00 0.00 ATOM 2473 CG2 VAL 322 23.981 5.603 3.871 1.00 0.00 ATOM 2474 O VAL 322 22.633 2.629 3.896 1.00 0.00 ATOM 2475 C VAL 322 23.209 3.018 2.872 1.00 0.00 ATOM 2476 N HIS 323 24.255 2.399 2.326 1.00 0.00 ATOM 2477 CA HIS 323 24.927 1.264 2.963 1.00 0.00 ATOM 2478 CB HIS 323 25.132 0.122 1.964 1.00 0.00 ATOM 2479 CG HIS 323 23.869 -0.341 1.308 1.00 0.00 ATOM 2480 CD2 HIS 323 22.732 -0.862 1.829 1.00 0.00 ATOM 2481 ND1 HIS 323 23.669 -0.277 -0.056 1.00 0.00 ATOM 2482 CE1 HIS 323 22.467 -0.746 -0.347 1.00 0.00 ATOM 2483 NE2 HIS 323 21.876 -1.102 0.781 1.00 0.00 ATOM 2484 O HIS 323 27.200 2.017 2.809 1.00 0.00 ATOM 2485 C HIS 323 26.267 1.703 3.550 1.00 0.00 ATOM 2486 N VAL 324 26.351 1.730 4.880 1.00 0.00 ATOM 2487 CA VAL 324 27.532 2.229 5.594 1.00 0.00 ATOM 2488 CB VAL 324 27.122 3.079 6.821 1.00 0.00 ATOM 2489 CG1 VAL 324 28.339 3.677 7.523 1.00 0.00 ATOM 2490 CG2 VAL 324 26.165 4.172 6.419 1.00 0.00 ATOM 2491 O VAL 324 27.782 0.070 6.611 1.00 0.00 ATOM 2492 C VAL 324 28.349 1.041 6.076 1.00 0.00 ATOM 2493 N LYS 325 29.671 1.103 5.890 1.00 0.00 ATOM 2494 CA LYS 325 30.552 -0.003 6.329 1.00 0.00 ATOM 2495 CB LYS 325 30.816 -0.992 5.189 1.00 0.00 ATOM 2496 CG LYS 325 29.754 -2.072 5.023 1.00 0.00 ATOM 2497 CD LYS 325 30.285 -3.272 4.213 1.00 0.00 ATOM 2498 CE LYS 325 30.537 -2.933 2.725 1.00 0.00 ATOM 2499 NZ LYS 325 29.271 -2.789 1.955 1.00 0.00 ATOM 2500 O LYS 325 32.881 -0.308 6.887 1.00 0.00 ATOM 2501 C LYS 325 31.878 0.419 6.982 1.00 0.00 ATOM 2502 N GLY 326 31.868 1.573 7.657 1.00 0.00 ATOM 2503 CA GLY 326 33.042 2.079 8.379 1.00 0.00 ATOM 2504 O GLY 326 33.706 4.290 7.676 1.00 0.00 ATOM 2505 C GLY 326 33.857 3.057 7.546 1.00 0.00 ATOM 2506 N GLU 327 34.721 2.530 6.680 1.00 0.00 ATOM 2507 CA GLU 327 35.567 3.393 5.845 1.00 0.00 ATOM 2508 CB GLU 327 36.930 2.742 5.551 1.00 0.00 ATOM 2509 CG GLU 327 37.939 2.867 6.712 1.00 0.00 ATOM 2510 CD GLU 327 38.200 4.315 7.126 1.00 0.00 ATOM 2511 OE1 GLU 327 38.831 5.060 6.341 1.00 0.00 ATOM 2512 OE2 GLU 327 37.774 4.703 8.236 1.00 0.00 ATOM 2513 O GLU 327 35.135 5.082 4.159 1.00 0.00 ATOM 2514 C GLU 327 34.891 3.934 4.563 1.00 0.00 ATOM 2515 N LYS 328 34.046 3.118 3.932 1.00 0.00 ATOM 2516 CA LYS 328 33.298 3.601 2.775 1.00 0.00 ATOM 2517 CB LYS 328 33.779 2.932 1.475 1.00 0.00 ATOM 2518 CG LYS 328 34.489 3.882 0.471 1.00 0.00 ATOM 2519 CD LYS 328 35.734 3.191 -0.153 1.00 0.00 ATOM 2520 CE LYS 328 35.439 1.775 -0.699 1.00 0.00 ATOM 2521 NZ LYS 328 36.604 0.855 -0.507 1.00 0.00 ATOM 2522 O LYS 328 31.291 2.547 3.620 1.00 0.00 ATOM 2523 C LYS 328 31.788 3.463 2.934 1.00 0.00 ATOM 2524 N THR 329 31.083 4.370 2.262 1.00 0.00 ATOM 2525 CA THR 329 29.639 4.404 2.272 1.00 0.00 ATOM 2526 CB THR 329 29.183 5.623 3.070 1.00 0.00 ATOM 2527 CG2 THR 329 27.672 5.827 3.001 1.00 0.00 ATOM 2528 OG1 THR 329 29.593 5.416 4.433 1.00 0.00 ATOM 2529 O THR 329 29.658 5.091 0.005 1.00 0.00 ATOM 2530 C THR 329 29.124 4.401 0.846 1.00 0.00 ATOM 2531 N GLU 330 28.115 3.586 0.569 1.00 0.00 ATOM 2532 CA GLU 330 27.484 3.589 -0.738 1.00 0.00 ATOM 2533 CB GLU 330 27.370 2.177 -1.312 1.00 0.00 ATOM 2534 CG GLU 330 27.095 2.174 -2.815 1.00 0.00 ATOM 2535 CD GLU 330 26.680 0.816 -3.355 1.00 0.00 ATOM 2536 OE1 GLU 330 26.774 -0.204 -2.631 1.00 0.00 ATOM 2537 OE2 GLU 330 26.259 0.772 -4.532 1.00 0.00 ATOM 2538 O GLU 330 25.290 3.927 0.153 1.00 0.00 ATOM 2539 C GLU 330 26.110 4.249 -0.693 1.00 0.00 ATOM 2540 N VAL 331 25.865 5.169 -1.623 1.00 0.00 ATOM 2541 CA VAL 331 24.570 5.835 -1.714 1.00 0.00 ATOM 2542 CB VAL 331 24.696 7.362 -1.476 1.00 0.00 ATOM 2543 CG1 VAL 331 23.337 7.996 -1.479 1.00 0.00 ATOM 2544 CG2 VAL 331 25.377 7.631 -0.162 1.00 0.00 ATOM 2545 O VAL 331 24.446 5.826 -4.107 1.00 0.00 ATOM 2546 C VAL 331 23.897 5.523 -3.052 1.00 0.00 ATOM 2547 N ILE 332 22.718 4.907 -2.995 1.00 0.00 ATOM 2548 CA ILE 332 21.950 4.560 -4.196 1.00 0.00 ATOM 2549 CB ILE 332 21.507 3.063 -4.207 1.00 0.00 ATOM 2550 CG1 ILE 332 22.713 2.149 -4.415 1.00 0.00 ATOM 2551 CG2 ILE 332 20.488 2.776 -5.319 1.00 0.00 ATOM 2552 CD1 ILE 332 23.050 1.318 -3.232 1.00 0.00 ATOM 2553 O ILE 332 19.902 5.583 -3.455 1.00 0.00 ATOM 2554 C ILE 332 20.747 5.496 -4.341 1.00 0.00 ATOM 2555 N PHE 333 20.689 6.193 -5.464 1.00 0.00 ATOM 2556 CA PHE 333 19.650 7.186 -5.715 1.00 0.00 ATOM 2557 CB PHE 333 20.098 8.191 -6.810 1.00 0.00 ATOM 2558 CG PHE 333 21.539 8.652 -6.690 1.00 0.00 ATOM 2559 CD1 PHE 333 22.163 8.781 -5.447 1.00 0.00 ATOM 2560 CD2 PHE 333 22.263 8.992 -7.820 1.00 0.00 ATOM 2561 CE1 PHE 333 23.471 9.205 -5.356 1.00 0.00 ATOM 2562 CE2 PHE 333 23.580 9.431 -7.724 1.00 0.00 ATOM 2563 CZ PHE 333 24.177 9.522 -6.490 1.00 0.00 ATOM 2564 O PHE 333 18.422 5.502 -6.880 1.00 0.00 ATOM 2565 C PHE 333 18.368 6.476 -6.139 1.00 0.00 ATOM 2566 N ALA 334 17.218 6.958 -5.674 1.00 0.00 ATOM 2567 CA ALA 334 15.924 6.464 -6.163 1.00 0.00 ATOM 2568 CB ALA 334 14.790 7.110 -5.402 1.00 0.00 ATOM 2569 O ALA 334 15.211 5.981 -8.394 1.00 0.00 ATOM 2570 C ALA 334 15.775 6.766 -7.648 1.00 0.00 ATOM 2571 N GLU 335 16.342 7.899 -8.057 1.00 0.00 ATOM 2572 CA GLU 335 16.135 8.524 -9.359 1.00 0.00 ATOM 2573 CB GLU 335 15.154 9.699 -9.143 1.00 0.00 ATOM 2574 CG GLU 335 14.634 10.467 -10.368 1.00 0.00 ATOM 2575 CD GLU 335 14.136 11.907 -10.027 1.00 0.00 ATOM 2576 OE1 GLU 335 13.906 12.211 -8.824 1.00 0.00 ATOM 2577 OE2 GLU 335 13.979 12.737 -10.962 1.00 0.00 ATOM 2578 O GLU 335 18.305 9.477 -8.981 1.00 0.00 ATOM 2579 C GLU 335 17.528 9.022 -9.811 1.00 0.00 ATOM 2580 N PRO 336 17.882 8.875 -11.107 1.00 0.00 ATOM 2581 CA PRO 336 19.181 9.443 -11.558 1.00 0.00 ATOM 2582 CB PRO 336 19.119 9.302 -13.079 1.00 0.00 ATOM 2583 CG PRO 336 18.199 8.086 -13.301 1.00 0.00 ATOM 2584 CD PRO 336 17.171 8.175 -12.210 1.00 0.00 ATOM 2585 O PRO 336 18.522 11.735 -11.182 1.00 0.00 ATOM 2586 C PRO 336 19.440 10.899 -11.162 1.00 0.00 ATOM 2587 N GLN 337 20.697 11.186 -10.829 1.00 0.00 ATOM 2588 CA GLN 337 21.108 12.475 -10.272 1.00 0.00 ATOM 2589 CB GLN 337 21.742 12.284 -8.892 1.00 0.00 ATOM 2590 CG GLN 337 20.755 11.876 -7.789 1.00 0.00 ATOM 2591 CD GLN 337 19.668 12.921 -7.547 1.00 0.00 ATOM 2592 OE1 GLN 337 19.961 14.123 -7.428 1.00 0.00 ATOM 2593 NE2 GLN 337 18.408 12.473 -7.498 1.00 0.00 ATOM 2594 O GLN 337 23.041 12.578 -11.720 1.00 0.00 ATOM 2595 C GLN 337 22.101 13.191 -11.169 1.00 0.00 ATOM 2596 N ARG 338 21.895 14.496 -11.289 1.00 0.00 ATOM 2597 CA ARG 338 22.673 15.331 -12.159 1.00 0.00 ATOM 2598 CB ARG 338 21.828 16.512 -12.607 1.00 0.00 ATOM 2599 CG ARG 338 22.526 17.321 -13.640 1.00 0.00 ATOM 2600 CD ARG 338 21.776 18.544 -14.018 1.00 0.00 ATOM 2601 NE ARG 338 22.555 19.329 -14.971 1.00 0.00 ATOM 2602 CZ ARG 338 23.491 20.221 -14.637 1.00 0.00 ATOM 2603 NH1 ARG 338 23.775 20.449 -13.356 1.00 0.00 ATOM 2604 NH2 ARG 338 24.137 20.897 -15.596 1.00 0.00 ATOM 2605 O ARG 338 23.778 16.427 -10.346 1.00 0.00 ATOM 2606 C ARG 338 23.883 15.892 -11.464 1.00 0.00 ATOM 2607 N ALA 339 25.025 15.804 -12.140 1.00 0.00 ATOM 2608 CA ALA 339 26.263 16.484 -11.720 1.00 0.00 ATOM 2609 CB ALA 339 26.156 18.006 -11.987 1.00 0.00 ATOM 2610 O ALA 339 27.102 17.114 -9.564 1.00 0.00 ATOM 2611 C ALA 339 26.717 16.208 -10.277 1.00 0.00 ATOM 2612 N ILE 340 26.693 14.943 -9.882 1.00 0.00 ATOM 2613 CA ILE 340 27.198 14.498 -8.602 1.00 0.00 ATOM 2614 CB ILE 340 26.902 12.990 -8.430 1.00 0.00 ATOM 2615 CG1 ILE 340 25.396 12.750 -8.280 1.00 0.00 ATOM 2616 CG2 ILE 340 27.727 12.353 -7.311 1.00 0.00 ATOM 2617 CD1 ILE 340 24.780 13.156 -6.994 1.00 0.00 ATOM 2618 O ILE 340 29.456 14.215 -9.401 1.00 0.00 ATOM 2619 C ILE 340 28.710 14.771 -8.578 1.00 0.00 ATOM 2620 N THR 341 29.162 15.591 -7.623 1.00 0.00 ATOM 2621 CA THR 341 30.495 16.189 -7.689 1.00 0.00 ATOM 2622 CB THR 341 30.381 17.713 -7.620 1.00 0.00 ATOM 2623 CG2 THR 341 31.743 18.396 -7.699 1.00 0.00 ATOM 2624 OG1 THR 341 29.566 18.138 -8.710 1.00 0.00 ATOM 2625 O THR 341 31.273 15.921 -5.429 1.00 0.00 ATOM 2626 C THR 341 31.462 15.681 -6.636 1.00 0.00 ATOM 2627 N PRO 342 32.524 14.982 -7.084 1.00 0.00 ATOM 2628 CA PRO 342 33.550 14.565 -6.112 1.00 0.00 ATOM 2629 CB PRO 342 34.648 13.932 -6.985 1.00 0.00 ATOM 2630 CG PRO 342 33.888 13.454 -8.196 1.00 0.00 ATOM 2631 CD PRO 342 32.853 14.555 -8.459 1.00 0.00 ATOM 2632 O PRO 342 34.399 16.816 -5.871 1.00 0.00 ATOM 2633 C PRO 342 34.096 15.742 -5.306 1.00 0.00 ATOM 2634 N GLY 343 34.183 15.524 -3.989 1.00 0.00 ATOM 2635 CA GLY 343 34.603 16.551 -3.040 1.00 0.00 ATOM 2636 O GLY 343 33.614 17.742 -1.215 1.00 0.00 ATOM 2637 C GLY 343 33.454 17.239 -2.321 1.00 0.00 ATOM 2638 N GLN 344 32.281 17.267 -2.932 1.00 0.00 ATOM 2639 CA GLN 344 31.151 17.945 -2.300 1.00 0.00 ATOM 2640 CB GLN 344 30.098 18.310 -3.340 1.00 0.00 ATOM 2641 CG GLN 344 30.617 19.390 -4.298 1.00 0.00 ATOM 2642 CD GLN 344 30.756 20.711 -3.591 1.00 0.00 ATOM 2643 OE1 GLN 344 29.751 21.361 -3.300 1.00 0.00 ATOM 2644 NE2 GLN 344 31.999 21.094 -3.243 1.00 0.00 ATOM 2645 O GLN 344 30.906 15.928 -1.100 1.00 0.00 ATOM 2646 C GLN 344 30.585 17.094 -1.180 1.00 0.00 ATOM 2647 N ALA 345 29.769 17.700 -0.316 1.00 0.00 ATOM 2648 CA ALA 345 29.136 16.995 0.774 1.00 0.00 ATOM 2649 CB ALA 345 28.816 17.986 1.923 1.00 0.00 ATOM 2650 O ALA 345 27.065 16.856 -0.421 1.00 0.00 ATOM 2651 C ALA 345 27.856 16.280 0.321 1.00 0.00 ATOM 2652 N VAL 346 27.675 15.039 0.771 1.00 0.00 ATOM 2653 CA VAL 346 26.393 14.341 0.708 1.00 0.00 ATOM 2654 CB VAL 346 26.517 12.796 0.609 1.00 0.00 ATOM 2655 CG1 VAL 346 25.401 12.186 -0.210 1.00 0.00 ATOM 2656 CG2 VAL 346 27.897 12.358 0.234 1.00 0.00 ATOM 2657 O VAL 346 26.612 14.014 3.060 1.00 0.00 ATOM 2658 C VAL 346 25.897 14.412 2.133 1.00 0.00 ATOM 2659 N VAL 347 24.658 14.840 2.314 1.00 0.00 ATOM 2660 CA VAL 347 24.119 15.008 3.650 1.00 0.00 ATOM 2661 CB VAL 347 24.008 16.500 3.991 1.00 0.00 ATOM 2662 CG1 VAL 347 23.462 16.698 5.379 1.00 0.00 ATOM 2663 CG2 VAL 347 25.381 17.155 3.842 1.00 0.00 ATOM 2664 O VAL 347 21.964 14.434 2.771 1.00 0.00 ATOM 2665 C VAL 347 22.782 14.297 3.699 1.00 0.00 ATOM 2666 N PHE 348 22.584 13.537 4.782 1.00 0.00 ATOM 2667 CA PHE 348 21.442 12.670 4.954 1.00 0.00 ATOM 2668 CB PHE 348 21.901 11.284 5.446 1.00 0.00 ATOM 2669 CG PHE 348 23.060 10.711 4.653 1.00 0.00 ATOM 2670 CD1 PHE 348 22.920 10.413 3.294 1.00 0.00 ATOM 2671 CD2 PHE 348 24.286 10.472 5.262 1.00 0.00 ATOM 2672 CE1 PHE 348 23.986 9.881 2.559 1.00 0.00 ATOM 2673 CE2 PHE 348 25.360 9.935 4.540 1.00 0.00 ATOM 2674 CZ PHE 348 25.216 9.640 3.189 1.00 0.00 ATOM 2675 O PHE 348 20.754 13.864 6.910 1.00 0.00 ATOM 2676 C PHE 348 20.418 13.263 5.886 1.00 0.00 ATOM 2677 N TYR 349 19.156 13.076 5.531 1.00 0.00 ATOM 2678 CA TYR 349 18.036 13.622 6.304 1.00 0.00 ATOM 2679 CB TYR 349 17.356 14.770 5.568 1.00 0.00 ATOM 2680 CG TYR 349 18.237 15.970 5.434 1.00 0.00 ATOM 2681 CD1 TYR 349 18.169 17.013 6.360 1.00 0.00 ATOM 2682 CD2 TYR 349 19.146 16.074 4.380 1.00 0.00 ATOM 2683 CE1 TYR 349 19.000 18.142 6.250 1.00 0.00 ATOM 2684 CE2 TYR 349 19.982 17.168 4.265 1.00 0.00 ATOM 2685 CZ TYR 349 19.896 18.207 5.207 1.00 0.00 ATOM 2686 OH TYR 349 20.723 19.305 5.086 1.00 0.00 ATOM 2687 O TYR 349 16.840 11.590 5.865 1.00 0.00 ATOM 2688 C TYR 349 17.001 12.574 6.597 1.00 0.00 ATOM 2689 N ASP 350 16.306 12.799 7.693 1.00 0.00 ATOM 2690 CA ASP 350 15.157 12.023 8.051 1.00 0.00 ATOM 2691 CB ASP 350 15.467 11.196 9.293 1.00 0.00 ATOM 2692 CG ASP 350 14.318 10.298 9.704 1.00 0.00 ATOM 2693 OD1 ASP 350 13.305 10.220 8.966 1.00 0.00 ATOM 2694 OD2 ASP 350 14.435 9.672 10.783 1.00 0.00 ATOM 2695 O ASP 350 13.915 13.472 9.470 1.00 0.00 ATOM 2696 C ASP 350 14.065 13.039 8.342 1.00 0.00 ATOM 2697 N GLY 351 13.313 13.427 7.317 1.00 0.00 ATOM 2698 CA GLY 351 12.351 14.499 7.491 1.00 0.00 ATOM 2699 O GLY 351 14.043 16.173 7.222 1.00 0.00 ATOM 2700 C GLY 351 13.113 15.741 7.908 1.00 0.00 ATOM 2701 N GLU 352 12.748 16.311 9.046 1.00 0.00 ATOM 2702 CA GLU 352 13.418 17.529 9.452 1.00 0.00 ATOM 2703 CB GLU 352 12.476 18.493 10.176 1.00 0.00 ATOM 2704 CG GLU 352 11.924 18.056 11.506 1.00 0.00 ATOM 2705 CD GLU 352 10.844 19.038 12.038 1.00 0.00 ATOM 2706 OE1 GLU 352 10.454 20.004 11.290 1.00 0.00 ATOM 2707 OE2 GLU 352 10.390 18.827 13.201 1.00 0.00 ATOM 2708 O GLU 352 15.464 18.294 10.414 1.00 0.00 ATOM 2709 C GLU 352 14.757 17.331 10.163 1.00 0.00 ATOM 2710 N GLU 353 15.132 16.084 10.420 1.00 0.00 ATOM 2711 CA GLU 353 16.362 15.834 11.111 1.00 0.00 ATOM 2712 CB GLU 353 16.275 14.574 11.963 1.00 0.00 ATOM 2713 CG GLU 353 17.490 14.423 12.886 1.00 0.00 ATOM 2714 CD GLU 353 17.489 13.159 13.763 1.00 0.00 ATOM 2715 OE1 GLU 353 16.420 12.526 13.974 1.00 0.00 ATOM 2716 OE2 GLU 353 18.592 12.832 14.259 1.00 0.00 ATOM 2717 O GLU 353 17.398 14.963 9.165 1.00 0.00 ATOM 2718 C GLU 353 17.501 15.688 10.140 1.00 0.00 ATOM 2719 N CYS 354 18.600 16.366 10.424 1.00 0.00 ATOM 2720 CA CYS 354 19.826 16.159 9.680 1.00 0.00 ATOM 2721 CB CYS 354 20.600 17.456 9.570 1.00 0.00 ATOM 2722 SG CYS 354 22.093 17.278 8.569 1.00 0.00 ATOM 2723 O CYS 354 21.220 15.296 11.451 1.00 0.00 ATOM 2724 C CYS 354 20.678 15.077 10.359 1.00 0.00 ATOM 2725 N LEU 355 20.795 13.918 9.710 1.00 0.00 ATOM 2726 CA LEU 355 21.435 12.749 10.350 1.00 0.00 ATOM 2727 CB LEU 355 20.975 11.442 9.710 1.00 0.00 ATOM 2728 CG LEU 355 19.460 11.211 9.750 1.00 0.00 ATOM 2729 CD1 LEU 355 19.048 10.117 8.799 1.00 0.00 ATOM 2730 CD2 LEU 355 18.965 10.916 11.179 1.00 0.00 ATOM 2731 O LEU 355 23.586 12.327 11.307 1.00 0.00 ATOM 2732 C LEU 355 22.957 12.818 10.383 1.00 0.00 ATOM 2733 N GLY 356 23.559 13.444 9.387 1.00 0.00 ATOM 2734 CA GLY 356 25.007 13.475 9.290 1.00 0.00 ATOM 2735 O GLY 356 24.530 14.026 7.038 1.00 0.00 ATOM 2736 C GLY 356 25.358 13.576 7.831 1.00 0.00 ATOM 2737 N GLY 357 26.570 13.168 7.470 1.00 0.00 ATOM 2738 CA GLY 357 27.004 13.273 6.095 1.00 0.00 ATOM 2739 O GLY 357 29.196 12.688 6.825 1.00 0.00 ATOM 2740 C GLY 357 28.455 12.938 5.869 1.00 0.00 ATOM 2741 N GLY 358 28.843 12.916 4.596 1.00 0.00 ATOM 2742 CA GLY 358 30.214 12.689 4.168 1.00 0.00 ATOM 2743 O GLY 358 29.952 14.541 2.628 1.00 0.00 ATOM 2744 C GLY 358 30.626 13.562 2.983 1.00 0.00 ATOM 2745 N LEU 359 31.745 13.194 2.377 1.00 0.00 ATOM 2746 CA LEU 359 32.280 13.881 1.198 1.00 0.00 ATOM 2747 CB LEU 359 33.720 14.358 1.454 1.00 0.00 ATOM 2748 CG LEU 359 33.772 15.321 2.652 1.00 0.00 ATOM 2749 CD1 LEU 359 35.210 15.621 3.038 1.00 0.00 ATOM 2750 CD2 LEU 359 32.989 16.636 2.351 1.00 0.00 ATOM 2751 O LEU 359 32.598 11.748 0.181 1.00 0.00 ATOM 2752 C LEU 359 32.225 12.916 0.037 1.00 0.00 ATOM 2753 N ILE 360 31.708 13.373 -1.091 1.00 0.00 ATOM 2754 CA ILE 360 31.556 12.499 -2.243 1.00 0.00 ATOM 2755 CB ILE 360 30.684 13.156 -3.286 1.00 0.00 ATOM 2756 CG1 ILE 360 29.260 13.285 -2.733 1.00 0.00 ATOM 2757 CG2 ILE 360 30.714 12.385 -4.606 1.00 0.00 ATOM 2758 CD1 ILE 360 28.419 14.340 -3.424 1.00 0.00 ATOM 2759 O ILE 360 33.690 13.039 -3.206 1.00 0.00 ATOM 2760 C ILE 360 32.926 12.140 -2.829 1.00 0.00 ATOM 2761 N ASP 361 33.221 10.838 -2.895 1.00 0.00 ATOM 2762 CA ASP 361 34.436 10.337 -3.545 1.00 0.00 ATOM 2763 CB ASP 361 34.796 8.934 -3.050 1.00 0.00 ATOM 2764 CG ASP 361 35.287 8.925 -1.637 1.00 0.00 ATOM 2765 OD1 ASP 361 35.750 9.982 -1.158 1.00 0.00 ATOM 2766 OD2 ASP 361 35.215 7.857 -0.998 1.00 0.00 ATOM 2767 O ASP 361 35.308 10.609 -5.758 1.00 0.00 ATOM 2768 C ASP 361 34.353 10.259 -5.065 1.00 0.00 ATOM 2769 N ASN 362 33.218 9.763 -5.556 1.00 0.00 ATOM 2770 CA ASN 362 33.026 9.366 -6.946 1.00 0.00 ATOM 2771 CB ASN 362 33.837 8.104 -7.275 1.00 0.00 ATOM 2772 CG ASN 362 35.217 8.412 -7.833 1.00 0.00 ATOM 2773 ND2 ASN 362 36.238 7.752 -7.295 1.00 0.00 ATOM 2774 OD1 ASN 362 35.361 9.241 -8.724 1.00 0.00 ATOM 2775 O ASN 362 30.876 8.604 -6.260 1.00 0.00 ATOM 2776 C ASN 362 31.567 9.046 -7.182 1.00 0.00 ATOM 2777 N ALA 363 31.120 9.255 -8.423 1.00 0.00 ATOM 2778 CA ALA 363 29.786 8.864 -8.869 1.00 0.00 ATOM 2779 CB ALA 363 29.136 9.976 -9.649 1.00 0.00 ATOM 2780 O ALA 363 30.930 7.347 -10.331 1.00 0.00 ATOM 2781 C ALA 363 29.882 7.612 -9.723 1.00 0.00 ATOM 2782 N TYR 364 28.789 6.855 -9.778 1.00 0.00 ATOM 2783 CA TYR 364 28.717 5.655 -10.624 1.00 0.00 ATOM 2784 CB TYR 364 28.810 4.384 -9.777 1.00 0.00 ATOM 2785 CG TYR 364 30.093 4.297 -9.013 1.00 0.00 ATOM 2786 CD1 TYR 364 31.133 3.476 -9.456 1.00 0.00 ATOM 2787 CD2 TYR 364 30.286 5.057 -7.855 1.00 0.00 ATOM 2788 CE1 TYR 364 32.338 3.389 -8.744 1.00 0.00 ATOM 2789 CE2 TYR 364 31.477 5.012 -7.160 1.00 0.00 ATOM 2790 CZ TYR 364 32.499 4.165 -7.593 1.00 0.00 ATOM 2791 OH TYR 364 33.678 4.099 -6.883 1.00 0.00 ATOM 2792 O TYR 364 26.396 6.077 -11.069 1.00 0.00 ATOM 2793 C TYR 364 27.461 5.609 -11.479 1.00 0.00 ATOM 2794 N ARG 365 27.605 5.113 -12.703 1.00 0.00 ATOM 2795 CA ARG 365 26.454 4.766 -13.526 1.00 0.00 ATOM 2796 CB ARG 365 26.209 5.755 -14.672 1.00 0.00 ATOM 2797 CG ARG 365 24.914 5.428 -15.437 1.00 0.00 ATOM 2798 CD ARG 365 24.462 6.536 -16.346 1.00 0.00 ATOM 2799 NE ARG 365 23.054 6.867 -16.120 1.00 0.00 ATOM 2800 CZ ARG 365 22.381 7.806 -16.787 1.00 0.00 ATOM 2801 NH1 ARG 365 22.978 8.510 -17.751 1.00 0.00 ATOM 2802 NH2 ARG 365 21.102 8.039 -16.491 1.00 0.00 ATOM 2803 O ARG 365 27.678 3.093 -14.716 1.00 0.00 ATOM 2804 C ARG 365 26.660 3.372 -14.076 1.00 0.00 ATOM 2805 N ASP 366 25.685 2.508 -13.813 1.00 0.00 ATOM 2806 CA ASP 366 25.727 1.077 -14.228 1.00 0.00 ATOM 2807 CB ASP 366 25.376 0.880 -15.720 1.00 0.00 ATOM 2808 CG ASP 366 24.337 1.879 -16.232 1.00 0.00 ATOM 2809 OD1 ASP 366 23.533 2.440 -15.413 1.00 0.00 ATOM 2810 OD2 ASP 366 24.347 2.117 -17.464 1.00 0.00 ATOM 2811 O ASP 366 27.752 -0.129 -14.799 1.00 0.00 ATOM 2812 C ASP 366 27.071 0.408 -13.903 1.00 0.00 ATOM 2813 N GLY 367 27.458 0.480 -12.625 1.00 0.00 ATOM 2814 CA GLY 367 28.667 -0.201 -12.130 1.00 0.00 ATOM 2815 O GLY 367 30.848 -0.604 -13.053 1.00 0.00 ATOM 2816 C GLY 367 29.967 0.224 -12.798 1.00 0.00 ATOM 2817 N GLN 368 30.085 1.512 -13.100 1.00 0.00 ATOM 2818 CA GLN 368 31.304 2.038 -13.681 1.00 0.00 ATOM 2819 CB GLN 368 31.292 1.890 -15.212 1.00 0.00 ATOM 2820 CG GLN 368 32.520 2.473 -15.947 1.00 0.00 ATOM 2821 CD GLN 368 33.094 1.524 -17.013 1.00 0.00 ATOM 2822 OE1 GLN 368 33.485 0.387 -16.710 1.00 0.00 ATOM 2823 NE2 GLN 368 33.165 2.001 -18.258 1.00 0.00 ATOM 2824 O GLN 368 30.462 4.241 -13.385 1.00 0.00 ATOM 2825 C GLN 368 31.409 3.476 -13.239 1.00 0.00 ATOM 2826 N VAL 369 32.559 3.820 -12.675 1.00 0.00 ATOM 2827 CA VAL 369 32.842 5.168 -12.216 1.00 0.00 ATOM 2828 CB VAL 369 34.257 5.275 -11.573 1.00 0.00 ATOM 2829 CG1 VAL 369 35.371 5.048 -12.618 1.00 0.00 ATOM 2830 CG2 VAL 369 34.435 6.624 -10.865 1.00 0.00 ATOM 2831 O VAL 369 33.099 6.006 -14.467 1.00 0.00 ATOM 2832 C VAL 369 32.654 6.197 -13.329 1.00 0.00 ATOM 2833 N CYS 370 31.959 7.279 -12.996 1.00 0.00 ATOM 2834 CA CYS 370 31.795 8.377 -13.924 1.00 0.00 ATOM 2835 CB CYS 370 30.694 9.319 -13.442 1.00 0.00 ATOM 2836 SG CYS 370 29.091 8.525 -13.237 1.00 0.00 ATOM 2837 O CYS 370 33.785 9.367 -13.035 1.00 0.00 ATOM 2838 C CYS 370 33.108 9.137 -14.040 1.00 0.00 ATOM 2839 N GLN 371 33.461 9.518 -15.271 1.00 0.00 ATOM 2840 CA GLN 371 34.654 10.314 -15.553 1.00 0.00 ATOM 2841 CB GLN 371 34.956 10.257 -17.054 1.00 0.00 ATOM 2842 CG GLN 371 36.315 10.822 -17.445 1.00 0.00 ATOM 2843 CD GLN 371 37.445 10.116 -16.730 1.00 0.00 ATOM 2844 OE1 GLN 371 38.053 10.664 -15.811 1.00 0.00 ATOM 2845 NE2 GLN 371 37.694 8.881 -17.107 1.00 0.00 ATOM 2846 O GLN 371 34.444 12.726 -15.864 1.00 0.00 ATOM 2847 C GLN 371 34.499 11.778 -15.058 1.00 0.00 ATOM 2848 N TYR 372 34.433 11.938 -13.731 1.00 0.00 ATOM 2849 CA TYR 372 34.266 13.244 -13.077 1.00 0.00 ATOM 2850 CB TYR 372 33.171 13.186 -12.031 1.00 0.00 ATOM 2851 CG TYR 372 31.777 13.008 -12.575 1.00 0.00 ATOM 2852 CD1 TYR 372 31.517 13.153 -13.914 1.00 0.00 ATOM 2853 CD2 TYR 372 30.706 12.728 -11.719 1.00 0.00 ATOM 2854 CE1 TYR 372 30.235 13.004 -14.409 1.00 0.00 ATOM 2855 CE2 TYR 372 29.424 12.572 -12.202 1.00 0.00 ATOM 2856 CZ TYR 372 29.197 12.710 -13.552 1.00 0.00 ATOM 2857 OH TYR 372 27.937 12.557 -14.059 1.00 0.00 ATOM 2858 O TYR 372 35.740 14.878 -12.122 1.00 0.00 ATOM 2859 C TYR 372 35.543 13.687 -12.387 1.00 0.00 ATOM 2860 N ILE 373 36.303 12.681 -11.967 1.00 0.00 ATOM 2861 CA ILE 373 37.730 12.739 -11.645 1.00 0.00 ATOM 2862 CB ILE 373 38.420 13.860 -12.409 1.00 0.00 ATOM 2863 CG1 ILE 373 39.638 13.288 -13.079 1.00 0.00 ATOM 2864 CG2 ILE 373 38.709 15.024 -11.485 1.00 0.00 ATOM 2865 CD1 ILE 373 39.394 11.852 -13.484 1.00 0.00 ATOM 2866 O ILE 373 39.511 12.769 -10.073 1.00 0.00 ATOM 2867 C ILE 373 38.278 12.607 -10.204 1.00 0.00 ENDMDL # command:# Prefix for output files set to decoys/ # command:# request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_815425926.pdb -s /var/tmp/to_scwrl_815425926.seq -o /var/tmp/from_scwrl_815425926.pdb > /var/tmp/scwrl_815425926.log sh: /var/tmp/scwrl_815425926.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_815425926.pdb or /var/tmp/from_scwrl_815425926.pdb.gz for input Warning: Couldn't open file /var/tmp/from_scwrl_815425926_b.pdb or /var/tmp/from_scwrl_815425926_b.pdb.gz for input Trying /var/tmp/from_scwrl_815425926_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_815425926_b.pdb or /var/tmp/from_scwrl_815425926_b.pdb.gz for input Warning: Couldn't open file /var/tmp/from_scwrl_815425926_a.pdb or /var/tmp/from_scwrl_815425926_a.pdb.gz for input Trying /var/tmp/from_scwrl_815425926_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_815425926_a.pdb or /var/tmp/from_scwrl_815425926_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_815425926.pdb or /var/tmp/from_scwrl_815425926_b.pdb or /var/tmp/from_scwrl_815425926_a.pdb Error: no new SCWRL conformation added # command:# naming current conformation model1-scwrl # command:# ReadConformPDB reading from PDB file model2.ts-submitted looking for model 1 # Found a chain break before 371 # copying to AlignedFragments data structure # command:# fraction of real conformation used = 1.000 # GDT_score = -20.673 # GDT_score(maxd=8.000,maxw=2.900)= -20.450 # GDT_score(maxd=8.000,maxw=3.200)= -19.356 # GDT_score(maxd=8.000,maxw=3.500)= -18.377 # GDT_score(maxd=10.000,maxw=3.800)= -20.041 # GDT_score(maxd=10.000,maxw=4.000)= -19.407 # GDT_score(maxd=10.000,maxw=4.200)= -18.789 # GDT_score(maxd=12.000,maxw=4.300)= -20.649 # GDT_score(maxd=12.000,maxw=4.500)= -20.010 # GDT_score(maxd=12.000,maxw=4.700)= -19.405 # GDT_score(maxd=14.000,maxw=5.200)= -19.761 # GDT_score(maxd=14.000,maxw=5.500)= -18.908 # command:# request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_486696746.pdb -s /var/tmp/to_scwrl_486696746.seq -o /var/tmp/from_scwrl_486696746.pdb > /var/tmp/scwrl_486696746.log sh: /var/tmp/scwrl_486696746.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_486696746.pdb or /var/tmp/from_scwrl_486696746.pdb.gz for input Warning: Couldn't open file /var/tmp/from_scwrl_486696746_b.pdb or /var/tmp/from_scwrl_486696746_b.pdb.gz for input Trying /var/tmp/from_scwrl_486696746_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_486696746_b.pdb or /var/tmp/from_scwrl_486696746_b.pdb.gz for input Warning: Couldn't open file /var/tmp/from_scwrl_486696746_a.pdb or /var/tmp/from_scwrl_486696746_a.pdb.gz for input Trying /var/tmp/from_scwrl_486696746_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_486696746_a.pdb or /var/tmp/from_scwrl_486696746_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_486696746.pdb or /var/tmp/from_scwrl_486696746_b.pdb or /var/tmp/from_scwrl_486696746_a.pdb Error: no new SCWRL conformation added # command:# naming current conformation model2-scwrl # command:# ReadConformPDB reading from PDB file model3.ts-submitted looking for model 1 # Found a chain break before 368 # copying to AlignedFragments data structure # command:# fraction of real conformation used = 1.000 # GDT_score = -17.445 # GDT_score(maxd=8.000,maxw=2.900)= -17.121 # GDT_score(maxd=8.000,maxw=3.200)= -16.159 # GDT_score(maxd=8.000,maxw=3.500)= -15.245 # GDT_score(maxd=10.000,maxw=3.800)= -16.757 # GDT_score(maxd=10.000,maxw=4.000)= -16.153 # GDT_score(maxd=10.000,maxw=4.200)= -15.565 # GDT_score(maxd=12.000,maxw=4.300)= -17.455 # GDT_score(maxd=12.000,maxw=4.500)= -16.844 # GDT_score(maxd=12.000,maxw=4.700)= -16.279 # GDT_score(maxd=14.000,maxw=5.200)= -16.862 # GDT_score(maxd=14.000,maxw=5.500)= -16.100 # command:# request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1997783949.pdb -s /var/tmp/to_scwrl_1997783949.seq -o /var/tmp/from_scwrl_1997783949.pdb > /var/tmp/scwrl_1997783949.log sh: /var/tmp/scwrl_1997783949.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1997783949.pdb or /var/tmp/from_scwrl_1997783949.pdb.gz for input Warning: Couldn't open file /var/tmp/from_scwrl_1997783949_b.pdb or /var/tmp/from_scwrl_1997783949_b.pdb.gz for input Trying /var/tmp/from_scwrl_1997783949_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1997783949_b.pdb or /var/tmp/from_scwrl_1997783949_b.pdb.gz for input Warning: Couldn't open file /var/tmp/from_scwrl_1997783949_a.pdb or /var/tmp/from_scwrl_1997783949_a.pdb.gz for input Trying /var/tmp/from_scwrl_1997783949_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1997783949_a.pdb or /var/tmp/from_scwrl_1997783949_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1997783949.pdb or /var/tmp/from_scwrl_1997783949_b.pdb or /var/tmp/from_scwrl_1997783949_a.pdb Error: no new SCWRL conformation added # command:# naming current conformation model3-scwrl # command:# ReadConformPDB reading from PDB file model4.ts-submitted looking for model 1 # Found a chain break before 355 # copying to AlignedFragments data structure # command:# fraction of real conformation used = 1.000 # GDT_score = -28.777 # GDT_score(maxd=8.000,maxw=2.900)= -28.890 # GDT_score(maxd=8.000,maxw=3.200)= -27.076 # GDT_score(maxd=8.000,maxw=3.500)= -25.454 # GDT_score(maxd=10.000,maxw=3.800)= -27.783 # GDT_score(maxd=10.000,maxw=4.000)= -26.756 # GDT_score(maxd=10.000,maxw=4.200)= -25.779 # GDT_score(maxd=12.000,maxw=4.300)= -28.306 # GDT_score(maxd=12.000,maxw=4.500)= -27.315 # GDT_score(maxd=12.000,maxw=4.700)= -26.376 # GDT_score(maxd=14.000,maxw=5.200)= -26.718 # GDT_score(maxd=14.000,maxw=5.500)= -25.469 # command:# request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_832552453.pdb -s /var/tmp/to_scwrl_832552453.seq -o /var/tmp/from_scwrl_832552453.pdb > /var/tmp/scwrl_832552453.log sh: /var/tmp/scwrl_832552453.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_832552453.pdb or /var/tmp/from_scwrl_832552453.pdb.gz for input Warning: Couldn't open file /var/tmp/from_scwrl_832552453_b.pdb or /var/tmp/from_scwrl_832552453_b.pdb.gz for input Trying /var/tmp/from_scwrl_832552453_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_832552453_b.pdb or /var/tmp/from_scwrl_832552453_b.pdb.gz for input Warning: Couldn't open file /var/tmp/from_scwrl_832552453_a.pdb or /var/tmp/from_scwrl_832552453_a.pdb.gz for input Trying /var/tmp/from_scwrl_832552453_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_832552453_a.pdb or /var/tmp/from_scwrl_832552453_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_832552453.pdb or /var/tmp/from_scwrl_832552453_b.pdb or /var/tmp/from_scwrl_832552453_a.pdb Error: no new SCWRL conformation added # command:# naming current conformation model4-scwrl # command:# ReadConformPDB reading from PDB file model5.ts-submitted looking for model 1 # Found a chain break before 355 # copying to AlignedFragments data structure # command:# fraction of real conformation used = 1.000 # GDT_score = -26.374 # GDT_score(maxd=8.000,maxw=2.900)= -26.157 # GDT_score(maxd=8.000,maxw=3.200)= -24.806 # GDT_score(maxd=8.000,maxw=3.500)= -23.530 # GDT_score(maxd=10.000,maxw=3.800)= -25.217 # GDT_score(maxd=10.000,maxw=4.000)= -24.398 # GDT_score(maxd=10.000,maxw=4.200)= -23.586 # GDT_score(maxd=12.000,maxw=4.300)= -25.567 # GDT_score(maxd=12.000,maxw=4.500)= -24.745 # GDT_score(maxd=12.000,maxw=4.700)= -23.940 # GDT_score(maxd=14.000,maxw=5.200)= -24.112 # GDT_score(maxd=14.000,maxw=5.500)= -23.005 # command:# request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_398165853.pdb -s /var/tmp/to_scwrl_398165853.seq -o /var/tmp/from_scwrl_398165853.pdb > /var/tmp/scwrl_398165853.log sh: /var/tmp/scwrl_398165853.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_398165853.pdb or /var/tmp/from_scwrl_398165853.pdb.gz for input Warning: Couldn't open file /var/tmp/from_scwrl_398165853_b.pdb or /var/tmp/from_scwrl_398165853_b.pdb.gz for input Trying /var/tmp/from_scwrl_398165853_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_398165853_b.pdb or /var/tmp/from_scwrl_398165853_b.pdb.gz for input Warning: Couldn't open file /var/tmp/from_scwrl_398165853_a.pdb or /var/tmp/from_scwrl_398165853_a.pdb.gz for input Trying /var/tmp/from_scwrl_398165853_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_398165853_a.pdb or /var/tmp/from_scwrl_398165853_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_398165853.pdb or /var/tmp/from_scwrl_398165853_b.pdb or /var/tmp/from_scwrl_398165853_a.pdb Error: no new SCWRL conformation added # command:# naming current conformation model5-scwrl # command:# Prefix for input files set to decoys/ # command:# ReadConformPDB reading from PDB file T0316.try1-opt2.pdb looking for model 1 # Found a chain break before 371 # copying to AlignedFragments data structure # command:# fraction of real conformation used = 1.000 # GDT_score = -20.398 # GDT_score(maxd=8.000,maxw=2.900)= -20.501 # GDT_score(maxd=8.000,maxw=3.200)= -19.465 # GDT_score(maxd=8.000,maxw=3.500)= -18.394 # GDT_score(maxd=10.000,maxw=3.800)= -19.823 # GDT_score(maxd=10.000,maxw=4.000)= -19.124 # GDT_score(maxd=10.000,maxw=4.200)= -18.469 # GDT_score(maxd=12.000,maxw=4.300)= -20.173 # GDT_score(maxd=12.000,maxw=4.500)= -19.513 # GDT_score(maxd=12.000,maxw=4.700)= -18.886 # GDT_score(maxd=14.000,maxw=5.200)= -19.099 # GDT_score(maxd=14.000,maxw=5.500)= -18.230 # command:# Prefix for output files set to # command:Warning: Couldn't open file T0316.try1-real.pdb for output Error: Couldn't open file T0316.try1-real.pdb for output superimposing iter= 0 total_weight= 4323.000 rmsd (weighted)= 22.057 (unweighted)= 24.763 superimposing iter= 1 total_weight= 7632.469 rmsd (weighted)= 12.876 (unweighted)= 24.748 superimposing iter= 2 total_weight= 4490.730 rmsd (weighted)= 10.025 (unweighted)= 24.982 superimposing iter= 3 total_weight= 3663.614 rmsd (weighted)= 8.658 (unweighted)= 25.486 superimposing iter= 4 total_weight= 3531.675 rmsd (weighted)= 7.586 (unweighted)= 26.318 superimposing iter= 5 total_weight= 3680.770 rmsd (weighted)= 6.514 (unweighted)= 27.226 EXPDTA T0316.try1-opt2.pdb MODEL 1 REMARK 44 REMARK 44 model 1 is called T0316.try1-opt2.pdb ATOM 1 N MET A 1 26.462 25.579 39.572 1.00 0.00 ATOM 2 CA MET A 1 25.983 24.221 39.306 1.00 0.00 ATOM 3 CB MET A 1 24.463 24.149 39.463 1.00 0.00 ATOM 4 CG MET A 1 23.894 22.744 39.349 1.00 0.00 ATOM 5 SD MET A 1 22.106 22.697 39.579 1.00 0.00 ATOM 6 CE MET A 1 21.988 22.907 41.355 1.00 0.00 ATOM 7 O MET A 1 26.192 24.689 36.964 1.00 0.00 ATOM 8 C MET A 1 26.365 23.879 37.875 1.00 0.00 ATOM 9 N SER A 2 26.856 22.643 37.682 1.00 0.00 ATOM 10 CA SER A 2 27.305 22.212 36.357 1.00 0.00 ATOM 11 CB SER A 2 27.793 20.772 36.451 1.00 0.00 ATOM 12 OG SER A 2 26.824 19.975 37.114 1.00 0.00 ATOM 13 O SER A 2 26.489 22.496 34.138 1.00 0.00 ATOM 14 C SER A 2 26.208 22.304 35.315 1.00 0.00 ATOM 15 N ASP A 3 24.962 22.133 35.733 1.00 0.00 ATOM 16 CA ASP A 3 23.858 22.184 34.789 1.00 0.00 ATOM 17 CB ASP A 3 22.591 21.581 35.394 1.00 0.00 ATOM 18 CG ASP A 3 22.673 20.034 35.549 1.00 0.00 ATOM 19 OD1 ASP A 3 23.366 19.365 34.744 1.00 0.00 ATOM 20 OD2 ASP A 3 22.014 19.517 36.476 1.00 0.00 ATOM 21 O ASP A 3 22.868 23.704 33.239 1.00 0.00 ATOM 22 C ASP A 3 23.556 23.571 34.243 1.00 0.00 ATOM 23 N ASN A 4 24.089 24.634 34.985 1.00 0.00 ATOM 24 CA ASN A 4 23.873 26.008 34.545 1.00 0.00 ATOM 25 CB ASN A 4 24.125 26.979 35.686 1.00 0.00 ATOM 26 CG ASN A 4 22.945 27.136 36.574 1.00 0.00 ATOM 27 ND2 ASN A 4 21.776 26.677 36.130 1.00 0.00 ATOM 28 OD1 ASN A 4 23.068 27.681 37.664 1.00 0.00 ATOM 29 O ASN A 4 24.635 27.443 32.780 1.00 0.00 ATOM 30 C ASN A 4 24.772 26.371 33.373 1.00 0.00 ATOM 31 N SER A 5 25.709 25.482 33.075 1.00 0.00 ATOM 32 CA SER A 5 26.642 25.691 31.963 1.00 0.00 ATOM 33 CB SER A 5 27.601 24.505 31.837 1.00 0.00 ATOM 34 OG SER A 5 26.905 23.326 31.471 1.00 0.00 ATOM 35 O SER A 5 26.427 26.550 29.706 1.00 0.00 ATOM 36 C SER A 5 25.934 25.849 30.603 1.00 0.00 ATOM 37 N LYS A 6 24.729 25.290 30.487 1.00 0.00 ATOM 38 CA LYS A 6 23.931 25.420 29.268 1.00 0.00 ATOM 39 CB LYS A 6 22.614 24.654 29.405 1.00 0.00 ATOM 40 CG LYS A 6 22.773 23.143 29.408 1.00 0.00 ATOM 41 CD LYS A 6 21.429 22.446 29.553 1.00 0.00 ATOM 42 CE LYS A 6 21.589 20.935 29.560 1.00 0.00 ATOM 43 NZ LYS A 6 20.283 20.239 29.735 1.00 0.00 ATOM 44 O LYS A 6 23.255 27.156 27.746 1.00 0.00 ATOM 45 C LYS A 6 23.553 26.867 28.905 1.00 0.00 ATOM 46 N THR A 7 23.502 27.760 29.896 1.00 0.00 ATOM 47 CA THR A 7 23.085 29.155 29.651 1.00 0.00 ATOM 48 CB THR A 7 23.113 29.989 30.946 1.00 0.00 ATOM 49 CG2 THR A 7 22.719 31.429 30.661 1.00 0.00 ATOM 50 OG1 THR A 7 22.194 29.434 31.895 1.00 0.00 ATOM 51 O THR A 7 23.664 31.010 28.216 1.00 0.00 ATOM 52 C THR A 7 24.027 29.985 28.806 1.00 0.00 ATOM 53 N ARG A 8 25.590 29.577 29.512 1.00 0.00 ATOM 54 CA ARG A 8 26.589 30.332 28.747 1.00 0.00 ATOM 55 CB ARG A 8 27.999 30.041 29.263 1.00 0.00 ATOM 56 CG ARG A 8 28.239 30.490 30.695 1.00 0.00 ATOM 57 CD ARG A 8 29.625 30.088 31.173 1.00 0.00 ATOM 58 NE ARG A 8 29.866 30.493 32.557 1.00 0.00 ATOM 59 CZ ARG A 8 30.955 30.175 33.250 1.00 0.00 ATOM 60 NH1 ARG A 8 31.086 30.590 34.503 1.00 0.00 ATOM 61 NH2 ARG A 8 31.908 29.446 32.689 1.00 0.00 ATOM 62 O ARG A 8 26.520 28.785 26.911 1.00 0.00 ATOM 63 C ARG A 8 26.516 29.965 27.276 1.00 0.00 ATOM 64 N VAL A 9 26.431 30.977 26.423 1.00 0.00 ATOM 65 CA VAL A 9 26.368 30.725 24.989 1.00 0.00 ATOM 66 CB VAL A 9 24.957 30.989 24.431 1.00 0.00 ATOM 67 CG1 VAL A 9 24.927 30.753 22.929 1.00 0.00 ATOM 68 CG2 VAL A 9 23.944 30.061 25.084 1.00 0.00 ATOM 69 O VAL A 9 27.316 32.863 24.462 1.00 0.00 ATOM 70 C VAL A 9 27.343 31.644 24.274 1.00 0.00 ATOM 71 N VAL A 10 28.164 31.072 23.430 1.00 0.00 ATOM 72 CA VAL A 10 29.142 31.840 22.680 1.00 0.00 ATOM 73 CB VAL A 10 30.424 31.039 22.381 1.00 0.00 ATOM 74 CG1 VAL A 10 31.382 31.865 21.536 1.00 0.00 ATOM 75 CG2 VAL A 10 31.128 30.657 23.673 1.00 0.00 ATOM 76 O VAL A 10 27.848 31.638 20.688 1.00 0.00 ATOM 77 C VAL A 10 28.610 32.332 21.348 1.00 0.00 ATOM 78 N VAL A 11 29.001 33.539 20.967 1.00 0.00 ATOM 79 CA VAL A 11 28.589 34.118 19.700 1.00 0.00 ATOM 80 CB VAL A 11 27.611 35.290 19.908 1.00 0.00 ATOM 81 CG1 VAL A 11 27.219 35.901 18.572 1.00 0.00 ATOM 82 CG2 VAL A 11 26.347 34.811 20.607 1.00 0.00 ATOM 83 O VAL A 11 30.698 35.280 19.597 1.00 0.00 ATOM 84 C VAL A 11 29.837 34.626 18.983 1.00 0.00 ATOM 85 N GLY A 12 29.963 34.277 17.701 1.00 0.00 ATOM 86 CA GLY A 12 31.064 34.757 16.871 1.00 0.00 ATOM 87 O GLY A 12 29.708 36.258 15.550 1.00 0.00 ATOM 88 C GLY A 12 30.518 36.124 16.473 1.00 0.00 ATOM 89 N MET A 13 30.968 37.135 17.209 1.00 0.00 ATOM 90 CA MET A 13 30.497 38.502 17.088 1.00 0.00 ATOM 91 CB MET A 13 30.637 39.238 18.422 1.00 0.00 ATOM 92 CG MET A 13 30.113 40.664 18.402 1.00 0.00 ATOM 93 SD MET A 13 28.351 40.752 18.029 1.00 0.00 ATOM 94 CE MET A 13 27.649 40.158 19.565 1.00 0.00 ATOM 95 O MET A 13 32.274 39.921 16.345 1.00 0.00 ATOM 96 C MET A 13 31.206 39.376 16.078 1.00 0.00 ATOM 97 N SER A 14 30.579 39.535 14.918 1.00 0.00 ATOM 98 CA SER A 14 31.145 40.329 13.834 1.00 0.00 ATOM 99 CB SER A 14 30.499 39.953 12.499 1.00 0.00 ATOM 100 OG SER A 14 29.121 40.284 12.490 1.00 0.00 ATOM 101 O SER A 14 31.714 42.631 13.540 1.00 0.00 ATOM 102 C SER A 14 30.935 41.821 14.036 1.00 0.00 ATOM 103 N GLY A 15 29.867 42.186 14.739 1.00 0.00 ATOM 104 CA GLY A 15 29.594 43.590 14.971 1.00 0.00 ATOM 105 O GLY A 15 28.055 45.279 14.249 1.00 0.00 ATOM 106 C GLY A 15 28.480 44.133 14.089 1.00 0.00 ATOM 107 N GLY A 16 28.017 43.322 13.146 1.00 0.00 ATOM 108 CA GLY A 16 26.941 43.753 12.272 1.00 0.00 ATOM 109 O GLY A 16 25.484 43.259 14.115 1.00 0.00 ATOM 110 C GLY A 16 25.589 43.673 12.956 1.00 0.00 ATOM 111 N VAL A 17 24.540 44.047 12.233 1.00 0.00 ATOM 112 CA VAL A 17 23.199 44.033 12.797 1.00 0.00 ATOM 113 CB VAL A 17 22.146 44.469 11.760 1.00 0.00 ATOM 114 CG1 VAL A 17 20.742 44.257 12.303 1.00 0.00 ATOM 115 CG2 VAL A 17 22.313 45.943 11.420 1.00 0.00 ATOM 116 O VAL A 17 22.237 42.522 14.397 1.00 0.00 ATOM 117 C VAL A 17 22.765 42.655 13.296 1.00 0.00 ATOM 118 N ASP A 18 22.988 41.624 12.492 1.00 0.00 ATOM 119 CA ASP A 18 22.583 40.285 12.886 1.00 0.00 ATOM 120 CB ASP A 18 23.041 39.259 11.847 1.00 0.00 ATOM 121 CG ASP A 18 22.407 37.897 12.053 1.00 0.00 ATOM 122 OD1 ASP A 18 21.503 37.786 12.908 1.00 0.00 ATOM 123 OD2 ASP A 18 22.813 36.942 11.358 1.00 0.00 ATOM 124 O ASP A 18 22.398 39.327 15.076 1.00 0.00 ATOM 125 C ASP A 18 23.147 39.817 14.225 1.00 0.00 ATOM 126 N SER A 19 24.458 39.961 14.429 1.00 0.00 ATOM 127 CA SER A 19 25.031 39.494 15.686 1.00 0.00 ATOM 128 CB SER A 19 26.548 39.343 15.560 1.00 0.00 ATOM 129 OG SER A 19 27.169 40.597 15.342 1.00 0.00 ATOM 130 O SER A 19 24.682 40.042 17.990 1.00 0.00 ATOM 131 C SER A 19 24.756 40.466 16.842 1.00 0.00 ATOM 132 N SER A 20 24.578 41.748 16.532 1.00 0.00 ATOM 133 CA SER A 20 24.262 42.724 17.581 1.00 0.00 ATOM 134 CB SER A 20 24.310 44.147 17.021 1.00 0.00 ATOM 135 OG SER A 20 25.629 44.502 16.643 1.00 0.00 ATOM 136 O SER A 20 22.668 42.340 19.337 1.00 0.00 ATOM 137 C SER A 20 22.863 42.451 18.122 1.00 0.00 ATOM 138 N VAL A 21 21.888 42.313 17.225 1.00 0.00 ATOM 139 CA VAL A 21 20.523 42.042 17.665 1.00 0.00 ATOM 140 CB VAL A 21 19.535 42.061 16.484 1.00 0.00 ATOM 141 CG1 VAL A 21 18.159 41.593 16.932 1.00 0.00 ATOM 142 CG2 VAL A 21 19.403 43.468 15.922 1.00 0.00 ATOM 143 O VAL A 21 19.700 40.534 19.329 1.00 0.00 ATOM 144 C VAL A 21 20.397 40.679 18.331 1.00 0.00 ATOM 145 N THR A 22 21.067 39.662 17.790 1.00 0.00 ATOM 146 CA THR A 22 20.988 38.340 18.389 1.00 0.00 ATOM 147 CB THR A 22 21.742 37.293 17.550 1.00 0.00 ATOM 148 CG2 THR A 22 21.676 35.927 18.217 1.00 0.00 ATOM 149 OG1 THR A 22 21.149 37.202 16.248 1.00 0.00 ATOM 150 O THR A 22 21.032 37.696 20.695 1.00 0.00 ATOM 151 C THR A 22 21.589 38.303 19.793 1.00 0.00 ATOM 152 N ALA A 23 22.726 38.962 19.986 1.00 0.00 ATOM 153 CA ALA A 23 23.343 38.950 21.307 1.00 0.00 ATOM 154 CB ALA A 23 24.687 39.662 21.270 1.00 0.00 ATOM 155 O ALA A 23 22.254 39.152 23.439 1.00 0.00 ATOM 156 C ALA A 23 22.453 39.658 22.333 1.00 0.00 ATOM 157 N LEU A 24 21.905 40.809 21.950 1.00 0.00 ATOM 158 CA LEU A 24 21.029 41.573 22.837 1.00 0.00 ATOM 159 CB LEU A 24 20.559 42.857 22.151 1.00 0.00 ATOM 160 CG LEU A 24 19.645 43.769 22.971 1.00 0.00 ATOM 161 CD1 LEU A 24 20.355 44.253 24.227 1.00 0.00 ATOM 162 CD2 LEU A 24 19.230 44.985 22.159 1.00 0.00 ATOM 163 O LEU A 24 19.409 40.700 24.375 1.00 0.00 ATOM 164 C LEU A 24 19.804 40.744 23.210 1.00 0.00 ATOM 165 N LEU A 25 19.214 40.089 22.206 1.00 0.00 ATOM 166 CA LEU A 25 18.032 39.248 22.387 1.00 0.00 ATOM 167 CB LEU A 25 17.517 38.730 21.033 1.00 0.00 ATOM 168 CG LEU A 25 16.815 39.791 20.181 1.00 0.00 ATOM 169 CD1 LEU A 25 16.633 39.224 18.762 1.00 0.00 ATOM 170 CD2 LEU A 25 15.428 40.143 20.792 1.00 0.00 ATOM 171 O LEU A 25 17.475 37.705 24.147 1.00 0.00 ATOM 172 C LEU A 25 18.308 38.062 23.313 1.00 0.00 ATOM 173 N LEU A 26 19.505 37.497 23.093 1.00 0.00 ATOM 174 CA LEU A 26 19.869 36.349 23.922 1.00 0.00 ATOM 175 CB LEU A 26 21.181 35.732 23.436 1.00 0.00 ATOM 176 CG LEU A 26 21.137 35.024 22.080 1.00 0.00 ATOM 177 CD1 LEU A 26 22.534 34.618 21.638 1.00 0.00 ATOM 178 CD2 LEU A 26 20.279 33.771 22.156 1.00 0.00 ATOM 179 O LEU A 26 19.558 36.063 26.288 1.00 0.00 ATOM 180 C LEU A 26 19.983 36.778 25.382 1.00 0.00 ATOM 181 N LYS A 27 20.562 37.948 25.603 1.00 0.00 ATOM 182 CA LYS A 27 20.739 38.456 26.957 1.00 0.00 ATOM 183 CB LYS A 27 21.607 39.715 26.984 1.00 0.00 ATOM 184 CG LYS A 27 21.864 40.261 28.379 1.00 0.00 ATOM 185 CD LYS A 27 22.801 41.459 28.338 1.00 0.00 ATOM 186 CE LYS A 27 23.031 42.026 29.729 1.00 0.00 ATOM 187 NZ LYS A 27 23.904 43.234 29.699 1.00 0.00 ATOM 188 O LYS A 27 19.019 38.400 28.667 1.00 0.00 ATOM 189 C LYS A 27 19.351 38.788 27.538 1.00 0.00 ATOM 190 N GLU A 28 18.548 39.491 26.751 1.00 0.00 ATOM 191 CA GLU A 28 17.216 39.890 27.175 1.00 0.00 ATOM 192 CB GLU A 28 16.502 40.651 26.054 1.00 0.00 ATOM 193 CG GLU A 28 17.065 42.038 25.793 1.00 0.00 ATOM 194 CD GLU A 28 16.397 42.724 24.616 1.00 0.00 ATOM 195 OE1 GLU A 28 15.543 42.087 23.963 1.00 0.00 ATOM 196 OE2 GLU A 28 16.726 43.898 24.349 1.00 0.00 ATOM 197 O GLU A 28 15.516 38.801 28.463 1.00 0.00 ATOM 198 C GLU A 28 16.338 38.704 27.545 1.00 0.00 ATOM 199 N GLN A 29 16.510 37.584 26.845 1.00 0.00 ATOM 200 CA GLN A 29 15.682 36.407 27.108 1.00 0.00 ATOM 201 CB GLN A 29 15.552 35.552 25.845 1.00 0.00 ATOM 202 CG GLN A 29 14.896 36.269 24.676 1.00 0.00 ATOM 203 CD GLN A 29 13.489 36.735 24.993 1.00 0.00 ATOM 204 OE1 GLN A 29 12.674 35.972 25.512 1.00 0.00 ATOM 205 NE2 GLN A 29 13.200 37.993 24.682 1.00 0.00 ATOM 206 O GLN A 29 15.651 34.410 28.438 1.00 0.00 ATOM 207 C GLN A 29 16.215 35.478 28.194 1.00 0.00 ATOM 208 N GLY A 30 17.295 35.872 28.851 1.00 0.00 ATOM 209 CA GLY A 30 17.795 35.061 29.946 1.00 0.00 ATOM 210 O GLY A 30 19.482 33.617 30.752 1.00 0.00 ATOM 211 C GLY A 30 19.052 34.247 29.788 1.00 0.00 ATOM 212 N TYR A 31 19.645 34.234 28.595 1.00 0.00 ATOM 213 CA TYR A 31 20.879 33.503 28.394 1.00 0.00 ATOM 214 CB TYR A 31 21.044 33.125 26.922 1.00 0.00 ATOM 215 CG TYR A 31 20.080 32.061 26.450 1.00 0.00 ATOM 216 CD1 TYR A 31 18.879 32.409 25.843 1.00 0.00 ATOM 217 CD2 TYR A 31 20.371 30.713 26.611 1.00 0.00 ATOM 218 CE1 TYR A 31 17.991 31.444 25.408 1.00 0.00 ATOM 219 CE2 TYR A 31 19.495 29.734 26.184 1.00 0.00 ATOM 220 CZ TYR A 31 18.297 30.111 25.577 1.00 0.00 ATOM 221 OH TYR A 31 17.413 29.148 25.145 1.00 0.00 ATOM 222 O TYR A 31 21.851 35.595 29.126 1.00 0.00 ATOM 223 C TYR A 31 22.040 34.401 28.831 1.00 0.00 ATOM 224 N ASP A 32 23.235 33.834 28.887 1.00 0.00 ATOM 225 CA ASP A 32 24.409 34.589 29.274 1.00 0.00 ATOM 226 CB ASP A 32 25.038 33.993 30.536 1.00 0.00 ATOM 227 CG ASP A 32 26.219 34.801 31.036 1.00 0.00 ATOM 228 OD1 ASP A 32 26.587 35.791 30.369 1.00 0.00 ATOM 229 OD2 ASP A 32 26.777 34.445 32.095 1.00 0.00 ATOM 230 O ASP A 32 26.221 33.610 28.046 1.00 0.00 ATOM 231 C ASP A 32 25.380 34.506 28.100 1.00 0.00 ATOM 232 N VAL A 33 25.274 35.449 27.153 1.00 0.00 ATOM 233 CA VAL A 33 26.159 35.442 25.983 1.00 0.00 ATOM 234 CB VAL A 33 25.605 36.325 24.849 1.00 0.00 ATOM 235 CG1 VAL A 33 26.594 36.397 23.697 1.00 0.00 ATOM 236 CG2 VAL A 33 24.295 35.757 24.324 1.00 0.00 ATOM 237 O VAL A 33 27.820 36.914 26.924 1.00 0.00 ATOM 238 C VAL A 33 27.579 35.941 26.193 1.00 0.00 ATOM 239 N ILE A 34 28.520 35.239 25.561 1.00 0.00 ATOM 240 CA ILE A 34 29.929 35.606 25.590 1.00 0.00 ATOM 241 CB ILE A 34 30.794 34.476 26.182 1.00 0.00 ATOM 242 CG1 ILE A 34 30.372 34.183 27.624 1.00 0.00 ATOM 243 CG2 ILE A 34 32.263 34.874 26.181 1.00 0.00 ATOM 244 CD1 ILE A 34 31.013 32.940 28.204 1.00 0.00 ATOM 245 O ILE A 34 29.991 35.024 23.265 1.00 0.00 ATOM 246 C ILE A 34 30.280 35.857 24.135 1.00 0.00 ATOM 247 N GLY A 35 30.901 36.998 23.875 1.00 0.00 ATOM 248 CA GLY A 35 31.244 37.361 22.504 1.00 0.00 ATOM 249 O GLY A 35 33.605 37.391 22.979 1.00 0.00 ATOM 250 C GLY A 35 32.707 37.119 22.172 1.00 0.00 ATOM 251 N ILE A 36 32.928 36.595 20.962 1.00 0.00 ATOM 252 CA ILE A 36 34.261 36.320 20.450 1.00 0.00 ATOM 253 CB ILE A 36 34.542 34.808 20.390 1.00 0.00 ATOM 254 CG1 ILE A 36 34.444 34.189 21.786 1.00 0.00 ATOM 255 CG2 ILE A 36 35.937 34.547 19.844 1.00 0.00 ATOM 256 CD1 ILE A 36 34.530 32.680 21.792 1.00 0.00 ATOM 257 O ILE A 36 33.567 36.554 18.155 1.00 0.00 ATOM 258 C ILE A 36 34.354 36.909 19.040 1.00 0.00 ATOM 259 N PHE A 37 35.298 37.823 18.851 1.00 0.00 ATOM 260 CA PHE A 37 35.498 38.471 17.559 1.00 0.00 ATOM 261 CB PHE A 37 35.497 39.993 17.716 1.00 0.00 ATOM 262 CG PHE A 37 35.676 40.736 16.423 1.00 0.00 ATOM 263 CD1 PHE A 37 34.641 40.826 15.510 1.00 0.00 ATOM 264 CD2 PHE A 37 36.882 41.347 16.120 1.00 0.00 ATOM 265 CE1 PHE A 37 34.806 41.511 14.321 1.00 0.00 ATOM 266 CE2 PHE A 37 37.047 42.030 14.931 1.00 0.00 ATOM 267 CZ PHE A 37 36.016 42.114 14.032 1.00 0.00 ATOM 268 O PHE A 37 37.864 38.139 17.653 1.00 0.00 ATOM 269 C PHE A 37 36.839 38.019 16.998 1.00 0.00 ATOM 270 N MET A 38 36.834 37.464 15.790 1.00 0.00 ATOM 271 CA MET A 38 38.093 37.027 15.209 1.00 0.00 ATOM 272 CB MET A 38 37.860 35.870 14.234 1.00 0.00 ATOM 273 CG MET A 38 39.126 35.347 13.577 1.00 0.00 ATOM 274 SD MET A 38 38.832 33.883 12.567 1.00 0.00 ATOM 275 CE MET A 38 40.441 33.667 11.807 1.00 0.00 ATOM 276 O MET A 38 38.166 38.753 13.580 1.00 0.00 ATOM 277 C MET A 38 38.777 38.145 14.447 1.00 0.00 ATOM 278 N LYS A 39 40.018 38.260 15.090 1.00 0.00 ATOM 279 CA LYS A 39 40.795 39.236 14.343 1.00 0.00 ATOM 280 CB LYS A 39 41.888 39.841 15.228 1.00 0.00 ATOM 281 CG LYS A 39 42.757 40.870 14.525 1.00 0.00 ATOM 282 CD LYS A 39 43.772 41.480 15.478 1.00 0.00 ATOM 283 CE LYS A 39 44.645 42.506 14.774 1.00 0.00 ATOM 284 NZ LYS A 39 45.592 43.167 15.713 1.00 0.00 ATOM 285 O LYS A 39 41.826 37.364 13.278 1.00 0.00 ATOM 286 C LYS A 39 41.433 38.526 13.160 1.00 0.00 ATOM 287 N ASN A 40 41.518 39.199 12.015 1.00 0.00 ATOM 288 CA ASN A 40 42.189 38.570 10.893 1.00 0.00 ATOM 289 CB ASN A 40 41.876 39.315 9.594 1.00 0.00 ATOM 290 CG ASN A 40 42.503 40.696 9.549 1.00 0.00 ATOM 291 ND2 ASN A 40 42.151 41.470 8.530 1.00 0.00 ATOM 292 OD1 ASN A 40 43.294 41.057 10.421 1.00 0.00 ATOM 293 O ASN A 40 44.073 39.199 12.257 1.00 0.00 ATOM 294 C ASN A 40 43.686 38.642 11.224 1.00 0.00 ATOM 295 N TRP A 41 44.532 38.117 10.351 1.00 0.00 ATOM 296 CA TRP A 41 45.965 38.064 10.615 1.00 0.00 ATOM 297 CB TRP A 41 46.495 36.642 10.419 1.00 0.00 ATOM 298 CG TRP A 41 46.227 36.086 9.054 1.00 0.00 ATOM 299 CD1 TRP A 41 45.151 35.338 8.670 1.00 0.00 ATOM 300 CD2 TRP A 41 47.049 36.234 7.890 1.00 0.00 ATOM 301 CE2 TRP A 41 46.410 35.549 6.837 1.00 0.00 ATOM 302 CE3 TRP A 41 48.263 36.879 7.634 1.00 0.00 ATOM 303 NE1 TRP A 41 45.251 35.010 7.340 1.00 0.00 ATOM 304 CZ2 TRP A 41 46.944 35.490 5.551 1.00 0.00 ATOM 305 CZ3 TRP A 41 48.788 36.819 6.357 1.00 0.00 ATOM 306 CH2 TRP A 41 48.131 36.131 5.330 1.00 0.00 ATOM 307 O TRP A 41 46.079 39.429 8.646 1.00 0.00 ATOM 308 C TRP A 41 46.651 39.000 9.651 1.00 0.00 ATOM 309 N ASP A 42 47.925 39.267 9.945 1.00 0.00 ATOM 310 CA ASP A 42 48.750 40.060 9.079 1.00 0.00 ATOM 311 CB ASP A 42 50.171 40.160 9.636 1.00 0.00 ATOM 312 CG ASP A 42 50.243 40.983 10.906 1.00 0.00 ATOM 313 OD1 ASP A 42 49.702 42.108 10.917 1.00 0.00 ATOM 314 OD2 ASP A 42 50.840 40.503 11.894 1.00 0.00 ATOM 315 O ASP A 42 48.949 38.285 7.496 1.00 0.00 ATOM 316 C ASP A 42 48.872 39.503 7.661 1.00 0.00 ATOM 317 N ASP A 43 48.453 40.590 6.769 1.00 0.00 ATOM 318 CA ASP A 43 48.640 40.187 5.372 1.00 0.00 ATOM 319 CB ASP A 43 48.509 41.395 4.444 1.00 0.00 ATOM 320 CG ASP A 43 47.077 41.873 4.306 1.00 0.00 ATOM 321 OD1 ASP A 43 46.164 41.151 4.761 1.00 0.00 ATOM 322 OD2 ASP A 43 46.867 42.968 3.743 1.00 0.00 ATOM 323 O ASP A 43 50.247 38.994 4.048 1.00 0.00 ATOM 324 C ASP A 43 50.005 39.565 5.105 1.00 0.00 ATOM 325 N THR A 44 50.969 39.671 6.010 1.00 0.00 ATOM 326 CA THR A 44 52.257 39.039 5.782 1.00 0.00 ATOM 327 CB THR A 44 53.399 40.072 5.764 1.00 0.00 ATOM 328 CG2 THR A 44 53.186 41.081 4.645 1.00 0.00 ATOM 329 OG1 THR A 44 53.437 40.769 7.015 1.00 0.00 ATOM 330 O THR A 44 53.701 37.476 6.826 1.00 0.00 ATOM 331 C THR A 44 52.588 38.015 6.877 1.00 0.00 ATOM 332 N ASP A 45 51.693 37.783 7.820 1.00 0.00 ATOM 333 CA ASP A 45 51.953 36.966 8.991 1.00 0.00 ATOM 334 CB ASP A 45 52.148 35.502 8.589 1.00 0.00 ATOM 335 CG ASP A 45 52.042 34.557 9.769 1.00 0.00 ATOM 336 OD1 ASP A 45 51.504 34.971 10.817 1.00 0.00 ATOM 337 OD2 ASP A 45 52.497 33.400 9.645 1.00 0.00 ATOM 338 O ASP A 45 54.141 36.676 10.045 1.00 0.00 ATOM 339 C ASP A 45 53.220 37.432 9.722 1.00 0.00 ATOM 340 N GLU A 46 53.270 38.729 9.983 1.00 0.00 ATOM 341 CA GLU A 46 54.415 39.384 10.582 1.00 0.00 ATOM 342 CB GLU A 46 54.980 40.444 9.637 1.00 0.00 ATOM 343 CG GLU A 46 56.184 41.190 10.189 1.00 0.00 ATOM 344 CD GLU A 46 56.744 42.202 9.208 1.00 0.00 ATOM 345 OE1 GLU A 46 56.139 42.381 8.130 1.00 0.00 ATOM 346 OE2 GLU A 46 57.788 42.813 9.516 1.00 0.00 ATOM 347 O GLU A 46 53.064 40.919 11.784 1.00 0.00 ATOM 348 C GLU A 46 54.041 40.197 11.797 1.00 0.00 ATOM 349 N ASN A 47 54.828 40.043 12.903 1.00 0.00 ATOM 350 CA ASN A 47 54.570 40.844 14.092 1.00 0.00 ATOM 351 CB ASN A 47 54.708 40.030 15.380 1.00 0.00 ATOM 352 CG ASN A 47 53.653 38.945 15.498 1.00 0.00 ATOM 353 ND2 ASN A 47 54.095 37.692 15.493 1.00 0.00 ATOM 354 OD1 ASN A 47 52.460 39.233 15.593 1.00 0.00 ATOM 355 O ASN A 47 55.533 42.725 15.181 1.00 0.00 ATOM 356 C ASN A 47 55.543 42.016 14.158 1.00 0.00 ATOM 357 N GLY A 48 56.059 42.189 12.760 1.00 0.00 ATOM 358 CA GLY A 48 57.064 43.230 12.819 1.00 0.00 ATOM 359 O GLY A 48 57.472 45.526 12.494 1.00 0.00 ATOM 360 C GLY A 48 56.607 44.633 12.501 1.00 0.00 ATOM 361 N VAL A 49 55.337 44.887 12.221 1.00 0.00 ATOM 362 CA VAL A 49 54.889 46.250 11.912 1.00 0.00 ATOM 363 CB VAL A 49 53.623 46.242 11.034 1.00 0.00 ATOM 364 CG1 VAL A 49 53.221 47.662 10.667 1.00 0.00 ATOM 365 CG2 VAL A 49 53.869 45.464 9.751 1.00 0.00 ATOM 366 O VAL A 49 53.434 47.071 13.673 1.00 0.00 ATOM 367 C VAL A 49 54.573 46.988 13.206 1.00 0.00 ATOM 368 N CYS A 50 55.613 47.505 13.826 1.00 0.00 ATOM 369 CA CYS A 50 55.483 48.400 14.973 1.00 0.00 ATOM 370 CB CYS A 50 56.862 48.869 15.445 1.00 0.00 ATOM 371 SG CYS A 50 57.884 47.568 16.171 1.00 0.00 ATOM 372 O CYS A 50 54.067 50.196 15.678 1.00 0.00 ATOM 373 C CYS A 50 54.679 49.670 14.740 1.00 0.00 ATOM 374 N THR A 51 54.670 50.117 13.479 1.00 0.00 ATOM 375 CA THR A 51 53.951 51.345 13.115 1.00 0.00 ATOM 376 CB THR A 51 54.100 51.661 11.615 1.00 0.00 ATOM 377 CG2 THR A 51 53.313 52.913 11.255 1.00 0.00 ATOM 378 OG1 THR A 51 55.482 51.877 11.303 1.00 0.00 ATOM 379 O THR A 51 51.798 52.069 13.998 1.00 0.00 ATOM 380 C THR A 51 52.470 51.188 13.425 1.00 0.00 ATOM 381 N ALA A 52 52.005 49.933 12.975 1.00 0.00 ATOM 382 CA ALA A 52 50.580 49.634 13.127 1.00 0.00 ATOM 383 CB ALA A 52 50.275 48.237 12.609 1.00 0.00 ATOM 384 O ALA A 52 48.933 50.039 14.812 1.00 0.00 ATOM 385 C ALA A 52 50.055 49.612 14.560 1.00 0.00 ATOM 386 N THR A 53 50.864 49.080 15.478 1.00 0.00 ATOM 387 CA THR A 53 50.449 48.971 16.880 1.00 0.00 ATOM 388 CB THR A 53 51.550 48.384 17.783 1.00 0.00 ATOM 389 CG2 THR A 53 51.880 46.960 17.364 1.00 0.00 ATOM 390 OG1 THR A 53 52.734 49.184 17.681 1.00 0.00 ATOM 391 O THR A 53 49.559 50.426 18.573 1.00 0.00 ATOM 392 C THR A 53 50.118 50.345 17.477 1.00 0.00 ATOM 393 N GLU A 54 50.461 51.414 16.759 1.00 0.00 ATOM 394 CA GLU A 54 50.179 52.773 17.221 1.00 0.00 ATOM 395 CB GLU A 54 51.416 53.661 17.064 1.00 0.00 ATOM 396 CG GLU A 54 52.609 53.213 17.891 1.00 0.00 ATOM 397 CD GLU A 54 53.810 54.122 17.723 1.00 0.00 ATOM 398 OE1 GLU A 54 53.699 55.119 16.976 1.00 0.00 ATOM 399 OE2 GLU A 54 54.861 53.839 18.334 1.00 0.00 ATOM 400 O GLU A 54 48.626 54.534 16.844 1.00 0.00 ATOM 401 C GLU A 54 49.048 53.453 16.456 1.00 0.00 ATOM 402 N ASP A 55 48.542 52.841 15.375 1.00 0.00 ATOM 403 CA ASP A 55 47.483 53.440 14.625 1.00 0.00 ATOM 404 CB ASP A 55 47.804 53.412 13.129 1.00 0.00 ATOM 405 CG ASP A 55 49.045 54.212 12.785 1.00 0.00 ATOM 406 OD1 ASP A 55 49.135 55.383 13.209 1.00 0.00 ATOM 407 OD2 ASP A 55 49.928 53.666 12.089 1.00 0.00 ATOM 408 O ASP A 55 45.195 53.066 14.083 1.00 0.00 ATOM 409 C ASP A 55 46.149 52.754 14.794 1.00 0.00 ATOM 410 N TYR A 56 46.059 51.872 15.771 1.00 0.00 ATOM 411 CA TYR A 56 44.791 51.288 16.126 1.00 0.00 ATOM 412 CB TYR A 56 44.993 50.116 17.089 1.00 0.00 ATOM 413 CG TYR A 56 43.705 49.460 17.533 1.00 0.00 ATOM 414 CD1 TYR A 56 43.005 48.614 16.683 1.00 0.00 ATOM 415 CD2 TYR A 56 43.193 49.691 18.804 1.00 0.00 ATOM 416 CE1 TYR A 56 41.827 48.012 17.082 1.00 0.00 ATOM 417 CE2 TYR A 56 42.016 49.096 19.220 1.00 0.00 ATOM 418 CZ TYR A 56 41.334 48.252 18.346 1.00 0.00 ATOM 419 OH TYR A 56 40.162 47.653 18.746 1.00 0.00 ATOM 420 O TYR A 56 44.405 53.036 17.645 1.00 0.00 ATOM 421 C TYR A 56 43.908 52.323 16.800 1.00 0.00 ATOM 422 N LYS A 57 42.631 52.370 16.454 1.00 0.00 ATOM 423 CA LYS A 57 41.693 53.276 17.085 1.00 0.00 ATOM 424 CB LYS A 57 41.207 54.327 16.085 1.00 0.00 ATOM 425 CG LYS A 57 42.302 55.249 15.572 1.00 0.00 ATOM 426 CD LYS A 57 41.742 56.296 14.624 1.00 0.00 ATOM 427 CE LYS A 57 42.844 57.184 14.069 1.00 0.00 ATOM 428 NZ LYS A 57 42.308 58.229 13.153 1.00 0.00 ATOM 429 O LYS A 57 39.916 51.743 16.797 1.00 0.00 ATOM 430 C LYS A 57 40.530 52.469 17.577 1.00 0.00 ATOM 431 N ASP A 58 37.034 50.082 17.889 1.00 0.00 ATOM 432 CA ASP A 58 35.647 50.433 18.160 1.00 0.00 ATOM 433 CB ASP A 58 35.122 51.401 17.099 1.00 0.00 ATOM 434 CG ASP A 58 35.703 52.794 17.242 1.00 0.00 ATOM 435 OD1 ASP A 58 36.330 53.071 18.287 1.00 0.00 ATOM 436 OD2 ASP A 58 35.532 53.608 16.310 1.00 0.00 ATOM 437 O ASP A 58 33.660 49.241 18.777 1.00 0.00 ATOM 438 C ASP A 58 34.731 49.221 18.162 1.00 0.00 ATOM 439 N VAL A 59 35.149 48.149 17.493 1.00 0.00 ATOM 440 CA VAL A 59 34.272 46.993 17.381 1.00 0.00 ATOM 441 CB VAL A 59 34.872 45.916 16.459 1.00 0.00 ATOM 442 CG1 VAL A 59 34.034 44.648 16.504 1.00 0.00 ATOM 443 CG2 VAL A 59 34.917 46.411 15.020 1.00 0.00 ATOM 444 O VAL A 59 32.791 46.015 18.978 1.00 0.00 ATOM 445 C VAL A 59 33.964 46.270 18.695 1.00 0.00 ATOM 446 N VAL A 60 34.985 45.923 19.499 1.00 0.00 ATOM 447 CA VAL A 60 34.705 45.238 20.772 1.00 0.00 ATOM 448 CB VAL A 60 36.003 44.901 21.529 1.00 0.00 ATOM 449 CG1 VAL A 60 36.875 43.970 20.701 1.00 0.00 ATOM 450 CG2 VAL A 60 36.792 46.167 21.823 1.00 0.00 ATOM 451 O VAL A 60 32.962 45.667 22.366 1.00 0.00 ATOM 452 C VAL A 60 33.843 46.140 21.656 1.00 0.00 ATOM 453 N ALA A 61 34.029 47.460 21.587 1.00 0.00 ATOM 454 CA ALA A 61 33.212 48.394 22.375 1.00 0.00 ATOM 455 CB ALA A 61 33.722 49.820 22.229 1.00 0.00 ATOM 456 O ALA A 61 30.846 48.289 22.807 1.00 0.00 ATOM 457 C ALA A 61 31.744 48.294 21.961 1.00 0.00 ATOM 458 N VAL A 62 31.512 48.225 20.650 1.00 0.00 ATOM 459 CA VAL A 62 30.152 48.108 20.136 1.00 0.00 ATOM 460 CB VAL A 62 30.100 48.129 18.596 1.00 0.00 ATOM 461 CG1 VAL A 62 28.695 47.811 18.106 1.00 0.00 ATOM 462 CG2 VAL A 62 30.494 49.500 18.069 1.00 0.00 ATOM 463 O VAL A 62 28.407 46.694 21.019 1.00 0.00 ATOM 464 C VAL A 62 29.571 46.771 20.639 1.00 0.00 ATOM 465 N ALA A 63 30.381 45.712 20.664 1.00 0.00 ATOM 466 CA ALA A 63 29.875 44.436 21.158 1.00 0.00 ATOM 467 CB ALA A 63 30.956 43.368 21.070 1.00 0.00 ATOM 468 O ALA A 63 28.389 44.065 23.021 1.00 0.00 ATOM 469 C ALA A 63 29.435 44.575 22.629 1.00 0.00 ATOM 470 N ASP A 64 30.228 45.269 23.441 1.00 0.00 ATOM 471 CA ASP A 64 29.834 45.450 24.843 1.00 0.00 ATOM 472 CB ASP A 64 30.905 46.235 25.605 1.00 0.00 ATOM 473 CG ASP A 64 32.152 45.414 25.868 1.00 0.00 ATOM 474 OD1 ASP A 64 32.102 44.181 25.676 1.00 0.00 ATOM 475 OD2 ASP A 64 33.179 46.004 26.264 1.00 0.00 ATOM 476 O ASP A 64 27.634 45.869 25.720 1.00 0.00 ATOM 477 C ASP A 64 28.517 46.220 24.932 1.00 0.00 ATOM 478 N GLN A 65 28.384 47.267 24.126 1.00 0.00 ATOM 479 CA GLN A 65 27.175 48.079 24.161 1.00 0.00 ATOM 480 CB GLN A 65 27.277 49.234 23.164 1.00 0.00 ATOM 481 CG GLN A 65 28.273 50.310 23.560 1.00 0.00 ATOM 482 CD GLN A 65 28.431 51.380 22.496 1.00 0.00 ATOM 483 OE1 GLN A 65 27.860 51.276 21.410 1.00 0.00 ATOM 484 NE2 GLN A 65 29.207 52.412 22.805 1.00 0.00 ATOM 485 O GLN A 65 24.854 47.498 24.365 1.00 0.00 ATOM 486 C GLN A 65 25.927 47.269 23.805 1.00 0.00 ATOM 487 N ILE A 66 26.071 46.314 22.883 1.00 0.00 ATOM 488 CA ILE A 66 24.945 45.475 22.479 1.00 0.00 ATOM 489 CB ILE A 66 25.158 44.882 21.073 1.00 0.00 ATOM 490 CG1 ILE A 66 26.365 43.944 21.067 1.00 0.00 ATOM 491 CG2 ILE A 66 25.404 45.990 20.060 1.00 0.00 ATOM 492 CD1 ILE A 66 26.553 43.199 19.764 1.00 0.00 ATOM 493 O ILE A 66 23.702 43.542 23.138 1.00 0.00 ATOM 494 C ILE A 66 24.662 44.269 23.385 1.00 0.00 ATOM 495 N GLY A 67 25.480 44.037 24.407 1.00 0.00 ATOM 496 CA GLY A 67 25.191 42.935 25.317 1.00 0.00 ATOM 497 O GLY A 67 26.039 40.955 26.354 1.00 0.00 ATOM 498 C GLY A 67 26.269 41.908 25.590 1.00 0.00 ATOM 499 N ILE A 68 27.449 42.059 25.005 1.00 0.00 ATOM 500 CA ILE A 68 28.497 41.080 25.255 1.00 0.00 ATOM 501 CB ILE A 68 29.761 41.381 24.428 1.00 0.00 ATOM 502 CG1 ILE A 68 29.433 41.373 22.933 1.00 0.00 ATOM 503 CG2 ILE A 68 30.832 40.333 24.692 1.00 0.00 ATOM 504 CD1 ILE A 68 28.911 40.044 22.430 1.00 0.00 ATOM 505 O ILE A 68 29.071 42.091 27.351 1.00 0.00 ATOM 506 C ILE A 68 28.931 41.038 26.714 1.00 0.00 ATOM 507 N PRO A 69 31.016 39.033 28.590 1.00 0.00 ATOM 508 CA PRO A 69 32.425 39.313 28.361 1.00 0.00 ATOM 509 CB PRO A 69 33.152 38.182 29.093 1.00 0.00 ATOM 510 CG PRO A 69 32.167 37.699 30.104 1.00 0.00 ATOM 511 CD PRO A 69 30.812 37.843 29.469 1.00 0.00 ATOM 512 O PRO A 69 31.774 38.662 26.156 1.00 0.00 ATOM 513 C PRO A 69 32.591 39.268 26.843 1.00 0.00 ATOM 514 N TYR A 70 33.610 39.959 26.336 1.00 0.00 ATOM 515 CA TYR A 70 33.854 40.025 24.900 1.00 0.00 ATOM 516 CB TYR A 70 33.316 41.342 24.332 1.00 0.00 ATOM 517 CG TYR A 70 33.538 41.503 22.845 1.00 0.00 ATOM 518 CD1 TYR A 70 32.755 40.812 21.929 1.00 0.00 ATOM 519 CD2 TYR A 70 34.531 42.346 22.361 1.00 0.00 ATOM 520 CE1 TYR A 70 32.951 40.954 20.569 1.00 0.00 ATOM 521 CE2 TYR A 70 34.742 42.499 21.005 1.00 0.00 ATOM 522 CZ TYR A 70 33.941 41.794 20.108 1.00 0.00 ATOM 523 OH TYR A 70 34.138 41.937 18.753 1.00 0.00 ATOM 524 O TYR A 70 36.112 40.666 25.312 1.00 0.00 ATOM 525 C TYR A 70 35.349 39.942 24.684 1.00 0.00 ATOM 526 N TYR A 71 35.772 39.029 23.812 1.00 0.00 ATOM 527 CA TYR A 71 37.186 38.813 23.545 1.00 0.00 ATOM 528 CB TYR A 71 37.612 37.416 23.999 1.00 0.00 ATOM 529 CG TYR A 71 37.458 37.182 25.484 1.00 0.00 ATOM 530 CD1 TYR A 71 36.267 36.690 26.007 1.00 0.00 ATOM 531 CD2 TYR A 71 38.501 37.452 26.360 1.00 0.00 ATOM 532 CE1 TYR A 71 36.117 36.474 27.364 1.00 0.00 ATOM 533 CE2 TYR A 71 38.368 37.241 27.720 1.00 0.00 ATOM 534 CZ TYR A 71 37.163 36.747 28.217 1.00 0.00 ATOM 535 OH TYR A 71 37.015 36.532 29.568 1.00 0.00 ATOM 536 O TYR A 71 36.838 38.332 21.243 1.00 0.00 ATOM 537 C TYR A 71 37.564 38.830 22.054 1.00 0.00 ATOM 538 N SER A 72 38.699 39.482 21.786 1.00 0.00 ATOM 539 CA SER A 72 39.292 39.479 20.452 1.00 0.00 ATOM 540 CB SER A 72 39.982 40.829 20.249 1.00 0.00 ATOM 541 OG SER A 72 40.558 40.919 18.959 1.00 0.00 ATOM 542 O SER A 72 41.287 38.305 21.081 1.00 0.00 ATOM 543 C SER A 72 40.274 38.311 20.389 1.00 0.00 ATOM 544 N VAL A 73 39.960 37.303 19.566 1.00 0.00 ATOM 545 CA VAL A 73 40.802 36.117 19.433 1.00 0.00 ATOM 546 CB VAL A 73 39.956 34.834 19.327 1.00 0.00 ATOM 547 CG1 VAL A 73 40.854 33.618 19.149 1.00 0.00 ATOM 548 CG2 VAL A 73 39.126 34.639 20.586 1.00 0.00 ATOM 549 O VAL A 73 41.071 36.386 17.078 1.00 0.00 ATOM 550 C VAL A 73 41.632 36.284 18.165 1.00 0.00 ATOM 551 N ASN A 74 42.957 36.334 18.299 1.00 0.00 ATOM 552 CA ASN A 74 43.798 36.525 17.112 1.00 0.00 ATOM 553 CB ASN A 74 45.182 37.042 17.513 1.00 0.00 ATOM 554 CG ASN A 74 46.041 37.394 16.315 1.00 0.00 ATOM 555 ND2 ASN A 74 46.997 38.294 16.518 1.00 0.00 ATOM 556 OD1 ASN A 74 45.847 36.864 15.221 1.00 0.00 ATOM 557 O ASN A 74 44.480 34.225 16.931 1.00 0.00 ATOM 558 C ASN A 74 43.965 35.203 16.379 1.00 0.00 ATOM 559 N PHE A 75 43.494 35.176 15.141 1.00 0.00 ATOM 560 CA PHE A 75 43.558 33.957 14.341 1.00 0.00 ATOM 561 CB PHE A 75 42.166 33.579 13.830 1.00 0.00 ATOM 562 CG PHE A 75 41.179 33.284 14.924 1.00 0.00 ATOM 563 CD1 PHE A 75 40.228 34.221 15.289 1.00 0.00 ATOM 564 CD2 PHE A 75 41.201 32.069 15.588 1.00 0.00 ATOM 565 CE1 PHE A 75 39.320 33.949 16.296 1.00 0.00 ATOM 566 CE2 PHE A 75 40.294 31.798 16.594 1.00 0.00 ATOM 567 CZ PHE A 75 39.355 32.731 16.948 1.00 0.00 ATOM 568 O PHE A 75 44.526 33.203 12.309 1.00 0.00 ATOM 569 C PHE A 75 44.463 34.116 13.131 1.00 0.00 ATOM 570 N GLU A 76 45.177 35.238 13.028 1.00 0.00 ATOM 571 CA GLU A 76 46.030 35.474 11.866 1.00 0.00 ATOM 572 CB GLU A 76 47.249 36.474 12.360 1.00 0.00 ATOM 573 CG GLU A 76 46.959 37.669 13.249 1.00 0.00 ATOM 574 CD GLU A 76 48.225 38.407 13.636 1.00 0.00 ATOM 575 OE1 GLU A 76 49.065 37.811 14.343 1.00 0.00 ATOM 576 OE2 GLU A 76 48.383 39.576 13.227 1.00 0.00 ATOM 577 O GLU A 76 47.388 33.997 10.543 1.00 0.00 ATOM 578 C GLU A 76 47.161 34.472 11.667 1.00 0.00 ATOM 579 N LYS A 77 47.501 32.504 7.960 1.00 0.00 ATOM 580 CA LYS A 77 48.357 31.328 7.944 1.00 0.00 ATOM 581 CB LYS A 77 48.531 30.773 9.359 1.00 0.00 ATOM 582 CG LYS A 77 49.374 31.648 10.271 1.00 0.00 ATOM 583 CD LYS A 77 49.509 31.038 11.655 1.00 0.00 ATOM 584 CE LYS A 77 50.333 31.926 12.574 1.00 0.00 ATOM 585 NZ LYS A 77 50.444 31.356 13.945 1.00 0.00 ATOM 586 O LYS A 77 48.431 29.595 6.287 1.00 0.00 ATOM 587 C LYS A 77 47.730 30.242 7.061 1.00 0.00 ATOM 588 N GLU A 78 46.421 30.055 7.170 1.00 0.00 ATOM 589 CA GLU A 78 45.764 29.032 6.341 1.00 0.00 ATOM 590 CB GLU A 78 44.388 28.667 6.896 1.00 0.00 ATOM 591 CG GLU A 78 44.423 27.734 8.107 1.00 0.00 ATOM 592 CD GLU A 78 45.161 26.424 7.843 1.00 0.00 ATOM 593 OE1 GLU A 78 44.960 25.812 6.773 1.00 0.00 ATOM 594 OE2 GLU A 78 45.938 25.994 8.723 1.00 0.00 ATOM 595 O GLU A 78 45.813 28.641 3.969 1.00 0.00 ATOM 596 C GLU A 78 45.699 29.478 4.877 1.00 0.00 ATOM 597 N TYR A 79 45.528 30.781 4.646 1.00 0.00 ATOM 598 CA TYR A 79 45.509 31.294 3.278 1.00 0.00 ATOM 599 CB TYR A 79 45.202 32.792 3.271 1.00 0.00 ATOM 600 CG TYR A 79 45.193 33.410 1.891 1.00 0.00 ATOM 601 CD1 TYR A 79 44.101 33.249 1.048 1.00 0.00 ATOM 602 CD2 TYR A 79 46.275 34.152 1.435 1.00 0.00 ATOM 603 CE1 TYR A 79 44.083 33.809 -0.216 1.00 0.00 ATOM 604 CE2 TYR A 79 46.275 34.720 0.176 1.00 0.00 ATOM 605 CZ TYR A 79 45.165 34.542 -0.651 1.00 0.00 ATOM 606 OH TYR A 79 45.150 35.100 -1.909 1.00 0.00 ATOM 607 O TYR A 79 46.943 30.657 1.470 1.00 0.00 ATOM 608 C TYR A 79 46.869 31.063 2.635 1.00 0.00 ATOM 609 N TRP A 80 47.958 31.333 3.372 1.00 0.00 ATOM 610 CA TRP A 80 49.283 31.085 2.815 1.00 0.00 ATOM 611 CB TRP A 80 50.369 31.540 3.793 1.00 0.00 ATOM 612 CG TRP A 80 51.761 31.332 3.281 1.00 0.00 ATOM 613 CD1 TRP A 80 52.477 32.178 2.483 1.00 0.00 ATOM 614 CD2 TRP A 80 52.608 30.203 3.532 1.00 0.00 ATOM 615 CE2 TRP A 80 53.822 30.435 2.855 1.00 0.00 ATOM 616 CE3 TRP A 80 52.460 29.022 4.263 1.00 0.00 ATOM 617 NE1 TRP A 80 53.717 31.647 2.222 1.00 0.00 ATOM 618 CZ2 TRP A 80 54.880 29.527 2.888 1.00 0.00 ATOM 619 CZ3 TRP A 80 53.510 28.125 4.292 1.00 0.00 ATOM 620 CH2 TRP A 80 54.706 28.379 3.611 1.00 0.00 ATOM 621 O TRP A 80 50.065 29.231 1.508 1.00 0.00 ATOM 622 C TRP A 80 49.480 29.587 2.535 1.00 0.00 ATOM 623 N ASP A 81 49.006 28.722 3.432 1.00 0.00 ATOM 624 CA ASP A 81 49.120 27.290 3.188 1.00 0.00 ATOM 625 CB ASP A 81 48.532 26.499 4.358 1.00 0.00 ATOM 626 CG ASP A 81 49.409 26.548 5.593 1.00 0.00 ATOM 627 OD1 ASP A 81 50.571 26.988 5.480 1.00 0.00 ATOM 628 OD2 ASP A 81 48.932 26.146 6.677 1.00 0.00 ATOM 629 O ASP A 81 48.831 26.093 1.128 1.00 0.00 ATOM 630 C ASP A 81 48.362 26.908 1.916 1.00 0.00 ATOM 631 N ARG A 82 47.179 27.480 1.719 1.00 0.00 ATOM 632 CA ARG A 82 46.392 27.200 0.526 1.00 0.00 ATOM 633 CB ARG A 82 45.059 27.951 0.536 1.00 0.00 ATOM 634 CG ARG A 82 44.156 27.628 -0.644 1.00 0.00 ATOM 635 CD ARG A 82 42.841 28.383 -0.554 1.00 0.00 ATOM 636 NE ARG A 82 43.033 29.828 -0.639 1.00 0.00 ATOM 637 CZ ARG A 82 42.122 30.726 -0.277 1.00 0.00 ATOM 638 NH1 ARG A 82 42.385 32.021 -0.389 1.00 0.00 ATOM 639 NH2 ARG A 82 40.949 30.326 0.196 1.00 0.00 ATOM 640 O ARG A 82 47.185 26.897 -1.743 1.00 0.00 ATOM 641 C ARG A 82 47.176 27.616 -0.742 1.00 0.00 ATOM 642 N VAL A 83 47.898 28.773 -0.684 1.00 0.00 ATOM 643 CA VAL A 83 48.702 29.216 -1.828 1.00 0.00 ATOM 644 CB VAL A 83 49.321 30.605 -1.579 1.00 0.00 ATOM 645 CG1 VAL A 83 50.296 30.959 -2.691 1.00 0.00 ATOM 646 CG2 VAL A 83 48.236 31.670 -1.530 1.00 0.00 ATOM 647 O VAL A 83 50.076 27.841 -3.226 1.00 0.00 ATOM 648 C VAL A 83 49.838 28.231 -2.087 1.00 0.00 ATOM 649 N PHE A 84 50.529 27.817 -1.024 1.00 0.00 ATOM 650 CA PHE A 84 51.639 26.871 -1.173 1.00 0.00 ATOM 651 CB PHE A 84 52.264 26.560 0.189 1.00 0.00 ATOM 652 CG PHE A 84 53.493 25.699 0.110 1.00 0.00 ATOM 653 CD1 PHE A 84 54.693 26.220 -0.338 1.00 0.00 ATOM 654 CD2 PHE A 84 53.447 24.367 0.484 1.00 0.00 ATOM 655 CE1 PHE A 84 55.823 25.429 -0.411 1.00 0.00 ATOM 656 CE2 PHE A 84 54.576 23.574 0.410 1.00 0.00 ATOM 657 CZ PHE A 84 55.761 24.100 -0.034 1.00 0.00 ATOM 658 O PHE A 84 52.000 24.878 -2.454 1.00 0.00 ATOM 659 C PHE A 84 51.211 25.547 -1.780 1.00 0.00 ATOM 660 N GLU A 85 49.906 25.138 -1.470 1.00 0.00 ATOM 661 CA GLU A 85 49.372 23.873 -1.987 1.00 0.00 ATOM 662 CB GLU A 85 48.444 23.223 -0.960 1.00 0.00 ATOM 663 CG GLU A 85 49.141 22.793 0.322 1.00 0.00 ATOM 664 CD GLU A 85 48.191 22.153 1.315 1.00 0.00 ATOM 665 OE1 GLU A 85 46.989 22.035 0.995 1.00 0.00 ATOM 666 OE2 GLU A 85 48.648 21.772 2.412 1.00 0.00 ATOM 667 O GLU A 85 48.098 22.929 -3.759 1.00 0.00 ATOM 668 C GLU A 85 48.563 23.970 -3.262 1.00 0.00 ATOM 669 N TYR A 86 48.372 25.190 -3.778 1.00 0.00 ATOM 670 CA TYR A 86 47.543 25.381 -4.973 1.00 0.00 ATOM 671 CB TYR A 86 48.182 24.697 -6.183 1.00 0.00 ATOM 672 CG TYR A 86 49.567 25.202 -6.512 1.00 0.00 ATOM 673 CD1 TYR A 86 50.695 24.474 -6.153 1.00 0.00 ATOM 674 CD2 TYR A 86 49.746 26.407 -7.178 1.00 0.00 ATOM 675 CE1 TYR A 86 51.966 24.928 -6.449 1.00 0.00 ATOM 676 CE2 TYR A 86 51.009 26.878 -7.484 1.00 0.00 ATOM 677 CZ TYR A 86 52.123 26.125 -7.111 1.00 0.00 ATOM 678 OH TYR A 86 53.387 26.580 -7.408 1.00 0.00 ATOM 679 O TYR A 86 45.589 24.131 -5.601 1.00 0.00 ATOM 680 C TYR A 86 46.165 24.765 -4.703 1.00 0.00 ATOM 681 N PHE A 87 45.634 24.975 -3.478 1.00 0.00 ATOM 682 CA PHE A 87 44.386 24.349 -3.090 1.00 0.00 ATOM 683 CB PHE A 87 44.102 24.598 -1.606 1.00 0.00 ATOM 684 CG PHE A 87 42.830 23.965 -1.118 1.00 0.00 ATOM 685 CD1 PHE A 87 42.772 22.609 -0.853 1.00 0.00 ATOM 686 CD2 PHE A 87 41.690 24.727 -0.927 1.00 0.00 ATOM 687 CE1 PHE A 87 41.602 22.026 -0.403 1.00 0.00 ATOM 688 CE2 PHE A 87 40.520 24.145 -0.479 1.00 0.00 ATOM 689 CZ PHE A 87 40.473 22.800 -0.216 1.00 0.00 ATOM 690 O PHE A 87 42.268 24.128 -4.186 1.00 0.00 ATOM 691 C PHE A 87 43.196 24.877 -3.871 1.00 0.00 ATOM 692 N LEU A 88 43.222 26.164 -4.195 1.00 0.00 ATOM 693 CA LEU A 88 42.123 26.751 -4.948 1.00 0.00 ATOM 694 CB LEU A 88 42.303 28.268 -5.062 1.00 0.00 ATOM 695 CG LEU A 88 42.145 29.068 -3.768 1.00 0.00 ATOM 696 CD1 LEU A 88 42.522 30.525 -3.988 1.00 0.00 ATOM 697 CD2 LEU A 88 40.705 29.020 -3.280 1.00 0.00 ATOM 698 O LEU A 88 40.880 25.874 -6.817 1.00 0.00 ATOM 699 C LEU A 88 41.997 26.171 -6.379 1.00 0.00 ATOM 700 N ALA A 89 43.138 25.926 -7.168 1.00 0.00 ATOM 701 CA ALA A 89 43.159 25.423 -8.557 1.00 0.00 ATOM 702 CB ALA A 89 44.591 25.382 -9.072 1.00 0.00 ATOM 703 O ALA A 89 41.882 23.612 -9.478 1.00 0.00 ATOM 704 C ALA A 89 42.604 24.004 -8.559 1.00 0.00 ATOM 705 N GLU A 90 42.941 23.233 -7.524 1.00 0.00 ATOM 706 CA GLU A 90 42.456 21.864 -7.437 1.00 0.00 ATOM 707 CB GLU A 90 43.025 21.172 -6.196 1.00 0.00 ATOM 708 CG GLU A 90 44.512 20.863 -6.287 1.00 0.00 ATOM 709 CD GLU A 90 45.061 20.264 -5.007 1.00 0.00 ATOM 710 OE1 GLU A 90 44.296 20.157 -4.025 1.00 0.00 ATOM 711 OE2 GLU A 90 46.257 19.904 -4.985 1.00 0.00 ATOM 712 O GLU A 90 40.290 20.904 -7.871 1.00 0.00 ATOM 713 C GLU A 90 40.931 21.817 -7.341 1.00 0.00 ATOM 714 N TYR A 91 40.351 22.827 -6.703 1.00 0.00 ATOM 715 CA TYR A 91 38.898 22.894 -6.553 1.00 0.00 ATOM 716 CB TYR A 91 38.509 24.037 -5.613 1.00 0.00 ATOM 717 CG TYR A 91 37.016 24.191 -5.421 1.00 0.00 ATOM 718 CD1 TYR A 91 36.319 23.346 -4.569 1.00 0.00 ATOM 719 CD2 TYR A 91 36.311 25.181 -6.094 1.00 0.00 ATOM 720 CE1 TYR A 91 34.954 23.479 -4.387 1.00 0.00 ATOM 721 CE2 TYR A 91 34.948 25.328 -5.925 1.00 0.00 ATOM 722 CZ TYR A 91 34.272 24.466 -5.062 1.00 0.00 ATOM 723 OH TYR A 91 32.914 24.601 -4.883 1.00 0.00 ATOM 724 O TYR A 91 37.240 22.454 -8.259 1.00 0.00 ATOM 725 C TYR A 91 38.214 23.134 -7.902 1.00 0.00 ATOM 726 N ARG A 92 38.716 24.115 -8.640 1.00 0.00 ATOM 727 CA ARG A 92 38.166 24.431 -9.952 1.00 0.00 ATOM 728 CB ARG A 92 38.897 25.626 -10.566 1.00 0.00 ATOM 729 CG ARG A 92 38.595 26.952 -9.887 1.00 0.00 ATOM 730 CD ARG A 92 39.417 28.081 -10.490 1.00 0.00 ATOM 731 NE ARG A 92 39.156 29.359 -9.833 1.00 0.00 ATOM 732 CZ ARG A 92 39.819 30.482 -10.093 1.00 0.00 ATOM 733 NH1 ARG A 92 39.514 31.597 -9.445 1.00 0.00 ATOM 734 NH2 ARG A 92 40.786 30.485 -10.998 1.00 0.00 ATOM 735 O ARG A 92 37.539 23.033 -11.805 1.00 0.00 ATOM 736 C ARG A 92 38.324 23.222 -10.887 1.00 0.00 ATOM 737 N ALA A 93 39.349 22.411 -10.651 1.00 0.00 ATOM 738 CA ALA A 93 39.576 21.234 -11.477 1.00 0.00 ATOM 739 CB ALA A 93 40.985 20.702 -11.263 1.00 0.00 ATOM 740 O ALA A 93 38.376 19.169 -11.813 1.00 0.00 ATOM 741 C ALA A 93 38.533 20.167 -11.116 1.00 0.00 ATOM 742 N GLY A 94 37.821 20.409 -9.999 1.00 0.00 ATOM 743 CA GLY A 94 36.752 19.498 -9.613 1.00 0.00 ATOM 744 O GLY A 94 36.482 17.397 -8.505 1.00 0.00 ATOM 745 C GLY A 94 37.266 18.232 -8.953 1.00 0.00 ATOM 746 N ARG A 95 38.602 18.388 -8.519 1.00 0.00 ATOM 747 CA ARG A 95 39.177 17.180 -7.948 1.00 0.00 ATOM 748 CB ARG A 95 40.628 17.011 -8.404 1.00 0.00 ATOM 749 CG ARG A 95 40.782 16.678 -9.878 1.00 0.00 ATOM 750 CD ARG A 95 42.244 16.512 -10.258 1.00 0.00 ATOM 751 NE ARG A 95 42.408 16.195 -11.674 1.00 0.00 ATOM 752 CZ ARG A 95 43.579 16.179 -12.305 1.00 0.00 ATOM 753 NH1 ARG A 95 43.634 15.880 -13.595 1.00 0.00 ATOM 754 NH2 ARG A 95 44.693 16.465 -11.644 1.00 0.00 ATOM 755 O ARG A 95 39.264 16.205 -5.762 1.00 0.00 ATOM 756 C ARG A 95 39.159 17.234 -6.425 1.00 0.00 ATOM 757 N THR A 96 39.005 18.432 -5.874 1.00 0.00 ATOM 758 CA THR A 96 39.015 18.589 -4.425 1.00 0.00 ATOM 759 CB THR A 96 40.432 18.887 -3.899 1.00 0.00 ATOM 760 CG2 THR A 96 41.405 17.809 -4.351 1.00 0.00 ATOM 761 OG1 THR A 96 40.875 20.153 -4.404 1.00 0.00 ATOM 762 O THR A 96 37.895 20.712 -4.577 1.00 0.00 ATOM 763 C THR A 96 38.136 19.720 -3.893 1.00 0.00 ATOM 764 N PRO A 97 37.699 19.529 -2.635 1.00 0.00 ATOM 765 CA PRO A 97 36.878 20.552 -1.982 1.00 0.00 ATOM 766 CB PRO A 97 36.546 19.946 -0.617 1.00 0.00 ATOM 767 CG PRO A 97 37.629 18.948 -0.379 1.00 0.00 ATOM 768 CD PRO A 97 37.997 18.400 -1.730 1.00 0.00 ATOM 769 O PRO A 97 38.861 21.753 -1.383 1.00 0.00 ATOM 770 C PRO A 97 37.743 21.802 -1.896 1.00 0.00 ATOM 771 N ASN A 98 37.232 22.920 -2.397 1.00 0.00 ATOM 772 CA ASN A 98 38.014 24.145 -2.397 1.00 0.00 ATOM 773 CB ASN A 98 38.273 24.618 -3.829 1.00 0.00 ATOM 774 CG ASN A 98 39.278 25.751 -3.897 1.00 0.00 ATOM 775 ND2 ASN A 98 39.229 26.520 -4.979 1.00 0.00 ATOM 776 OD1 ASN A 98 40.086 25.932 -2.987 1.00 0.00 ATOM 777 O ASN A 98 37.141 26.381 -2.245 1.00 0.00 ATOM 778 C ASN A 98 37.343 25.306 -1.669 1.00 0.00 ATOM 779 N PRO A 99 36.992 25.107 -0.387 1.00 0.00 ATOM 780 CA PRO A 99 36.348 26.188 0.367 1.00 0.00 ATOM 781 CB PRO A 99 36.115 25.571 1.735 1.00 0.00 ATOM 782 CG PRO A 99 35.872 24.135 1.422 1.00 0.00 ATOM 783 CD PRO A 99 36.946 23.842 0.408 1.00 0.00 ATOM 784 O PRO A 99 38.464 27.303 0.556 1.00 0.00 ATOM 785 C PRO A 99 37.255 27.412 0.353 1.00 0.00 ATOM 786 N ASP A 100 36.682 28.561 0.061 1.00 0.00 ATOM 787 CA ASP A 100 37.430 29.816 -0.024 1.00 0.00 ATOM 788 CB ASP A 100 36.809 30.740 -1.072 1.00 0.00 ATOM 789 CG ASP A 100 37.694 31.925 -1.402 1.00 0.00 ATOM 790 OD1 ASP A 100 38.866 31.931 -0.968 1.00 0.00 ATOM 791 OD2 ASP A 100 37.219 32.848 -2.096 1.00 0.00 ATOM 792 O ASP A 100 36.467 31.253 1.622 1.00 0.00 ATOM 793 C ASP A 100 37.349 30.441 1.369 1.00 0.00 ATOM 794 N VAL A 101 36.306 29.593 2.513 1.00 0.00 ATOM 795 CA VAL A 101 36.536 28.296 3.177 1.00 0.00 ATOM 796 CB VAL A 101 36.831 27.184 2.155 1.00 0.00 ATOM 797 CG1 VAL A 101 37.259 25.907 2.864 1.00 0.00 ATOM 798 CG2 VAL A 101 35.592 26.879 1.327 1.00 0.00 ATOM 799 O VAL A 101 37.695 27.735 5.227 1.00 0.00 ATOM 800 C VAL A 101 37.742 28.354 4.152 1.00 0.00 ATOM 801 N MET A 102 38.825 29.054 3.779 1.00 0.00 ATOM 802 CA MET A 102 39.984 29.150 4.675 1.00 0.00 ATOM 803 CB MET A 102 41.144 29.862 3.977 1.00 0.00 ATOM 804 CG MET A 102 41.749 29.079 2.823 1.00 0.00 ATOM 805 SD MET A 102 42.462 27.507 3.346 1.00 0.00 ATOM 806 CE MET A 102 41.116 26.385 2.971 1.00 0.00 ATOM 807 O MET A 102 39.985 29.549 7.059 1.00 0.00 ATOM 808 C MET A 102 39.618 29.939 5.940 1.00 0.00 ATOM 809 N CYS A 103 38.888 31.032 5.749 1.00 0.00 ATOM 810 CA CYS A 103 38.460 31.845 6.886 1.00 0.00 ATOM 811 CB CYS A 103 37.640 33.046 6.407 1.00 0.00 ATOM 812 SG CYS A 103 38.595 34.289 5.506 1.00 0.00 ATOM 813 O CYS A 103 37.758 31.154 9.072 1.00 0.00 ATOM 814 C CYS A 103 37.597 31.046 7.848 1.00 0.00 ATOM 815 N ASN A 104 36.694 30.219 7.321 1.00 0.00 ATOM 816 CA ASN A 104 35.821 29.438 8.202 1.00 0.00 ATOM 817 CB ASN A 104 34.728 28.736 7.391 1.00 0.00 ATOM 818 CG ASN A 104 33.710 28.036 8.267 1.00 0.00 ATOM 819 ND2 ASN A 104 33.629 26.716 8.142 1.00 0.00 ATOM 820 OD1 ASN A 104 33.004 28.676 9.047 1.00 0.00 ATOM 821 O ASN A 104 36.215 28.055 10.123 1.00 0.00 ATOM 822 C ASN A 104 36.568 28.357 8.978 1.00 0.00 ATOM 823 N LYS A 105 37.567 27.729 8.362 1.00 0.00 ATOM 824 CA LYS A 105 38.351 26.699 9.026 1.00 0.00 ATOM 825 CB LYS A 105 39.127 25.870 8.000 1.00 0.00 ATOM 826 CG LYS A 105 39.918 24.720 8.602 1.00 0.00 ATOM 827 CD LYS A 105 40.520 23.838 7.520 1.00 0.00 ATOM 828 CE LYS A 105 41.307 22.685 8.120 1.00 0.00 ATOM 829 NZ LYS A 105 41.861 21.785 7.072 1.00 0.00 ATOM 830 O LYS A 105 39.603 26.732 11.073 1.00 0.00 ATOM 831 C LYS A 105 39.366 27.287 10.003 1.00 0.00 ATOM 832 N GLU A 106 40.000 28.391 9.616 1.00 0.00 ATOM 833 CA GLU A 106 40.994 29.025 10.472 1.00 0.00 ATOM 834 CB GLU A 106 41.746 30.113 9.704 1.00 0.00 ATOM 835 CG GLU A 106 42.851 30.785 10.502 1.00 0.00 ATOM 836 CD GLU A 106 43.613 31.815 9.691 1.00 0.00 ATOM 837 OE1 GLU A 106 43.283 31.996 8.500 1.00 0.00 ATOM 838 OE2 GLU A 106 44.539 32.441 10.246 1.00 0.00 ATOM 839 O GLU A 106 41.011 29.645 12.789 1.00 0.00 ATOM 840 C GLU A 106 40.415 29.697 11.714 1.00 0.00 ATOM 841 N ILE A 107 39.253 30.325 11.574 1.00 0.00 ATOM 842 CA ILE A 107 38.639 31.041 12.688 1.00 0.00 ATOM 843 CB ILE A 107 38.480 32.541 12.376 1.00 0.00 ATOM 844 CG1 ILE A 107 37.693 32.735 11.078 1.00 0.00 ATOM 845 CG2 ILE A 107 39.842 33.199 12.217 1.00 0.00 ATOM 846 CD1 ILE A 107 37.242 34.160 10.845 1.00 0.00 ATOM 847 O ILE A 107 36.970 30.256 14.225 1.00 0.00 ATOM 848 C ILE A 107 37.250 30.541 13.059 1.00 0.00 ATOM 849 N LYS A 108 37.350 28.944 11.855 1.00 0.00 ATOM 850 CA LYS A 108 36.454 29.453 12.895 1.00 0.00 ATOM 851 CB LYS A 108 35.141 30.100 11.963 1.00 0.00 ATOM 852 CG LYS A 108 35.433 30.825 10.655 1.00 0.00 ATOM 853 CD LYS A 108 34.210 31.564 10.117 1.00 0.00 ATOM 854 CE LYS A 108 33.884 32.834 10.911 1.00 0.00 ATOM 855 NZ LYS A 108 32.665 33.508 10.364 1.00 0.00 ATOM 856 O LYS A 108 35.411 28.498 14.834 1.00 0.00 ATOM 857 C LYS A 108 35.669 28.378 13.618 1.00 0.00 ATOM 858 N PHE A 109 35.313 27.301 12.911 1.00 0.00 ATOM 859 CA PHE A 109 34.570 26.222 13.533 1.00 0.00 ATOM 860 CB PHE A 109 34.248 25.132 12.508 1.00 0.00 ATOM 861 CG PHE A 109 33.482 23.971 13.078 1.00 0.00 ATOM 862 CD1 PHE A 109 32.120 24.063 13.297 1.00 0.00 ATOM 863 CD2 PHE A 109 34.127 22.788 13.395 1.00 0.00 ATOM 864 CE1 PHE A 109 31.416 22.996 13.821 1.00 0.00 ATOM 865 CE2 PHE A 109 33.423 21.721 13.920 1.00 0.00 ATOM 866 CZ PHE A 109 32.073 21.820 14.133 1.00 0.00 ATOM 867 O PHE A 109 34.799 25.157 15.666 1.00 0.00 ATOM 868 C PHE A 109 35.367 25.591 14.659 1.00 0.00 ATOM 869 N LYS A 110 36.679 25.522 14.489 1.00 0.00 ATOM 870 CA LYS A 110 37.506 24.970 15.542 1.00 0.00 ATOM 871 CB LYS A 110 38.794 24.385 14.960 1.00 0.00 ATOM 872 CG LYS A 110 39.716 23.764 15.995 1.00 0.00 ATOM 873 CD LYS A 110 40.923 23.112 15.340 1.00 0.00 ATOM 874 CE LYS A 110 41.804 22.421 16.368 1.00 0.00 ATOM 875 NZ LYS A 110 42.891 21.630 15.727 1.00 0.00 ATOM 876 O LYS A 110 37.739 25.821 17.778 1.00 0.00 ATOM 877 C LYS A 110 37.899 26.042 16.576 1.00 0.00 ATOM 878 N ALA A 111 38.361 27.203 16.120 1.00 0.00 ATOM 879 CA ALA A 111 38.827 28.219 17.066 1.00 0.00 ATOM 880 CB ALA A 111 39.451 29.390 16.321 1.00 0.00 ATOM 881 O ALA A 111 38.036 29.062 19.153 1.00 0.00 ATOM 882 C ALA A 111 37.773 28.823 17.961 1.00 0.00 ATOM 883 N PHE A 112 36.595 29.103 17.424 1.00 0.00 ATOM 884 CA PHE A 112 35.596 29.688 18.301 1.00 0.00 ATOM 885 CB PHE A 112 34.421 30.232 17.485 1.00 0.00 ATOM 886 CG PHE A 112 34.723 31.519 16.772 1.00 0.00 ATOM 887 CD1 PHE A 112 34.991 31.530 15.414 1.00 0.00 ATOM 888 CD2 PHE A 112 34.739 32.720 17.460 1.00 0.00 ATOM 889 CE1 PHE A 112 35.268 32.715 14.759 1.00 0.00 ATOM 890 CE2 PHE A 112 35.017 33.905 16.805 1.00 0.00 ATOM 891 CZ PHE A 112 35.281 33.906 15.460 1.00 0.00 ATOM 892 O PHE A 112 34.933 28.990 20.495 1.00 0.00 ATOM 893 C PHE A 112 35.113 28.662 19.322 1.00 0.00 ATOM 894 N LEU A 113 34.900 27.413 18.886 1.00 0.00 ATOM 895 CA LEU A 113 34.458 26.375 19.815 1.00 0.00 ATOM 896 CB LEU A 113 34.157 25.067 19.082 1.00 0.00 ATOM 897 CG LEU A 113 32.990 25.096 18.094 1.00 0.00 ATOM 898 CD1 LEU A 113 32.901 23.787 17.326 1.00 0.00 ATOM 899 CD2 LEU A 113 31.673 25.311 18.823 1.00 0.00 ATOM 900 O LEU A 113 35.186 25.827 22.054 1.00 0.00 ATOM 901 C LEU A 113 35.517 26.118 20.894 1.00 0.00 ATOM 902 N ASP A 114 36.789 26.240 20.523 1.00 0.00 ATOM 903 CA ASP A 114 37.837 26.003 21.511 1.00 0.00 ATOM 904 CB ASP A 114 39.207 25.942 20.833 1.00 0.00 ATOM 905 CG ASP A 114 39.409 24.667 20.038 1.00 0.00 ATOM 906 OD1 ASP A 114 38.603 23.729 20.207 1.00 0.00 ATOM 907 OD2 ASP A 114 40.374 24.608 19.247 1.00 0.00 ATOM 908 O ASP A 114 38.010 26.929 23.708 1.00 0.00 ATOM 909 C ASP A 114 37.803 27.155 22.513 1.00 0.00 ATOM 910 N TYR A 115 37.542 28.372 22.029 1.00 0.00 ATOM 911 CA TYR A 115 37.478 29.531 22.933 1.00 0.00 ATOM 912 CB TYR A 115 37.417 30.901 22.287 1.00 0.00 ATOM 913 CG TYR A 115 38.827 31.396 21.960 1.00 0.00 ATOM 914 CD1 TYR A 115 39.541 32.126 22.906 1.00 0.00 ATOM 915 CD2 TYR A 115 39.411 31.115 20.740 1.00 0.00 ATOM 916 CE1 TYR A 115 40.811 32.575 22.647 1.00 0.00 ATOM 917 CE2 TYR A 115 40.705 31.572 20.465 1.00 0.00 ATOM 918 CZ TYR A 115 41.374 32.298 21.417 1.00 0.00 ATOM 919 OH TYR A 115 42.652 32.770 21.204 1.00 0.00 ATOM 920 O TYR A 115 36.362 29.698 25.054 1.00 0.00 ATOM 921 C TYR A 115 36.275 29.377 23.862 1.00 0.00 ATOM 922 N ALA A 116 35.142 28.908 23.327 1.00 0.00 ATOM 923 CA ALA A 116 33.954 28.667 24.137 1.00 0.00 ATOM 924 CB ALA A 116 32.813 28.160 23.267 1.00 0.00 ATOM 925 O ALA A 116 33.908 27.784 26.388 1.00 0.00 ATOM 926 C ALA A 116 34.253 27.617 25.213 1.00 0.00 ATOM 927 N ILE A 117 34.898 26.522 24.819 1.00 0.00 ATOM 928 CA ILE A 117 35.213 25.453 25.772 1.00 0.00 ATOM 929 CB ILE A 117 35.970 24.295 25.095 1.00 0.00 ATOM 930 CG1 ILE A 117 35.058 23.569 24.104 1.00 0.00 ATOM 931 CG2 ILE A 117 36.451 23.293 26.132 1.00 0.00 ATOM 932 CD1 ILE A 117 35.787 22.596 23.204 1.00 0.00 ATOM 933 O ILE A 117 35.908 25.650 28.071 1.00 0.00 ATOM 934 C ILE A 117 36.100 25.993 26.900 1.00 0.00 ATOM 935 N THR A 118 37.041 26.857 26.525 1.00 0.00 ATOM 936 CA THR A 118 37.939 27.430 27.527 1.00 0.00 ATOM 937 CB THR A 118 38.926 28.385 26.833 1.00 0.00 ATOM 938 CG2 THR A 118 39.861 29.020 27.851 1.00 0.00 ATOM 939 OG1 THR A 118 39.707 27.658 25.876 1.00 0.00 ATOM 940 O THR A 118 37.623 28.335 29.740 1.00 0.00 ATOM 941 C THR A 118 37.179 28.228 28.592 1.00 0.00 ATOM 942 N LEU A 119 36.069 28.753 28.288 1.00 0.00 ATOM 943 CA LEU A 119 35.228 29.570 29.158 1.00 0.00 ATOM 944 CB LEU A 119 34.639 30.748 28.380 1.00 0.00 ATOM 945 CG LEU A 119 35.644 31.732 27.778 1.00 0.00 ATOM 946 CD1 LEU A 119 34.930 32.795 26.956 1.00 0.00 ATOM 947 CD2 LEU A 119 36.434 32.431 28.875 1.00 0.00 ATOM 948 O LEU A 119 33.140 29.417 30.323 1.00 0.00 ATOM 949 C LEU A 119 34.051 28.805 29.760 1.00 0.00 ATOM 950 N GLY A 120 34.048 27.482 29.622 1.00 0.00 ATOM 951 CA GLY A 120 32.952 26.686 30.161 1.00 0.00 ATOM 952 O GLY A 120 30.564 26.600 29.952 1.00 0.00 ATOM 953 C GLY A 120 31.647 26.814 29.404 1.00 0.00 ATOM 954 N ALA A 121 31.752 27.168 28.120 1.00 0.00 ATOM 955 CA ALA A 121 30.592 27.333 27.254 1.00 0.00 ATOM 956 CB ALA A 121 30.712 28.617 26.446 1.00 0.00 ATOM 957 O ALA A 121 31.523 25.922 25.557 1.00 0.00 ATOM 958 C ALA A 121 30.589 26.114 26.344 1.00 0.00 ATOM 959 N ASP A 122 29.552 25.285 26.482 1.00 0.00 ATOM 960 CA ASP A 122 29.437 24.053 25.724 1.00 0.00 ATOM 961 CB ASP A 122 28.781 22.962 26.572 1.00 0.00 ATOM 962 CG ASP A 122 29.613 22.586 27.782 1.00 0.00 ATOM 963 OD1 ASP A 122 30.799 22.234 27.603 1.00 0.00 ATOM 964 OD2 ASP A 122 29.081 22.643 28.911 1.00 0.00 ATOM 965 O ASP A 122 28.864 23.578 23.449 1.00 0.00 ATOM 966 C ASP A 122 28.597 24.214 24.469 1.00 0.00 ATOM 967 N TYR A 123 27.578 25.068 24.551 1.00 0.00 ATOM 968 CA TYR A 123 26.674 25.288 23.428 1.00 0.00 ATOM 969 CB TYR A 123 25.298 24.692 23.725 1.00 0.00 ATOM 970 CG TYR A 123 25.306 23.189 23.902 1.00 0.00 ATOM 971 CD1 TYR A 123 25.479 22.622 25.159 1.00 0.00 ATOM 972 CD2 TYR A 123 25.142 22.344 22.812 1.00 0.00 ATOM 973 CE1 TYR A 123 25.488 21.251 25.329 1.00 0.00 ATOM 974 CE2 TYR A 123 25.148 20.969 22.964 1.00 0.00 ATOM 975 CZ TYR A 123 25.324 20.427 24.238 1.00 0.00 ATOM 976 OH TYR A 123 25.333 19.062 24.405 1.00 0.00 ATOM 977 O TYR A 123 26.244 27.561 24.055 1.00 0.00 ATOM 978 C TYR A 123 26.486 26.769 23.141 1.00 0.00 ATOM 979 N VAL A 124 26.612 27.140 21.870 1.00 0.00 ATOM 980 CA VAL A 124 26.450 28.532 21.471 1.00 0.00 ATOM 981 CB VAL A 124 27.579 28.985 20.527 1.00 0.00 ATOM 982 CG1 VAL A 124 27.367 30.426 20.096 1.00 0.00 ATOM 983 CG2 VAL A 124 28.927 28.884 21.224 1.00 0.00 ATOM 984 O VAL A 124 24.843 27.902 19.780 1.00 0.00 ATOM 985 C VAL A 124 25.122 28.630 20.749 1.00 0.00 ATOM 986 N ALA A 125 24.226 29.518 21.243 1.00 0.00 ATOM 987 CA ALA A 125 22.924 29.714 20.647 1.00 0.00 ATOM 988 CB ALA A 125 21.853 29.662 21.724 1.00 0.00 ATOM 989 O ALA A 125 23.079 32.100 20.649 1.00 0.00 ATOM 990 C ALA A 125 22.796 31.085 20.013 1.00 0.00 ATOM 991 N THR A 126 22.302 31.085 18.776 1.00 0.00 ATOM 992 CA THR A 126 22.128 32.328 18.032 1.00 0.00 ATOM 993 CB THR A 126 23.448 32.708 17.334 1.00 0.00 ATOM 994 CG2 THR A 126 23.822 31.661 16.298 1.00 0.00 ATOM 995 OG1 THR A 126 23.301 33.975 16.681 1.00 0.00 ATOM 996 O THR A 126 21.226 31.665 15.922 1.00 0.00 ATOM 997 C THR A 126 21.079 32.336 16.941 1.00 0.00 ATOM 998 N GLY A 127 20.020 33.099 17.187 1.00 0.00 ATOM 999 CA GLY A 127 18.977 33.284 16.190 1.00 0.00 ATOM 1000 O GLY A 127 19.130 35.632 15.704 1.00 0.00 ATOM 1001 C GLY A 127 19.407 34.481 15.367 1.00 0.00 ATOM 1002 N HIS A 128 20.458 34.137 14.358 1.00 0.00 ATOM 1003 CA HIS A 128 20.980 35.192 13.496 1.00 0.00 ATOM 1004 CB HIS A 128 22.457 34.945 13.183 1.00 0.00 ATOM 1005 CG HIS A 128 23.348 35.012 14.385 1.00 0.00 ATOM 1006 CD2 HIS A 128 24.050 34.042 15.213 1.00 0.00 ATOM 1007 ND1 HIS A 128 23.697 36.202 14.988 1.00 0.00 ATOM 1008 CE1 HIS A 128 24.500 35.942 16.035 1.00 0.00 ATOM 1009 NE2 HIS A 128 24.716 34.649 16.175 1.00 0.00 ATOM 1010 O HIS A 128 20.337 34.364 11.334 1.00 0.00 ATOM 1011 C HIS A 128 20.247 35.279 12.171 1.00 0.00 ATOM 1012 N TYR A 129 19.543 36.387 11.973 1.00 0.00 ATOM 1013 CA TYR A 129 18.790 36.564 10.745 1.00 0.00 ATOM 1014 CB TYR A 129 17.683 37.601 10.942 1.00 0.00 ATOM 1015 CG TYR A 129 16.568 37.143 11.854 1.00 0.00 ATOM 1016 CD1 TYR A 129 16.535 37.530 13.187 1.00 0.00 ATOM 1017 CD2 TYR A 129 15.552 36.324 11.379 1.00 0.00 ATOM 1018 CE1 TYR A 129 15.520 37.116 14.028 1.00 0.00 ATOM 1019 CE2 TYR A 129 14.528 35.899 12.206 1.00 0.00 ATOM 1020 CZ TYR A 129 14.519 36.304 13.540 1.00 0.00 ATOM 1021 OH TYR A 129 13.509 35.890 14.375 1.00 0.00 ATOM 1022 O TYR A 129 18.905 37.226 8.473 1.00 0.00 ATOM 1023 C TYR A 129 19.541 37.040 9.506 1.00 0.00 ATOM 1024 N ALA A 130 20.863 37.221 9.581 1.00 0.00 ATOM 1025 CA ALA A 130 21.613 37.673 8.398 1.00 0.00 ATOM 1026 CB ALA A 130 23.105 37.451 8.599 1.00 0.00 ATOM 1027 O ALA A 130 21.020 35.631 7.239 1.00 0.00 ATOM 1028 C ALA A 130 21.127 36.863 7.182 1.00 0.00 ATOM 1029 N ARG A 131 20.877 37.573 6.089 1.00 0.00 ATOM 1030 CA ARG A 131 20.300 36.974 4.900 1.00 0.00 ATOM 1031 CB ARG A 131 19.743 38.056 3.973 1.00 0.00 ATOM 1032 CG ARG A 131 18.550 38.807 4.542 1.00 0.00 ATOM 1033 CD ARG A 131 17.989 39.797 3.534 1.00 0.00 ATOM 1034 NE ARG A 131 16.817 40.499 4.050 1.00 0.00 ATOM 1035 CZ ARG A 131 16.113 41.387 3.356 1.00 0.00 ATOM 1036 NH1 ARG A 131 15.060 41.976 3.909 1.00 0.00 ATOM 1037 NH2 ARG A 131 16.462 41.686 2.112 1.00 0.00 ATOM 1038 O ARG A 131 22.398 36.248 3.962 1.00 0.00 ATOM 1039 C ARG A 131 21.175 36.138 3.989 1.00 0.00 ATOM 1040 N VAL A 132 20.505 35.324 3.196 1.00 0.00 ATOM 1041 CA VAL A 132 21.188 34.392 2.330 1.00 0.00 ATOM 1042 CB VAL A 132 20.203 33.399 1.682 1.00 0.00 ATOM 1043 CG1 VAL A 132 19.485 32.588 2.749 1.00 0.00 ATOM 1044 CG2 VAL A 132 19.162 34.143 0.861 1.00 0.00 ATOM 1045 O VAL A 132 22.756 34.171 0.570 1.00 0.00 ATOM 1046 C VAL A 132 21.971 34.920 1.148 1.00 0.00 ATOM 1047 N ALA A 133 21.786 36.185 0.778 1.00 0.00 ATOM 1048 CA ALA A 133 22.504 36.746 -0.362 1.00 0.00 ATOM 1049 CB ALA A 133 21.566 37.579 -1.222 1.00 0.00 ATOM 1050 O ALA A 133 24.714 37.590 -0.757 1.00 0.00 ATOM 1051 C ALA A 133 23.773 37.510 0.027 1.00 0.00 ATOM 1052 N ARG A 134 23.738 38.061 1.243 1.00 0.00 ATOM 1053 CA ARG A 134 24.837 38.931 1.669 1.00 0.00 ATOM 1054 CB ARG A 134 24.373 39.812 2.832 1.00 0.00 ATOM 1055 CG ARG A 134 23.163 40.674 2.512 1.00 0.00 ATOM 1056 CD ARG A 134 22.866 41.647 3.640 1.00 0.00 ATOM 1057 NE ARG A 134 23.898 42.674 3.763 1.00 0.00 ATOM 1058 CZ ARG A 134 23.975 43.539 4.769 1.00 0.00 ATOM 1059 NH1 ARG A 134 24.949 44.440 4.797 1.00 0.00 ATOM 1060 NH2 ARG A 134 23.077 43.503 5.745 1.00 0.00 ATOM 1061 O ARG A 134 26.114 37.047 2.503 1.00 0.00 ATOM 1062 C ARG A 134 26.085 38.255 2.306 1.00 0.00 ATOM 1063 N ASP A 135 27.127 39.224 2.484 1.00 0.00 ATOM 1064 CA ASP A 135 28.442 38.862 2.999 1.00 0.00 ATOM 1065 CB ASP A 135 29.487 39.963 2.806 1.00 0.00 ATOM 1066 CG ASP A 135 30.900 39.476 3.059 1.00 0.00 ATOM 1067 OD1 ASP A 135 31.092 38.247 3.181 1.00 0.00 ATOM 1068 OD2 ASP A 135 31.815 40.322 3.136 1.00 0.00 ATOM 1069 O ASP A 135 29.147 37.779 4.988 1.00 0.00 ATOM 1070 C ASP A 135 28.458 38.659 4.531 1.00 0.00 ATOM 1071 N GLU A 136 27.704 39.447 5.177 1.00 0.00 ATOM 1072 CA GLU A 136 27.703 39.317 6.647 1.00 0.00 ATOM 1073 CB GLU A 136 26.732 40.291 7.318 1.00 0.00 ATOM 1074 CG GLU A 136 27.223 41.728 7.356 1.00 0.00 ATOM 1075 CD GLU A 136 26.196 42.680 7.941 1.00 0.00 ATOM 1076 OE1 GLU A 136 25.076 42.226 8.251 1.00 0.00 ATOM 1077 OE2 GLU A 136 26.513 43.879 8.089 1.00 0.00 ATOM 1078 O GLU A 136 27.735 37.425 8.087 1.00 0.00 ATOM 1079 C GLU A 136 27.255 37.938 7.085 1.00 0.00 ATOM 1080 N ASP A 137 26.347 37.308 6.345 1.00 0.00 ATOM 1081 CA ASP A 137 25.896 35.990 6.761 1.00 0.00 ATOM 1082 CB ASP A 137 24.924 35.408 5.734 1.00 0.00 ATOM 1083 CG ASP A 137 24.328 34.087 6.179 1.00 0.00 ATOM 1084 OD1 ASP A 137 23.632 34.068 7.216 1.00 0.00 ATOM 1085 OD2 ASP A 137 24.556 33.071 5.490 1.00 0.00 ATOM 1086 O ASP A 137 27.180 34.252 7.827 1.00 0.00 ATOM 1087 C ASP A 137 27.090 35.048 6.893 1.00 0.00 ATOM 1088 N GLY A 138 28.049 35.194 5.983 1.00 0.00 ATOM 1089 CA GLY A 138 29.229 34.359 5.989 1.00 0.00 ATOM 1090 O GLY A 138 30.915 33.958 7.676 1.00 0.00 ATOM 1091 C GLY A 138 30.272 34.796 7.025 1.00 0.00 ATOM 1092 N THR A 139 30.451 36.102 7.171 1.00 0.00 ATOM 1093 CA THR A 139 31.400 36.610 8.165 1.00 0.00 ATOM 1094 CB THR A 139 31.493 38.147 8.123 1.00 0.00 ATOM 1095 CG2 THR A 139 32.451 38.652 9.190 1.00 0.00 ATOM 1096 OG1 THR A 139 31.970 38.564 6.838 1.00 0.00 ATOM 1097 O THR A 139 31.752 35.682 10.355 1.00 0.00 ATOM 1098 C THR A 139 30.952 36.195 9.564 1.00 0.00 ATOM 1099 N VAL A 140 29.676 36.419 9.879 1.00 0.00 ATOM 1100 CA VAL A 140 29.170 36.061 11.213 1.00 0.00 ATOM 1101 CB VAL A 140 27.703 36.495 11.395 1.00 0.00 ATOM 1102 CG1 VAL A 140 27.141 35.942 12.695 1.00 0.00 ATOM 1103 CG2 VAL A 140 27.599 38.012 11.432 1.00 0.00 ATOM 1104 O VAL A 140 29.516 34.105 12.595 1.00 0.00 ATOM 1105 C VAL A 140 29.222 34.566 11.465 1.00 0.00 ATOM 1106 N HIS A 141 28.932 33.734 10.373 1.00 0.00 ATOM 1107 CA HIS A 141 28.986 32.291 10.462 1.00 0.00 ATOM 1108 CB HIS A 141 27.680 31.742 11.041 1.00 0.00 ATOM 1109 CG HIS A 141 26.493 31.944 10.150 1.00 0.00 ATOM 1110 CD2 HIS A 141 25.760 31.125 9.196 1.00 0.00 ATOM 1111 ND1 HIS A 141 25.800 33.134 10.092 1.00 0.00 ATOM 1112 CE1 HIS A 141 24.794 33.010 9.210 1.00 0.00 ATOM 1113 NE2 HIS A 141 24.762 31.808 8.669 1.00 0.00 ATOM 1114 O HIS A 141 28.727 32.268 8.106 1.00 0.00 ATOM 1115 C HIS A 141 29.197 31.708 9.078 1.00 0.00 ATOM 1116 N MET A 142 29.924 30.601 8.996 1.00 0.00 ATOM 1117 CA MET A 142 30.200 29.932 7.731 1.00 0.00 ATOM 1118 CB MET A 142 31.589 30.314 7.216 1.00 0.00 ATOM 1119 CG MET A 142 31.957 29.670 5.887 1.00 0.00 ATOM 1120 SD MET A 142 31.017 30.345 4.504 1.00 0.00 ATOM 1121 CE MET A 142 31.732 31.982 4.376 1.00 0.00 ATOM 1122 O MET A 142 30.564 27.934 8.963 1.00 0.00 ATOM 1123 C MET A 142 30.144 28.439 7.931 1.00 0.00 ATOM 1124 N LEU A 143 29.605 27.732 6.953 1.00 0.00 ATOM 1125 CA LEU A 143 29.489 26.291 7.017 1.00 0.00 ATOM 1126 CB LEU A 143 28.033 25.881 7.249 1.00 0.00 ATOM 1127 CG LEU A 143 27.404 26.329 8.569 1.00 0.00 ATOM 1128 CD1 LEU A 143 25.916 26.012 8.591 1.00 0.00 ATOM 1129 CD2 LEU A 143 28.057 25.617 9.744 1.00 0.00 ATOM 1130 O LEU A 143 29.651 26.483 4.665 1.00 0.00 ATOM 1131 C LEU A 143 30.003 25.867 5.660 1.00 0.00 ATOM 1132 N ARG A 144 30.917 24.912 5.618 1.00 0.00 ATOM 1133 CA ARG A 144 31.476 24.475 4.354 1.00 0.00 ATOM 1134 CB ARG A 144 32.989 24.284 4.475 1.00 0.00 ATOM 1135 CG ARG A 144 33.758 25.570 4.727 1.00 0.00 ATOM 1136 CD ARG A 144 35.235 25.294 4.962 1.00 0.00 ATOM 1137 NE ARG A 144 35.459 24.519 6.182 1.00 0.00 ATOM 1138 CZ ARG A 144 36.620 23.966 6.512 1.00 0.00 ATOM 1139 NH1 ARG A 144 36.731 23.280 7.640 1.00 0.00 ATOM 1140 NH2 ARG A 144 37.669 24.099 5.711 1.00 0.00 ATOM 1141 O ARG A 144 30.315 22.397 4.700 1.00 0.00 ATOM 1142 C ARG A 144 30.876 23.159 3.908 1.00 0.00 ATOM 1143 N GLY A 145 31.131 22.962 2.543 1.00 0.00 ATOM 1144 CA GLY A 145 30.603 21.798 1.876 1.00 0.00 ATOM 1145 O GLY A 145 32.040 22.292 0.056 1.00 0.00 ATOM 1146 C GLY A 145 31.628 21.442 0.822 1.00 0.00 ATOM 1147 N VAL A 146 32.074 20.193 0.791 1.00 0.00 ATOM 1148 CA VAL A 146 33.057 19.816 -0.224 1.00 0.00 ATOM 1149 CB VAL A 146 33.748 18.485 0.126 1.00 0.00 ATOM 1150 CG1 VAL A 146 34.675 18.053 -1.000 1.00 0.00 ATOM 1151 CG2 VAL A 146 34.570 18.630 1.397 1.00 0.00 ATOM 1152 O VAL A 146 31.351 19.067 -1.762 1.00 0.00 ATOM 1153 C VAL A 146 32.407 19.644 -1.610 1.00 0.00 ATOM 1154 N ASP A 147 33.105 20.130 -2.555 1.00 0.00 ATOM 1155 CA ASP A 147 32.736 20.052 -3.991 1.00 0.00 ATOM 1156 CB ASP A 147 33.313 21.243 -4.758 1.00 0.00 ATOM 1157 CG ASP A 147 32.926 21.235 -6.223 1.00 0.00 ATOM 1158 OD1 ASP A 147 32.309 20.246 -6.671 1.00 0.00 ATOM 1159 OD2 ASP A 147 33.242 22.217 -6.928 1.00 0.00 ATOM 1160 O ASP A 147 34.459 18.577 -4.732 1.00 0.00 ATOM 1161 C ASP A 147 33.249 18.755 -4.602 1.00 0.00 ATOM 1162 N ASN A 148 32.378 17.838 -4.927 1.00 0.00 ATOM 1163 CA ASN A 148 32.807 16.515 -5.381 1.00 0.00 ATOM 1164 CB ASN A 148 31.655 15.525 -5.205 1.00 0.00 ATOM 1165 CG ASN A 148 31.429 15.145 -3.754 1.00 0.00 ATOM 1166 ND2 ASN A 148 30.211 14.729 -3.434 1.00 0.00 ATOM 1167 OD1 ASN A 148 32.343 15.228 -2.932 1.00 0.00 ATOM 1168 O ASN A 148 32.679 17.530 -7.567 1.00 0.00 ATOM 1169 C ASN A 148 33.128 16.615 -6.882 1.00 0.00 ATOM 1170 N GLY A 149 33.866 15.639 -7.388 1.00 0.00 ATOM 1171 CA GLY A 149 34.226 15.588 -8.793 1.00 0.00 ATOM 1172 O GLY A 149 33.011 15.428 -10.842 1.00 0.00 ATOM 1173 C GLY A 149 32.989 15.338 -9.622 1.00 0.00 ATOM 1174 N LYS A 150 31.911 14.960 -8.960 1.00 0.00 ATOM 1175 CA LYS A 150 30.680 14.680 -9.649 1.00 0.00 ATOM 1176 CB LYS A 150 30.038 13.405 -9.100 1.00 0.00 ATOM 1177 CG LYS A 150 30.891 12.157 -9.268 1.00 0.00 ATOM 1178 CD LYS A 150 31.168 11.873 -10.735 1.00 0.00 ATOM 1179 CE LYS A 150 31.931 10.569 -10.910 1.00 0.00 ATOM 1180 NZ LYS A 150 32.274 10.312 -12.336 1.00 0.00 ATOM 1181 O LYS A 150 28.628 15.836 -10.035 1.00 0.00 ATOM 1182 C LYS A 150 29.712 15.833 -9.463 1.00 0.00 ATOM 1183 N ASP A 151 29.540 16.550 -7.640 1.00 0.00 ATOM 1184 CA ASP A 151 28.527 17.575 -7.495 1.00 0.00 ATOM 1185 CB ASP A 151 28.978 18.633 -6.485 1.00 0.00 ATOM 1186 CG ASP A 151 27.919 19.689 -6.236 1.00 0.00 ATOM 1187 OD1 ASP A 151 26.885 19.358 -5.620 1.00 0.00 ATOM 1188 OD2 ASP A 151 28.123 20.846 -6.660 1.00 0.00 ATOM 1189 O ASP A 151 29.130 18.412 -9.656 1.00 0.00 ATOM 1190 C ASP A 151 28.243 18.284 -8.809 1.00 0.00 ATOM 1191 N GLN A 152 26.984 18.687 -8.984 1.00 0.00 ATOM 1192 CA GLN A 152 26.549 19.473 -10.130 1.00 0.00 ATOM 1193 CB GLN A 152 25.537 18.685 -10.966 1.00 0.00 ATOM 1194 CG GLN A 152 26.106 17.430 -11.608 1.00 0.00 ATOM 1195 CD GLN A 152 27.195 17.735 -12.616 1.00 0.00 ATOM 1196 OE1 GLN A 152 27.105 18.705 -13.369 1.00 0.00 ATOM 1197 NE2 GLN A 152 28.233 16.905 -12.635 1.00 0.00 ATOM 1198 O GLN A 152 25.860 20.774 -8.230 1.00 0.00 ATOM 1199 C GLN A 152 25.926 20.706 -9.459 1.00 0.00 ATOM 1200 N THR A 153 25.472 21.691 -10.219 1.00 0.00 ATOM 1201 CA THR A 153 24.863 22.841 -9.574 1.00 0.00 ATOM 1202 CB THR A 153 24.525 23.946 -10.592 1.00 0.00 ATOM 1203 CG2 THR A 153 25.784 24.421 -11.300 1.00 0.00 ATOM 1204 OG1 THR A 153 23.608 23.435 -11.568 1.00 0.00 ATOM 1205 O THR A 153 23.225 23.054 -7.850 1.00 0.00 ATOM 1206 C THR A 153 23.576 22.461 -8.851 1.00 0.00 ATOM 1207 N TYR A 154 22.884 21.460 -9.361 1.00 0.00 ATOM 1208 CA TYR A 154 21.664 21.001 -8.727 1.00 0.00 ATOM 1209 CB TYR A 154 20.957 19.973 -9.613 1.00 0.00 ATOM 1210 CG TYR A 154 19.674 19.433 -9.020 1.00 0.00 ATOM 1211 CD1 TYR A 154 18.501 20.174 -9.067 1.00 0.00 ATOM 1212 CD2 TYR A 154 19.642 18.182 -8.415 1.00 0.00 ATOM 1213 CE1 TYR A 154 17.325 19.689 -8.528 1.00 0.00 ATOM 1214 CE2 TYR A 154 18.475 17.681 -7.872 1.00 0.00 ATOM 1215 CZ TYR A 154 17.311 18.446 -7.932 1.00 0.00 ATOM 1216 OH TYR A 154 16.141 17.960 -7.395 1.00 0.00 ATOM 1217 O TYR A 154 21.202 20.656 -6.402 1.00 0.00 ATOM 1218 C TYR A 154 21.908 20.347 -7.376 1.00 0.00 ATOM 1219 N PHE A 155 22.883 19.443 -7.287 1.00 0.00 ATOM 1220 CA PHE A 155 23.157 18.790 -6.017 1.00 0.00 ATOM 1221 CB PHE A 155 24.147 17.640 -6.208 1.00 0.00 ATOM 1222 CG PHE A 155 23.543 16.420 -6.842 1.00 0.00 ATOM 1223 CD1 PHE A 155 23.763 16.135 -8.179 1.00 0.00 ATOM 1224 CD2 PHE A 155 22.755 15.555 -6.102 1.00 0.00 ATOM 1225 CE1 PHE A 155 23.207 15.013 -8.762 1.00 0.00 ATOM 1226 CE2 PHE A 155 22.200 14.431 -6.686 1.00 0.00 ATOM 1227 CZ PHE A 155 22.423 14.158 -8.010 1.00 0.00 ATOM 1228 O PHE A 155 23.431 19.713 -3.833 1.00 0.00 ATOM 1229 C PHE A 155 23.787 19.762 -5.038 1.00 0.00 ATOM 1230 N LEU A 156 24.644 20.696 -5.444 1.00 0.00 ATOM 1231 CA LEU A 156 25.227 21.728 -4.566 1.00 0.00 ATOM 1232 CB LEU A 156 26.249 22.539 -5.366 1.00 0.00 ATOM 1233 CG LEU A 156 26.994 23.632 -4.600 1.00 0.00 ATOM 1234 CD1 LEU A 156 27.790 23.037 -3.447 1.00 0.00 ATOM 1235 CD2 LEU A 156 27.964 24.366 -5.516 1.00 0.00 ATOM 1236 O LEU A 156 24.162 23.130 -2.897 1.00 0.00 ATOM 1237 C LEU A 156 24.130 22.675 -4.042 1.00 0.00 ATOM 1238 N SER A 157 23.150 22.960 -4.890 1.00 0.00 ATOM 1239 CA SER A 157 22.056 23.825 -4.511 1.00 0.00 ATOM 1240 CB SER A 157 21.122 24.057 -5.699 1.00 0.00 ATOM 1241 OG SER A 157 21.773 24.785 -6.727 1.00 0.00 ATOM 1242 O SER A 157 20.867 23.814 -2.423 1.00 0.00 ATOM 1243 C SER A 157 21.281 23.163 -3.381 1.00 0.00 ATOM 1244 N GLN A 158 21.025 21.874 -3.531 1.00 0.00 ATOM 1245 CA GLN A 158 20.280 21.145 -2.516 1.00 0.00 ATOM 1246 CB GLN A 158 20.204 19.671 -2.778 1.00 0.00 ATOM 1247 CG GLN A 158 19.404 19.369 -4.041 1.00 0.00 ATOM 1248 CD GLN A 158 17.978 19.877 -3.963 1.00 0.00 ATOM 1249 OE1 GLN A 158 17.227 19.534 -3.049 1.00 0.00 ATOM 1250 NE2 GLN A 158 17.597 20.707 -4.928 1.00 0.00 ATOM 1251 O GLN A 158 20.275 21.296 -0.130 1.00 0.00 ATOM 1252 C GLN A 158 20.954 21.195 -1.153 1.00 0.00 ATOM 1253 N LEU A 159 22.285 21.090 -1.166 1.00 0.00 ATOM 1254 CA LEU A 159 23.058 21.152 0.049 1.00 0.00 ATOM 1255 CB LEU A 159 24.307 20.180 -0.176 1.00 0.00 ATOM 1256 CG LEU A 159 25.220 19.971 1.025 1.00 0.00 ATOM 1257 CD1 LEU A 159 24.414 19.373 2.156 1.00 0.00 ATOM 1258 CD2 LEU A 159 26.426 19.089 0.640 1.00 0.00 ATOM 1259 O LEU A 159 23.610 22.746 1.711 1.00 0.00 ATOM 1260 C LEU A 159 23.320 22.551 0.542 1.00 0.00 ATOM 1261 N SER A 160 23.267 23.561 -0.313 1.00 0.00 ATOM 1262 CA SER A 160 23.605 24.901 0.084 1.00 0.00 ATOM 1263 CB SER A 160 23.214 25.899 -1.008 1.00 0.00 ATOM 1264 OG SER A 160 23.996 25.712 -2.175 1.00 0.00 ATOM 1265 O SER A 160 23.654 25.981 2.201 1.00 0.00 ATOM 1266 C SER A 160 22.952 25.443 1.363 1.00 0.00 ATOM 1267 N GLN A 161 21.673 25.339 1.445 1.00 0.00 ATOM 1268 CA GLN A 161 20.962 25.847 2.660 1.00 0.00 ATOM 1269 CB GLN A 161 19.454 25.617 2.536 1.00 0.00 ATOM 1270 CG GLN A 161 18.776 26.500 1.500 1.00 0.00 ATOM 1271 CD GLN A 161 17.292 26.218 1.377 1.00 0.00 ATOM 1272 OE1 GLN A 161 16.746 25.385 2.101 1.00 0.00 ATOM 1273 NE2 GLN A 161 16.634 26.913 0.456 1.00 0.00 ATOM 1274 O GLN A 161 21.321 25.749 5.027 1.00 0.00 ATOM 1275 C GLN A 161 21.413 25.162 3.961 1.00 0.00 ATOM 1276 N GLU A 162 21.942 23.933 3.839 1.00 0.00 ATOM 1277 CA GLU A 162 22.403 23.183 5.013 1.00 0.00 ATOM 1278 CB GLU A 162 22.232 21.696 4.787 1.00 0.00 ATOM 1279 CG GLU A 162 20.758 21.270 4.687 1.00 0.00 ATOM 1280 CD GLU A 162 20.020 21.745 3.420 1.00 0.00 ATOM 1281 OE1 GLU A 162 20.657 22.015 2.365 1.00 0.00 ATOM 1282 OE2 GLU A 162 18.763 21.842 3.466 1.00 0.00 ATOM 1283 O GLU A 162 23.935 23.564 6.761 1.00 0.00 ATOM 1284 C GLU A 162 23.603 23.863 5.618 1.00 0.00 ATOM 1285 N GLN A 163 24.196 24.850 4.888 1.00 0.00 ATOM 1286 CA GLN A 163 25.278 25.658 5.453 1.00 0.00 ATOM 1287 CB GLN A 163 25.751 26.642 4.382 1.00 0.00 ATOM 1288 CG GLN A 163 26.374 25.981 3.163 1.00 0.00 ATOM 1289 CD GLN A 163 26.729 26.978 2.077 1.00 0.00 ATOM 1290 OE1 GLN A 163 26.420 28.164 2.185 1.00 0.00 ATOM 1291 NE2 GLN A 163 27.380 26.497 1.024 1.00 0.00 ATOM 1292 O GLN A 163 25.725 26.498 7.665 1.00 0.00 ATOM 1293 C GLN A 163 24.907 26.434 6.716 1.00 0.00 ATOM 1294 N LEU A 164 23.708 26.940 6.787 1.00 0.00 ATOM 1295 CA LEU A 164 23.216 27.666 7.948 1.00 0.00 ATOM 1296 CB LEU A 164 21.899 28.375 7.619 1.00 0.00 ATOM 1297 CG LEU A 164 21.334 29.291 8.705 1.00 0.00 ATOM 1298 CD1 LEU A 164 22.316 30.404 9.035 1.00 0.00 ATOM 1299 CD2 LEU A 164 20.032 29.927 8.247 1.00 0.00 ATOM 1300 O LEU A 164 23.342 27.070 10.263 1.00 0.00 ATOM 1301 C LEU A 164 23.007 26.721 9.145 1.00 0.00 ATOM 1302 N GLN A 165 22.496 25.540 8.897 1.00 0.00 ATOM 1303 CA GLN A 165 22.304 24.584 9.987 1.00 0.00 ATOM 1304 CB GLN A 165 21.455 23.404 9.471 1.00 0.00 ATOM 1305 CG GLN A 165 20.019 23.787 9.110 1.00 0.00 ATOM 1306 CD GLN A 165 19.130 22.586 8.902 1.00 0.00 ATOM 1307 OE1 GLN A 165 19.615 21.475 8.700 1.00 0.00 ATOM 1308 NE2 GLN A 165 17.820 22.799 8.934 1.00 0.00 ATOM 1309 O GLN A 165 23.751 23.842 11.711 1.00 0.00 ATOM 1310 C GLN A 165 23.636 24.062 10.496 1.00 0.00 ATOM 1311 N LYS A 166 24.529 23.717 9.632 1.00 0.00 ATOM 1312 CA LYS A 166 25.829 23.259 10.111 1.00 0.00 ATOM 1313 CB LYS A 166 26.837 23.331 8.963 1.00 0.00 ATOM 1314 CG LYS A 166 28.194 22.729 9.288 1.00 0.00 ATOM 1315 CD LYS A 166 29.119 22.767 8.083 1.00 0.00 ATOM 1316 CE LYS A 166 30.478 22.173 8.412 1.00 0.00 ATOM 1317 NZ LYS A 166 31.394 22.202 7.238 1.00 0.00 ATOM 1318 O LYS A 166 26.877 23.946 12.190 1.00 0.00 ATOM 1319 C LYS A 166 26.395 24.323 11.131 1.00 0.00 ATOM 1320 N THR A 167 26.907 26.217 10.717 1.00 0.00 ATOM 1321 CA THR A 167 27.477 27.261 11.565 1.00 0.00 ATOM 1322 CB THR A 167 27.271 28.657 10.971 1.00 0.00 ATOM 1323 CG2 THR A 167 27.766 29.731 11.929 1.00 0.00 ATOM 1324 OG1 THR A 167 27.990 28.747 9.736 1.00 0.00 ATOM 1325 O THR A 167 27.512 27.249 13.966 1.00 0.00 ATOM 1326 C THR A 167 26.833 27.185 12.929 1.00 0.00 ATOM 1327 N MET A 168 25.515 27.056 12.917 1.00 0.00 ATOM 1328 CA MET A 168 24.765 26.973 14.172 1.00 0.00 ATOM 1329 CB MET A 168 23.275 26.769 13.892 1.00 0.00 ATOM 1330 CG MET A 168 22.580 27.987 13.308 1.00 0.00 ATOM 1331 SD MET A 168 22.597 29.402 14.426 1.00 0.00 ATOM 1332 CE MET A 168 21.504 28.823 15.721 1.00 0.00 ATOM 1333 O MET A 168 25.496 25.916 16.212 1.00 0.00 ATOM 1334 C MET A 168 25.278 25.795 15.004 1.00 0.00 ATOM 1335 N PHE A 169 25.451 24.650 14.349 1.00 0.00 ATOM 1336 CA PHE A 169 25.910 23.448 15.021 1.00 0.00 ATOM 1337 CB PHE A 169 25.902 22.260 14.056 1.00 0.00 ATOM 1338 CG PHE A 169 26.372 20.974 14.676 1.00 0.00 ATOM 1339 CD1 PHE A 169 25.529 20.227 15.480 1.00 0.00 ATOM 1340 CD2 PHE A 169 27.657 20.510 14.451 1.00 0.00 ATOM 1341 CE1 PHE A 169 25.961 19.045 16.049 1.00 0.00 ATOM 1342 CE2 PHE A 169 28.089 19.327 15.021 1.00 0.00 ATOM 1343 CZ PHE A 169 27.247 18.595 15.816 1.00 0.00 ATOM 1344 O PHE A 169 27.614 23.201 16.682 1.00 0.00 ATOM 1345 C PHE A 169 27.326 23.612 15.550 1.00 0.00 ATOM 1346 N PRO A 170 28.199 24.238 14.759 1.00 0.00 ATOM 1347 CA PRO A 170 29.575 24.470 15.178 1.00 0.00 ATOM 1348 CB PRO A 170 30.332 24.842 13.890 1.00 0.00 ATOM 1349 CG PRO A 170 29.418 24.406 12.751 1.00 0.00 ATOM 1350 CD PRO A 170 28.014 24.394 13.320 1.00 0.00 ATOM 1351 O PRO A 170 30.567 25.436 17.145 1.00 0.00 ATOM 1352 C PRO A 170 29.604 25.426 16.370 1.00 0.00 ATOM 1353 N LEU A 171 28.570 26.253 16.492 1.00 0.00 ATOM 1354 CA LEU A 171 28.497 27.197 17.598 1.00 0.00 ATOM 1355 CB LEU A 171 27.731 28.454 17.180 1.00 0.00 ATOM 1356 CG LEU A 171 28.331 29.264 16.031 1.00 0.00 ATOM 1357 CD1 LEU A 171 27.424 30.427 15.660 1.00 0.00 ATOM 1358 CD2 LEU A 171 29.689 29.828 16.423 1.00 0.00 ATOM 1359 O LEU A 171 27.557 27.388 19.762 1.00 0.00 ATOM 1360 C LEU A 171 27.797 26.642 18.819 1.00 0.00 ATOM 1361 N GLY A 172 27.447 25.356 18.787 1.00 0.00 ATOM 1362 CA GLY A 172 26.822 24.733 19.951 1.00 0.00 ATOM 1363 O GLY A 172 24.729 24.393 21.059 1.00 0.00 ATOM 1364 C GLY A 172 25.315 24.664 19.998 1.00 0.00 ATOM 1365 N HIS A 173 24.672 24.888 18.861 1.00 0.00 ATOM 1366 CA HIS A 173 23.219 24.843 18.811 1.00 0.00 ATOM 1367 CB HIS A 173 22.658 26.184 18.332 1.00 0.00 ATOM 1368 CG HIS A 173 21.164 26.214 18.237 1.00 0.00 ATOM 1369 CD2 HIS A 173 20.193 26.283 17.154 1.00 0.00 ATOM 1370 ND1 HIS A 173 20.346 26.172 19.345 1.00 0.00 ATOM 1371 CE1 HIS A 173 19.063 26.212 18.945 1.00 0.00 ATOM 1372 NE2 HIS A 173 18.964 26.281 17.631 1.00 0.00 ATOM 1373 O HIS A 173 22.910 23.838 16.670 1.00 0.00 ATOM 1374 C HIS A 173 22.686 23.782 17.875 1.00 0.00 ATOM 1375 N LEU A 174 21.973 22.824 18.460 1.00 0.00 ATOM 1376 CA LEU A 174 21.376 21.724 17.715 1.00 0.00 ATOM 1377 CB LEU A 174 21.088 20.541 18.642 1.00 0.00 ATOM 1378 CG LEU A 174 22.303 19.894 19.311 1.00 0.00 ATOM 1379 CD1 LEU A 174 21.867 18.800 20.274 1.00 0.00 ATOM 1380 CD2 LEU A 174 23.222 19.271 18.270 1.00 0.00 ATOM 1381 O LEU A 174 19.227 22.763 17.609 1.00 0.00 ATOM 1382 C LEU A 174 20.061 22.069 17.038 1.00 0.00 ATOM 1383 N GLU A 175 19.875 21.589 15.805 1.00 0.00 ATOM 1384 CA GLU A 175 18.628 21.867 15.118 1.00 0.00 ATOM 1385 CB GLU A 175 18.877 22.091 13.626 1.00 0.00 ATOM 1386 CG GLU A 175 19.771 23.281 13.317 1.00 0.00 ATOM 1387 CD GLU A 175 19.202 24.588 13.831 1.00 0.00 ATOM 1388 OE1 GLU A 175 18.051 24.916 13.471 1.00 0.00 ATOM 1389 OE2 GLU A 175 19.904 25.284 14.593 1.00 0.00 ATOM 1390 O GLU A 175 18.058 19.583 15.518 1.00 0.00 ATOM 1391 C GLU A 175 17.657 20.715 15.268 1.00 0.00 ATOM 1392 N LYS A 176 16.369 21.027 15.122 1.00 0.00 ATOM 1393 CA LYS A 176 15.297 20.058 15.258 1.00 0.00 ATOM 1394 CB LYS A 176 13.994 20.616 14.681 1.00 0.00 ATOM 1395 CG LYS A 176 12.795 19.696 14.851 1.00 0.00 ATOM 1396 CD LYS A 176 11.528 20.332 14.304 1.00 0.00 ATOM 1397 CE LYS A 176 10.338 19.399 14.444 1.00 0.00 ATOM 1398 NZ LYS A 176 9.086 20.014 13.919 1.00 0.00 ATOM 1399 O LYS A 176 15.392 17.673 15.149 1.00 0.00 ATOM 1400 C LYS A 176 15.550 18.737 14.546 1.00 0.00 ATOM 1401 N PRO A 177 15.950 18.807 13.274 1.00 0.00 ATOM 1402 CA PRO A 177 16.182 17.558 12.532 1.00 0.00 ATOM 1403 CB PRO A 177 16.604 18.026 11.138 1.00 0.00 ATOM 1404 CG PRO A 177 15.944 19.356 10.976 1.00 0.00 ATOM 1405 CD PRO A 177 16.015 20.023 12.321 1.00 0.00 ATOM 1406 O PRO A 177 17.133 15.489 13.292 1.00 0.00 ATOM 1407 C PRO A 177 17.286 16.711 13.199 1.00 0.00 ATOM 1408 N GLU A 178 18.287 17.317 13.831 1.00 0.00 ATOM 1409 CA GLU A 178 19.336 16.619 14.573 1.00 0.00 ATOM 1410 CB GLU A 178 20.439 17.594 14.987 1.00 0.00 ATOM 1411 CG GLU A 178 21.292 18.095 13.834 1.00 0.00 ATOM 1412 CD GLU A 178 22.291 19.151 14.263 1.00 0.00 ATOM 1413 OE1 GLU A 178 22.267 19.545 15.447 1.00 0.00 ATOM 1414 OE2 GLU A 178 23.098 19.584 13.414 1.00 0.00 ATOM 1415 O GLU A 178 19.137 14.847 16.185 1.00 0.00 ATOM 1416 C GLU A 178 18.785 15.971 15.832 1.00 0.00 ATOM 1417 N VAL A 179 17.918 16.692 16.552 1.00 0.00 ATOM 1418 CA VAL A 179 17.360 16.140 17.783 1.00 0.00 ATOM 1419 CB VAL A 179 16.539 17.192 18.552 1.00 0.00 ATOM 1420 CG1 VAL A 179 15.815 16.549 19.726 1.00 0.00 ATOM 1421 CG2 VAL A 179 17.447 18.288 19.089 1.00 0.00 ATOM 1422 O VAL A 179 16.492 13.946 18.233 1.00 0.00 ATOM 1423 C VAL A 179 16.433 14.959 17.524 1.00 0.00 ATOM 1424 N ARG A 180 15.615 15.053 16.449 1.00 0.00 ATOM 1425 CA ARG A 180 14.767 13.970 16.021 1.00 0.00 ATOM 1426 CB ARG A 180 14.008 14.356 14.751 1.00 0.00 ATOM 1427 CG ARG A 180 13.001 13.314 14.290 1.00 0.00 ATOM 1428 CD ARG A 180 12.294 13.754 13.017 1.00 0.00 ATOM 1429 NE ARG A 180 11.498 14.961 13.223 1.00 0.00 ATOM 1430 CZ ARG A 180 10.276 14.972 13.744 1.00 0.00 ATOM 1431 NH1 ARG A 180 9.627 16.118 13.893 1.00 0.00 ATOM 1432 NH2 ARG A 180 9.705 13.832 14.115 1.00 0.00 ATOM 1433 O ARG A 180 15.317 11.610 16.154 1.00 0.00 ATOM 1434 C ARG A 180 15.639 12.712 15.727 1.00 0.00 ATOM 1435 N ARG A 181 16.716 12.878 14.976 1.00 0.00 ATOM 1436 CA ARG A 181 17.612 11.732 14.702 1.00 0.00 ATOM 1437 CB ARG A 181 18.758 12.157 13.781 1.00 0.00 ATOM 1438 CG ARG A 181 18.332 12.435 12.349 1.00 0.00 ATOM 1439 CD ARG A 181 19.503 12.920 11.510 1.00 0.00 ATOM 1440 NE ARG A 181 19.105 13.219 10.135 1.00 0.00 ATOM 1441 CZ ARG A 181 19.918 13.728 9.216 1.00 0.00 ATOM 1442 NH1 ARG A 181 19.468 13.968 7.992 1.00 0.00 ATOM 1443 NH2 ARG A 181 21.180 13.997 9.523 1.00 0.00 ATOM 1444 O ARG A 181 18.294 9.944 16.167 1.00 0.00 ATOM 1445 C ARG A 181 18.231 11.169 15.989 1.00 0.00 ATOM 1446 N LEU A 182 18.589 12.032 16.940 1.00 0.00 ATOM 1447 CA LEU A 182 19.149 11.532 18.165 1.00 0.00 ATOM 1448 CB LEU A 182 19.520 12.688 19.095 1.00 0.00 ATOM 1449 CG LEU A 182 20.713 13.546 18.666 1.00 0.00 ATOM 1450 CD1 LEU A 182 20.854 14.762 19.568 1.00 0.00 ATOM 1451 CD2 LEU A 182 22.005 12.747 18.740 1.00 0.00 ATOM 1452 O LEU A 182 18.518 9.592 19.356 1.00 0.00 ATOM 1453 C LEU A 182 18.159 10.639 18.895 1.00 0.00 ATOM 1454 N ALA A 183 16.935 11.111 19.069 1.00 0.00 ATOM 1455 CA ALA A 183 15.933 10.376 19.832 1.00 0.00 ATOM 1456 CB ALA A 183 14.669 11.195 19.998 1.00 0.00 ATOM 1457 O ALA A 183 15.450 7.989 19.785 1.00 0.00 ATOM 1458 C ALA A 183 15.602 9.049 19.121 1.00 0.00 ATOM 1459 N GLU A 184 15.466 9.122 17.800 1.00 0.00 ATOM 1460 CA GLU A 184 15.153 7.934 16.994 1.00 0.00 ATOM 1461 CB GLU A 184 14.894 8.307 15.552 1.00 0.00 ATOM 1462 CG GLU A 184 13.500 8.985 15.412 1.00 0.00 ATOM 1463 CD GLU A 184 13.334 9.802 14.146 1.00 0.00 ATOM 1464 OE1 GLU A 184 12.275 10.463 14.033 1.00 0.00 ATOM 1465 OE2 GLU A 184 14.236 9.782 13.270 1.00 0.00 ATOM 1466 O GLU A 184 16.135 5.768 17.344 1.00 0.00 ATOM 1467 C GLU A 184 16.326 6.963 17.105 1.00 0.00 ATOM 1468 N GLU A 185 17.562 7.466 16.959 1.00 0.00 ATOM 1469 CA GLU A 185 18.756 6.636 17.019 1.00 0.00 ATOM 1470 CB GLU A 185 19.983 7.410 16.535 1.00 0.00 ATOM 1471 CG GLU A 185 20.374 8.575 17.429 1.00 0.00 ATOM 1472 CD GLU A 185 21.585 9.326 16.911 1.00 0.00 ATOM 1473 OE1 GLU A 185 22.093 8.961 15.830 1.00 0.00 ATOM 1474 OE2 GLU A 185 22.026 10.281 17.587 1.00 0.00 ATOM 1475 O GLU A 185 19.745 5.169 18.645 1.00 0.00 ATOM 1476 C GLU A 185 19.045 6.173 18.441 1.00 0.00 ATOM 1477 N ALA A 186 18.572 6.873 19.465 1.00 0.00 ATOM 1478 CA ALA A 186 19.069 6.597 20.805 1.00 0.00 ATOM 1479 CB ALA A 186 18.505 7.604 21.797 1.00 0.00 ATOM 1480 O ALA A 186 19.504 4.561 22.021 1.00 0.00 ATOM 1481 C ALA A 186 18.693 5.206 21.319 1.00 0.00 ATOM 1482 N GLY A 187 22.114 8.482 21.924 1.00 0.00 ATOM 1483 CA GLY A 187 22.690 9.281 22.994 1.00 0.00 ATOM 1484 O GLY A 187 22.059 10.968 24.566 1.00 0.00 ATOM 1485 C GLY A 187 21.846 10.446 23.471 1.00 0.00 ATOM 1486 N LEU A 188 20.884 10.858 22.656 1.00 0.00 ATOM 1487 CA LEU A 188 20.015 11.978 22.993 1.00 0.00 ATOM 1488 CB LEU A 188 19.008 12.231 21.869 1.00 0.00 ATOM 1489 CG LEU A 188 18.036 13.394 22.079 1.00 0.00 ATOM 1490 CD1 LEU A 188 18.792 14.710 22.209 1.00 0.00 ATOM 1491 CD2 LEU A 188 17.077 13.512 20.905 1.00 0.00 ATOM 1492 O LEU A 188 19.016 12.708 25.048 1.00 0.00 ATOM 1493 C LEU A 188 19.201 11.773 24.268 1.00 0.00 ATOM 1494 N SER A 189 18.717 10.552 24.482 1.00 0.00 ATOM 1495 CA SER A 189 17.907 10.253 25.659 1.00 0.00 ATOM 1496 CB SER A 189 16.625 9.523 25.255 1.00 0.00 ATOM 1497 OG SER A 189 16.917 8.287 24.627 1.00 0.00 ATOM 1498 O SER A 189 18.016 8.899 27.636 1.00 0.00 ATOM 1499 C SER A 189 18.624 9.366 26.672 1.00 0.00 ATOM 1500 N THR A 190 19.915 9.131 26.455 1.00 0.00 ATOM 1501 CA THR A 190 20.692 8.302 27.364 1.00 0.00 ATOM 1502 CB THR A 190 21.346 7.119 26.628 1.00 0.00 ATOM 1503 CG2 THR A 190 20.284 6.192 26.057 1.00 0.00 ATOM 1504 OG1 THR A 190 22.159 7.610 25.555 1.00 0.00 ATOM 1505 O THR A 190 22.921 8.600 28.209 1.00 0.00 ATOM 1506 C THR A 190 21.810 9.098 28.032 1.00 0.00 ATOM 1507 N ALA A 191 21.460 10.601 28.594 1.00 0.00 ATOM 1508 CA ALA A 191 22.440 11.472 29.256 1.00 0.00 ATOM 1509 CB ALA A 191 21.846 12.852 29.497 1.00 0.00 ATOM 1510 O ALA A 191 23.981 11.404 31.070 1.00 0.00 ATOM 1511 C ALA A 191 22.921 10.972 30.605 1.00 0.00 ATOM 1512 N LYS A 192 22.196 10.048 31.229 1.00 0.00 ATOM 1513 CA LYS A 192 22.685 9.550 32.518 1.00 0.00 ATOM 1514 CB LYS A 192 21.517 9.081 33.389 1.00 0.00 ATOM 1515 CG LYS A 192 20.572 10.195 33.812 1.00 0.00 ATOM 1516 CD LYS A 192 19.416 9.656 34.638 1.00 0.00 ATOM 1517 CE LYS A 192 18.477 10.769 35.067 1.00 0.00 ATOM 1518 NZ LYS A 192 17.354 10.257 35.902 1.00 0.00 ATOM 1519 O LYS A 192 24.267 7.908 33.262 1.00 0.00 ATOM 1520 C LYS A 192 23.634 8.375 32.317 1.00 0.00 ATOM 1521 N LYS A 193 23.746 7.895 31.082 1.00 0.00 ATOM 1522 CA LYS A 193 24.610 6.761 30.796 1.00 0.00 ATOM 1523 CB LYS A 193 23.963 5.843 29.757 1.00 0.00 ATOM 1524 CG LYS A 193 24.747 4.570 29.480 1.00 0.00 ATOM 1525 CD LYS A 193 24.067 3.723 28.416 1.00 0.00 ATOM 1526 CE LYS A 193 24.845 2.446 28.147 1.00 0.00 ATOM 1527 NZ LYS A 193 24.188 1.603 27.110 1.00 0.00 ATOM 1528 O LYS A 193 26.152 7.760 29.268 1.00 0.00 ATOM 1529 C LYS A 193 26.003 7.047 30.261 1.00 0.00 ATOM 1530 N LYS A 194 27.090 6.550 31.005 1.00 0.00 ATOM 1531 CA LYS A 194 28.471 6.710 30.561 1.00 0.00 ATOM 1532 CB LYS A 194 29.434 6.606 31.745 1.00 0.00 ATOM 1533 CG LYS A 194 30.893 6.819 31.378 1.00 0.00 ATOM 1534 CD LYS A 194 31.782 6.801 32.612 1.00 0.00 ATOM 1535 CE LYS A 194 33.234 7.065 32.250 1.00 0.00 ATOM 1536 NZ LYS A 194 34.112 7.075 33.452 1.00 0.00 ATOM 1537 O LYS A 194 28.952 4.435 29.941 1.00 0.00 ATOM 1538 C LYS A 194 28.727 5.576 29.557 1.00 0.00 ATOM 1539 N ASP A 195 28.670 5.881 28.252 1.00 0.00 ATOM 1540 CA ASP A 195 28.887 4.844 27.220 1.00 0.00 ATOM 1541 CB ASP A 195 28.884 5.470 25.824 1.00 0.00 ATOM 1542 CG ASP A 195 27.498 5.888 25.375 1.00 0.00 ATOM 1543 OD1 ASP A 195 26.518 5.519 26.054 1.00 0.00 ATOM 1544 OD2 ASP A 195 27.392 6.584 24.342 1.00 0.00 ATOM 1545 O ASP A 195 31.252 4.682 27.613 1.00 0.00 ATOM 1546 C ASP A 195 30.196 4.085 27.338 1.00 0.00 ATOM 1547 N SER A 196 30.136 2.774 27.140 1.00 0.00 ATOM 1548 CA SER A 196 31.341 1.981 27.228 1.00 0.00 ATOM 1549 CB SER A 196 31.083 0.700 28.024 1.00 0.00 ATOM 1550 OG SER A 196 30.143 -0.130 27.364 1.00 0.00 ATOM 1551 O SER A 196 32.986 0.927 25.830 1.00 0.00 ATOM 1552 C SER A 196 31.911 1.540 25.880 1.00 0.00 ATOM 1553 N THR A 197 31.214 1.848 24.781 1.00 0.00 ATOM 1554 CA THR A 197 31.718 1.481 23.450 1.00 0.00 ATOM 1555 CB THR A 197 30.760 0.516 22.730 1.00 0.00 ATOM 1556 CG2 THR A 197 30.603 -0.771 23.525 1.00 0.00 ATOM 1557 OG1 THR A 197 29.474 1.131 22.587 1.00 0.00 ATOM 1558 O THR A 197 32.301 2.618 21.420 1.00 0.00 ATOM 1559 C THR A 197 31.880 2.715 22.570 1.00 0.00 ATOM 1560 N GLY A 198 31.552 3.878 23.109 1.00 0.00 ATOM 1561 CA GLY A 198 31.644 5.090 22.320 1.00 0.00 ATOM 1562 O GLY A 198 31.793 6.227 24.418 1.00 0.00 ATOM 1563 C GLY A 198 31.732 6.324 23.188 1.00 0.00 ATOM 1564 N ILE A 199 31.715 7.482 22.538 1.00 0.00 ATOM 1565 CA ILE A 199 31.821 8.763 23.242 1.00 0.00 ATOM 1566 CB ILE A 199 32.600 9.800 22.412 1.00 0.00 ATOM 1567 CG1 ILE A 199 31.856 10.112 21.114 1.00 0.00 ATOM 1568 CG2 ILE A 199 33.982 9.270 22.060 1.00 0.00 ATOM 1569 CD1 ILE A 199 32.411 11.302 20.361 1.00 0.00 ATOM 1570 O ILE A 199 29.416 8.970 23.058 1.00 0.00 ATOM 1571 C ILE A 199 30.467 9.403 23.561 1.00 0.00 ATOM 1572 N CYS A 200 30.486 10.422 24.428 1.00 0.00 ATOM 1573 CA CYS A 200 29.260 11.138 24.805 1.00 0.00 ATOM 1574 CB CYS A 200 29.428 11.801 26.174 1.00 0.00 ATOM 1575 SG CYS A 200 29.703 10.645 27.536 1.00 0.00 ATOM 1576 O CYS A 200 29.299 13.386 23.923 1.00 0.00 ATOM 1577 C CYS A 200 29.004 12.198 23.741 1.00 0.00 ATOM 1578 N PHE A 201 28.423 11.776 22.622 1.00 0.00 ATOM 1579 CA PHE A 201 28.210 12.688 21.503 1.00 0.00 ATOM 1580 CB PHE A 201 27.685 11.927 20.285 1.00 0.00 ATOM 1581 CG PHE A 201 27.682 12.735 19.019 1.00 0.00 ATOM 1582 CD1 PHE A 201 28.869 13.051 18.381 1.00 0.00 ATOM 1583 CD2 PHE A 201 26.493 13.182 18.468 1.00 0.00 ATOM 1584 CE1 PHE A 201 28.866 13.796 17.216 1.00 0.00 ATOM 1585 CE2 PHE A 201 26.492 13.926 17.304 1.00 0.00 ATOM 1586 CZ PHE A 201 27.672 14.233 16.678 1.00 0.00 ATOM 1587 O PHE A 201 27.187 14.797 21.035 1.00 0.00 ATOM 1588 C PHE A 201 27.210 13.804 21.763 1.00 0.00 ATOM 1589 N ILE A 202 26.539 13.315 23.002 1.00 0.00 ATOM 1590 CA ILE A 202 25.545 14.333 23.316 1.00 0.00 ATOM 1591 CB ILE A 202 24.512 13.819 24.336 1.00 0.00 ATOM 1592 CG1 ILE A 202 23.282 14.727 24.356 1.00 0.00 ATOM 1593 CG2 ILE A 202 25.114 13.792 25.735 1.00 0.00 ATOM 1594 CD1 ILE A 202 22.108 14.149 25.114 1.00 0.00 ATOM 1595 O ILE A 202 25.756 16.631 23.845 1.00 0.00 ATOM 1596 C ILE A 202 26.292 15.529 23.900 1.00 0.00 ATOM 1597 N GLY A 203 27.495 14.970 24.414 1.00 0.00 ATOM 1598 CA GLY A 203 28.163 16.011 25.159 1.00 0.00 ATOM 1599 O GLY A 203 29.985 16.426 23.649 1.00 0.00 ATOM 1600 C GLY A 203 28.995 16.885 24.217 1.00 0.00 ATOM 1601 N GLU A 204 28.582 18.142 24.060 1.00 0.00 ATOM 1602 CA GLU A 204 29.261 19.107 23.191 1.00 0.00 ATOM 1603 CB GLU A 204 28.397 20.436 23.081 1.00 0.00 ATOM 1604 CG GLU A 204 28.934 21.502 22.166 1.00 0.00 ATOM 1605 CD GLU A 204 28.735 21.139 20.743 1.00 0.00 ATOM 1606 OE1 GLU A 204 29.593 21.512 19.921 1.00 0.00 ATOM 1607 OE2 GLU A 204 27.740 20.470 20.461 1.00 0.00 ATOM 1608 O GLU A 204 31.501 19.618 22.524 1.00 0.00 ATOM 1609 C GLU A 204 30.752 19.272 23.443 1.00 0.00 ATOM 1610 N LYS A 205 31.188 19.037 24.679 1.00 0.00 ATOM 1611 CA LYS A 205 32.598 19.190 25.023 1.00 0.00 ATOM 1612 CB LYS A 205 32.777 19.227 26.542 1.00 0.00 ATOM 1613 CG LYS A 205 32.177 20.453 27.208 1.00 0.00 ATOM 1614 CD LYS A 205 32.400 20.431 28.712 1.00 0.00 ATOM 1615 CE LYS A 205 31.810 21.664 29.377 1.00 0.00 ATOM 1616 NZ LYS A 205 32.010 21.650 30.852 1.00 0.00 ATOM 1617 O LYS A 205 34.699 18.151 24.506 1.00 0.00 ATOM 1618 C LYS A 205 33.472 18.060 24.502 1.00 0.00 ATOM 1619 N ASN A 206 32.842 16.984 24.040 1.00 0.00 ATOM 1620 CA ASN A 206 33.583 15.858 23.499 1.00 0.00 ATOM 1621 CB ASN A 206 32.789 14.561 23.676 1.00 0.00 ATOM 1622 CG ASN A 206 33.573 13.337 23.245 1.00 0.00 ATOM 1623 ND2 ASN A 206 33.230 12.187 23.814 1.00 0.00 ATOM 1624 OD1 ASN A 206 34.475 13.426 22.412 1.00 0.00 ATOM 1625 O ASN A 206 32.829 16.353 21.285 1.00 0.00 ATOM 1626 C ASN A 206 33.797 16.155 22.023 1.00 0.00 ATOM 1627 N PHE A 207 35.055 16.213 21.600 1.00 0.00 ATOM 1628 CA PHE A 207 35.363 16.517 20.209 1.00 0.00 ATOM 1629 CB PHE A 207 36.751 17.150 20.094 1.00 0.00 ATOM 1630 CG PHE A 207 36.836 18.534 20.672 1.00 0.00 ATOM 1631 CD1 PHE A 207 37.297 18.734 21.962 1.00 0.00 ATOM 1632 CD2 PHE A 207 36.455 19.637 19.927 1.00 0.00 ATOM 1633 CE1 PHE A 207 37.376 20.007 22.495 1.00 0.00 ATOM 1634 CE2 PHE A 207 36.532 20.909 20.459 1.00 0.00 ATOM 1635 CZ PHE A 207 36.991 21.096 21.737 1.00 0.00 ATOM 1636 O PHE A 207 36.018 14.286 19.640 1.00 0.00 ATOM 1637 C PHE A 207 35.352 15.277 19.340 1.00 0.00 ATOM 1638 N LYS A 208 34.595 15.352 18.248 1.00 0.00 ATOM 1639 CA LYS A 208 34.476 14.234 17.326 1.00 0.00 ATOM 1640 CB LYS A 208 33.853 13.060 17.639 1.00 0.00 ATOM 1641 CG LYS A 208 34.834 12.137 18.377 1.00 0.00 ATOM 1642 CD LYS A 208 36.175 11.976 17.637 1.00 0.00 ATOM 1643 CE LYS A 208 37.091 10.981 18.348 1.00 0.00 ATOM 1644 NZ LYS A 208 38.445 10.859 17.717 1.00 0.00 ATOM 1645 O LYS A 208 33.654 15.220 15.295 1.00 0.00 ATOM 1646 C LYS A 208 34.615 14.751 15.899 1.00 0.00 ATOM 1647 N ASN A 209 35.828 14.674 15.338 1.00 0.00 ATOM 1648 CA ASN A 209 36.006 15.157 13.966 1.00 0.00 ATOM 1649 CB ASN A 209 37.489 15.158 13.587 1.00 0.00 ATOM 1650 CG ASN A 209 38.272 16.238 14.308 1.00 0.00 ATOM 1651 ND2 ASN A 209 39.586 16.060 14.386 1.00 0.00 ATOM 1652 OD1 ASN A 209 37.701 17.219 14.785 1.00 0.00 ATOM 1653 O ASN A 209 35.100 13.056 13.248 1.00 0.00 ATOM 1654 C ASN A 209 35.256 14.257 12.989 1.00 0.00 ATOM 1655 N PHE A 210 34.759 14.850 11.907 1.00 0.00 ATOM 1656 CA PHE A 210 34.075 14.082 10.868 1.00 0.00 ATOM 1657 CB PHE A 210 33.595 15.008 9.747 1.00 0.00 ATOM 1658 CG PHE A 210 32.454 15.899 10.143 1.00 0.00 ATOM 1659 CD1 PHE A 210 31.815 15.730 11.361 1.00 0.00 ATOM 1660 CD2 PHE A 210 32.019 16.907 9.302 1.00 0.00 ATOM 1661 CE1 PHE A 210 30.764 16.550 11.726 1.00 0.00 ATOM 1662 CE2 PHE A 210 30.968 17.727 9.666 1.00 0.00 ATOM 1663 CZ PHE A 210 30.342 17.553 10.873 1.00 0.00 ATOM 1664 O PHE A 210 36.299 13.406 10.266 1.00 0.00 ATOM 1665 C PHE A 210 35.107 13.089 10.350 1.00 0.00 ATOM 1666 N LEU A 211 34.664 11.889 9.996 1.00 0.00 ATOM 1667 CA LEU A 211 35.588 10.862 9.517 1.00 0.00 ATOM 1668 CB LEU A 211 35.860 9.833 10.616 1.00 0.00 ATOM 1669 CG LEU A 211 36.760 8.656 10.233 1.00 0.00 ATOM 1670 CD1 LEU A 211 38.174 9.133 9.943 1.00 0.00 ATOM 1671 CD2 LEU A 211 36.823 7.639 11.364 1.00 0.00 ATOM 1672 O LEU A 211 33.830 9.803 8.266 1.00 0.00 ATOM 1673 C LEU A 211 35.020 10.130 8.304 1.00 0.00 ATOM 1674 N SER A 212 35.865 9.929 7.292 1.00 0.00 ATOM 1675 CA SER A 212 35.457 9.207 6.084 1.00 0.00 ATOM 1676 CB SER A 212 36.187 9.719 4.840 1.00 0.00 ATOM 1677 OG SER A 212 35.801 11.047 4.533 1.00 0.00 ATOM 1678 O SER A 212 36.901 7.434 6.831 1.00 0.00 ATOM 1679 C SER A 212 35.813 7.740 6.336 1.00 0.00 ATOM 1680 N ASN A 213 34.860 6.788 5.978 1.00 0.00 ATOM 1681 CA ASN A 213 35.054 5.360 6.175 1.00 0.00 ATOM 1682 CB ASN A 213 34.371 4.898 7.464 1.00 0.00 ATOM 1683 CG ASN A 213 34.943 5.569 8.698 1.00 0.00 ATOM 1684 ND2 ASN A 213 34.223 6.554 9.223 1.00 0.00 ATOM 1685 OD1 ASN A 213 36.018 5.203 9.172 1.00 0.00 ATOM 1686 O ASN A 213 33.484 5.022 4.402 1.00 0.00 ATOM 1687 C ASN A 213 34.495 4.617 4.975 1.00 0.00 ATOM 1688 N TYR A 214 35.142 3.475 4.605 1.00 0.00 ATOM 1689 CA TYR A 214 34.655 2.653 3.515 1.00 0.00 ATOM 1690 CB TYR A 214 35.590 2.678 2.280 1.00 0.00 ATOM 1691 CG TYR A 214 36.859 1.850 2.406 1.00 0.00 ATOM 1692 CD1 TYR A 214 37.011 0.657 1.702 1.00 0.00 ATOM 1693 CD2 TYR A 214 37.962 2.356 3.068 1.00 0.00 ATOM 1694 CE1 TYR A 214 38.206 -0.052 1.727 1.00 0.00 ATOM 1695 CE2 TYR A 214 39.169 1.662 3.109 1.00 0.00 ATOM 1696 CZ TYR A 214 39.292 0.453 2.424 1.00 0.00 ATOM 1697 OH TYR A 214 40.476 -0.269 2.499 1.00 0.00 ATOM 1698 O TYR A 214 34.893 0.704 4.879 1.00 0.00 ATOM 1699 C TYR A 214 34.177 1.329 4.092 1.00 0.00 ATOM 1700 N LEU A 215 32.831 0.838 3.855 1.00 0.00 ATOM 1701 CA LEU A 215 32.313 -0.428 4.370 1.00 0.00 ATOM 1702 CB LEU A 215 31.042 -0.353 5.218 1.00 0.00 ATOM 1703 CG LEU A 215 31.130 0.472 6.503 1.00 0.00 ATOM 1704 CD1 LEU A 215 29.780 0.532 7.198 1.00 0.00 ATOM 1705 CD2 LEU A 215 32.135 -0.139 7.466 1.00 0.00 ATOM 1706 O LEU A 215 31.235 -0.971 2.295 1.00 0.00 ATOM 1707 C LEU A 215 32.082 -1.293 3.136 1.00 0.00 ATOM 1708 N PRO A 216 32.824 -2.392 3.031 1.00 0.00 ATOM 1709 CA PRO A 216 32.708 -3.251 1.858 1.00 0.00 ATOM 1710 CB PRO A 216 33.562 -3.140 0.920 1.00 0.00 ATOM 1711 CG PRO A 216 34.466 -2.017 1.230 1.00 0.00 ATOM 1712 CD PRO A 216 33.689 -1.090 2.054 1.00 0.00 ATOM 1713 O PRO A 216 32.765 -5.248 3.174 1.00 0.00 ATOM 1714 C PRO A 216 32.287 -4.667 2.197 1.00 0.00 ATOM 1715 N ALA A 217 31.355 -5.196 1.404 1.00 0.00 ATOM 1716 CA ALA A 217 30.810 -6.551 1.560 1.00 0.00 ATOM 1717 CB ALA A 217 29.300 -6.498 1.736 1.00 0.00 ATOM 1718 O ALA A 217 31.169 -6.942 -0.780 1.00 0.00 ATOM 1719 C ALA A 217 31.104 -7.429 0.344 1.00 0.00 ATOM 1720 N GLN A 218 31.252 -8.728 0.596 1.00 0.00 ATOM 1721 CA GLN A 218 31.428 -9.735 -0.449 1.00 0.00 ATOM 1722 CB GLN A 218 32.871 -10.229 -0.475 1.00 0.00 ATOM 1723 CG GLN A 218 33.817 -9.325 -1.248 1.00 0.00 ATOM 1724 CD GLN A 218 35.263 -9.751 -1.108 1.00 0.00 ATOM 1725 OE1 GLN A 218 35.876 -9.561 -0.057 1.00 0.00 ATOM 1726 NE2 GLN A 218 35.814 -10.340 -2.162 1.00 0.00 ATOM 1727 O GLN A 218 30.442 -11.488 0.899 1.00 0.00 ATOM 1728 C GLN A 218 30.387 -10.819 -0.140 1.00 0.00 ATOM 1729 N PRO A 219 29.173 -10.962 -0.904 1.00 0.00 ATOM 1730 CA PRO A 219 28.183 -12.014 -0.743 1.00 0.00 ATOM 1731 CB PRO A 219 28.667 -13.141 -1.591 1.00 0.00 ATOM 1732 CG PRO A 219 30.155 -12.951 -1.612 1.00 0.00 ATOM 1733 CD PRO A 219 30.281 -11.459 -1.800 1.00 0.00 ATOM 1734 O PRO A 219 27.203 -12.994 1.220 1.00 0.00 ATOM 1735 C PRO A 219 27.476 -11.962 0.598 1.00 0.00 ATOM 1736 N GLY A 220 27.175 -10.747 1.045 1.00 0.00 ATOM 1737 CA GLY A 220 26.445 -10.565 2.287 1.00 0.00 ATOM 1738 O GLY A 220 26.780 -10.318 4.636 1.00 0.00 ATOM 1739 C GLY A 220 27.300 -10.514 3.537 1.00 0.00 ATOM 1740 N ARG A 221 28.596 -10.720 3.374 1.00 0.00 ATOM 1741 CA ARG A 221 29.491 -10.680 4.526 1.00 0.00 ATOM 1742 CB ARG A 221 30.504 -11.823 4.429 1.00 0.00 ATOM 1743 CG ARG A 221 31.427 -11.938 5.631 1.00 0.00 ATOM 1744 CD ARG A 221 32.380 -13.113 5.485 1.00 0.00 ATOM 1745 NE ARG A 221 33.246 -13.265 6.653 1.00 0.00 ATOM 1746 CZ ARG A 221 34.282 -14.094 6.711 1.00 0.00 ATOM 1747 NH1 ARG A 221 35.012 -14.165 7.816 1.00 0.00 ATOM 1748 NH2 ARG A 221 34.586 -14.851 5.667 1.00 0.00 ATOM 1749 O ARG A 221 30.877 -8.941 3.631 1.00 0.00 ATOM 1750 C ARG A 221 30.276 -9.371 4.613 1.00 0.00 ATOM 1751 N MET A 222 30.266 -8.698 5.785 1.00 0.00 ATOM 1752 CA MET A 222 31.004 -7.426 5.913 1.00 0.00 ATOM 1753 CB MET A 222 30.591 -6.693 7.192 1.00 0.00 ATOM 1754 CG MET A 222 31.284 -5.355 7.390 1.00 0.00 ATOM 1755 SD MET A 222 30.872 -4.159 6.107 1.00 0.00 ATOM 1756 CE MET A 222 29.141 -3.864 6.463 1.00 0.00 ATOM 1757 O MET A 222 32.964 -8.418 6.872 1.00 0.00 ATOM 1758 C MET A 222 32.500 -7.729 5.965 1.00 0.00 ATOM 1759 N MET A 223 33.230 -7.233 4.971 1.00 0.00 ATOM 1760 CA MET A 223 34.664 -7.531 4.881 1.00 0.00 ATOM 1761 CB MET A 223 34.996 -8.167 3.530 1.00 0.00 ATOM 1762 CG MET A 223 34.358 -9.529 3.311 1.00 0.00 ATOM 1763 SD MET A 223 34.893 -10.752 4.525 1.00 0.00 ATOM 1764 CE MET A 223 36.608 -10.970 4.052 1.00 0.00 ATOM 1765 O MET A 223 36.792 -6.575 5.290 1.00 0.00 ATOM 1766 C MET A 223 35.618 -6.362 5.009 1.00 0.00 ATOM 1767 N THR A 224 35.184 -5.139 4.790 1.00 0.00 ATOM 1768 CA THR A 224 36.098 -3.990 4.906 1.00 0.00 ATOM 1769 CB THR A 224 35.424 -2.685 4.447 1.00 0.00 ATOM 1770 CG2 THR A 224 36.378 -1.509 4.604 1.00 0.00 ATOM 1771 OG1 THR A 224 35.049 -2.796 3.069 1.00 0.00 ATOM 1772 O THR A 224 37.630 -3.279 6.627 1.00 0.00 ATOM 1773 C THR A 224 36.545 -3.802 6.358 1.00 0.00 ATOM 1774 N VAL A 225 35.718 -4.168 7.326 1.00 0.00 ATOM 1775 CA VAL A 225 36.040 -3.924 8.737 1.00 0.00 ATOM 1776 CB VAL A 225 35.134 -2.800 9.331 1.00 0.00 ATOM 1777 CG1 VAL A 225 35.663 -2.350 10.690 1.00 0.00 ATOM 1778 CG2 VAL A 225 35.028 -1.621 8.375 1.00 0.00 ATOM 1779 O VAL A 225 34.865 -5.919 9.378 1.00 0.00 ATOM 1780 C VAL A 225 35.836 -5.188 9.582 1.00 0.00 ATOM 1781 N ASP A 226 36.735 -5.475 10.522 1.00 0.00 ATOM 1782 CA ASP A 226 36.596 -6.634 11.371 1.00 0.00 ATOM 1783 CB ASP A 226 37.949 -7.163 11.869 1.00 0.00 ATOM 1784 CG ASP A 226 38.671 -6.194 12.787 1.00 0.00 ATOM 1785 OD1 ASP A 226 38.084 -5.119 13.099 1.00 0.00 ATOM 1786 OD2 ASP A 226 39.825 -6.425 13.227 1.00 0.00 ATOM 1787 O ASP A 226 35.509 -7.264 13.413 1.00 0.00 ATOM 1788 C ASP A 226 35.637 -6.405 12.551 1.00 0.00 ATOM 1789 N GLY A 227 34.999 -5.242 12.548 1.00 0.00 ATOM 1790 CA GLY A 227 34.012 -4.897 13.567 1.00 0.00 ATOM 1791 O GLY A 227 33.890 -3.657 15.584 1.00 0.00 ATOM 1792 C GLY A 227 34.621 -4.143 14.738 1.00 0.00 ATOM 1793 N ARG A 228 35.728 -2.144 14.208 1.00 0.00 ATOM 1794 CA ARG A 228 35.401 -1.609 15.520 1.00 0.00 ATOM 1795 CB ARG A 228 35.677 -2.648 16.607 1.00 0.00 ATOM 1796 CG ARG A 228 35.327 -2.187 18.012 1.00 0.00 ATOM 1797 CD ARG A 228 35.516 -3.304 19.025 1.00 0.00 ATOM 1798 NE ARG A 228 35.224 -2.864 20.386 1.00 0.00 ATOM 1799 CZ ARG A 228 35.359 -3.630 21.465 1.00 0.00 ATOM 1800 NH1 ARG A 228 35.069 -3.145 22.664 1.00 0.00 ATOM 1801 NH2 ARG A 228 35.784 -4.880 21.342 1.00 0.00 ATOM 1802 O ARG A 228 35.762 0.607 16.410 1.00 0.00 ATOM 1803 C ARG A 228 36.244 -0.358 15.822 1.00 0.00 ATOM 1804 N ASP A 229 37.523 -0.379 15.450 1.00 0.00 ATOM 1805 CA ASP A 229 38.362 0.797 15.726 1.00 0.00 ATOM 1806 CB ASP A 229 39.808 0.535 15.299 1.00 0.00 ATOM 1807 CG ASP A 229 40.524 -0.426 16.228 1.00 0.00 ATOM 1808 OD1 ASP A 229 39.990 -0.704 17.322 1.00 0.00 ATOM 1809 OD2 ASP A 229 41.619 -0.901 15.860 1.00 0.00 ATOM 1810 O ASP A 229 37.797 3.131 15.540 1.00 0.00 ATOM 1811 C ASP A 229 37.872 2.026 14.976 1.00 0.00 ATOM 1812 N MET A 230 37.546 1.841 13.698 1.00 0.00 ATOM 1813 CA MET A 230 37.072 2.941 12.869 1.00 0.00 ATOM 1814 CB MET A 230 36.842 2.468 11.433 1.00 0.00 ATOM 1815 CG MET A 230 38.118 2.127 10.680 1.00 0.00 ATOM 1816 SD MET A 230 37.802 1.540 9.005 1.00 0.00 ATOM 1817 CE MET A 230 39.465 1.153 8.463 1.00 0.00 ATOM 1818 O MET A 230 35.619 4.701 13.634 1.00 0.00 ATOM 1819 C MET A 230 35.751 3.504 13.401 1.00 0.00 ATOM 1820 N GLY A 231 34.764 2.637 13.597 1.00 0.00 ATOM 1821 CA GLY A 231 33.495 3.137 14.095 1.00 0.00 ATOM 1822 O GLY A 231 32.916 4.669 15.846 1.00 0.00 ATOM 1823 C GLY A 231 33.599 3.700 15.498 1.00 0.00 ATOM 1824 N GLU A 232 34.511 3.071 16.358 1.00 0.00 ATOM 1825 CA GLU A 232 34.683 3.475 17.745 1.00 0.00 ATOM 1826 CB GLU A 232 35.719 2.588 18.437 1.00 0.00 ATOM 1827 CG GLU A 232 35.918 2.899 19.912 1.00 0.00 ATOM 1828 CD GLU A 232 36.907 1.964 20.578 1.00 0.00 ATOM 1829 OE1 GLU A 232 37.424 1.058 19.888 1.00 0.00 ATOM 1830 OE2 GLU A 232 37.168 2.134 21.787 1.00 0.00 ATOM 1831 O GLU A 232 34.747 5.585 18.874 1.00 0.00 ATOM 1832 C GLU A 232 35.155 4.902 17.924 1.00 0.00 ATOM 1833 N HIS A 233 36.013 5.353 17.018 1.00 0.00 ATOM 1834 CA HIS A 233 36.513 6.724 17.100 1.00 0.00 ATOM 1835 CB HIS A 233 37.497 7.006 15.962 1.00 0.00 ATOM 1836 CG HIS A 233 38.812 6.306 16.113 1.00 0.00 ATOM 1837 CD2 HIS A 233 39.450 5.506 17.148 1.00 0.00 ATOM 1838 ND1 HIS A 233 39.777 6.316 15.129 1.00 0.00 ATOM 1839 CE1 HIS A 233 40.840 5.605 15.552 1.00 0.00 ATOM 1840 NE2 HIS A 233 40.650 5.119 16.762 1.00 0.00 ATOM 1841 O HIS A 233 35.576 8.914 17.400 1.00 0.00 ATOM 1842 C HIS A 233 35.402 7.752 17.005 1.00 0.00 ATOM 1843 N ALA A 234 34.246 7.326 16.485 1.00 0.00 ATOM 1844 CA ALA A 234 33.126 8.229 16.283 1.00 0.00 ATOM 1845 CB ALA A 234 32.653 8.171 14.838 1.00 0.00 ATOM 1846 O ALA A 234 31.021 8.796 17.213 1.00 0.00 ATOM 1847 C ALA A 234 31.909 7.947 17.128 1.00 0.00 ATOM 1848 N GLY A 235 31.880 6.775 17.750 1.00 0.00 ATOM 1849 CA GLY A 235 30.734 6.388 18.555 1.00 0.00 ATOM 1850 O GLY A 235 28.448 5.849 18.034 1.00 0.00 ATOM 1851 C GLY A 235 29.627 5.877 17.644 1.00 0.00 ATOM 1852 N LEU A 236 30.202 5.548 16.611 1.00 0.00 ATOM 1853 CA LEU A 236 29.227 5.000 15.655 1.00 0.00 ATOM 1854 CB LEU A 236 29.928 4.572 14.364 1.00 0.00 ATOM 1855 CG LEU A 236 30.526 5.693 13.512 1.00 0.00 ATOM 1856 CD1 LEU A 236 31.303 5.120 12.335 1.00 0.00 ATOM 1857 CD2 LEU A 236 29.432 6.596 12.965 1.00 0.00 ATOM 1858 O LEU A 236 29.133 2.972 16.944 1.00 0.00 ATOM 1859 C LEU A 236 28.513 3.774 16.244 1.00 0.00 ATOM 1860 N MET A 237 27.269 3.921 15.571 1.00 0.00 ATOM 1861 CA MET A 237 26.500 2.737 15.956 1.00 0.00 ATOM 1862 CB MET A 237 27.393 1.494 15.950 1.00 0.00 ATOM 1863 CG MET A 237 27.963 1.146 14.585 1.00 0.00 ATOM 1864 SD MET A 237 26.685 0.839 13.352 1.00 0.00 ATOM 1865 CE MET A 237 26.019 -0.717 13.936 1.00 0.00 ATOM 1866 O MET A 237 25.283 1.599 17.650 1.00 0.00 ATOM 1867 C MET A 237 25.820 2.663 17.299 1.00 0.00 ATOM 1868 N TYR A 238 25.842 3.732 18.080 1.00 0.00 ATOM 1869 CA TYR A 238 25.165 3.635 19.372 1.00 0.00 ATOM 1870 CB TYR A 238 25.747 4.651 20.358 1.00 0.00 ATOM 1871 CG TYR A 238 25.100 4.620 21.723 1.00 0.00 ATOM 1872 CD1 TYR A 238 25.383 3.597 22.621 1.00 0.00 ATOM 1873 CD2 TYR A 238 24.209 5.611 22.111 1.00 0.00 ATOM 1874 CE1 TYR A 238 24.796 3.561 23.871 1.00 0.00 ATOM 1875 CE2 TYR A 238 23.613 5.590 23.357 1.00 0.00 ATOM 1876 CZ TYR A 238 23.914 4.553 24.239 1.00 0.00 ATOM 1877 OH TYR A 238 23.328 4.519 25.483 1.00 0.00 ATOM 1878 O TYR A 238 23.270 4.772 18.446 1.00 0.00 ATOM 1879 C TYR A 238 23.679 3.908 19.231 1.00 0.00 ATOM 1880 N TYR A 239 22.884 3.179 20.007 1.00 0.00 ATOM 1881 CA TYR A 239 21.438 3.400 19.994 1.00 0.00 ATOM 1882 CB TYR A 239 20.763 2.469 18.984 1.00 0.00 ATOM 1883 CG TYR A 239 20.868 1.003 19.338 1.00 0.00 ATOM 1884 CD1 TYR A 239 19.861 0.370 20.055 1.00 0.00 ATOM 1885 CD2 TYR A 239 21.974 0.256 18.954 1.00 0.00 ATOM 1886 CE1 TYR A 239 19.948 -0.970 20.382 1.00 0.00 ATOM 1887 CE2 TYR A 239 22.080 -1.084 19.273 1.00 0.00 ATOM 1888 CZ TYR A 239 21.054 -1.694 19.993 1.00 0.00 ATOM 1889 OH TYR A 239 21.144 -3.029 20.318 1.00 0.00 ATOM 1890 O TYR A 239 21.485 2.586 22.251 1.00 0.00 ATOM 1891 C TYR A 239 20.833 3.132 21.370 1.00 0.00 ATOM 1892 N THR A 240 19.562 3.518 21.508 1.00 0.00 ATOM 1893 CA THR A 240 18.780 3.354 22.747 1.00 0.00 ATOM 1894 CB THR A 240 18.534 4.706 23.442 1.00 0.00 ATOM 1895 CG2 THR A 240 17.750 4.509 24.730 1.00 0.00 ATOM 1896 OG1 THR A 240 19.791 5.321 23.755 1.00 0.00 ATOM 1897 O THR A 240 16.729 3.321 21.493 1.00 0.00 ATOM 1898 C THR A 240 17.457 2.726 22.292 1.00 0.00 ATOM 1899 N ILE A 241 17.186 1.494 22.735 1.00 0.00 ATOM 1900 CA ILE A 241 15.963 0.803 22.309 1.00 0.00 ATOM 1901 CB ILE A 241 16.244 -0.301 21.267 1.00 0.00 ATOM 1902 CG1 ILE A 241 14.935 -0.877 20.704 1.00 0.00 ATOM 1903 CG2 ILE A 241 17.101 -1.417 21.863 1.00 0.00 ATOM 1904 CD1 ILE A 241 15.141 -1.650 19.414 1.00 0.00 ATOM 1905 O ILE A 241 15.556 -0.475 24.280 1.00 0.00 ATOM 1906 C ILE A 241 15.086 0.232 23.398 1.00 0.00 ATOM 1907 N GLY A 242 13.698 0.491 23.375 1.00 0.00 ATOM 1908 CA GLY A 242 12.749 -0.191 24.275 1.00 0.00 ATOM 1909 O GLY A 242 11.959 -1.288 22.242 1.00 0.00 ATOM 1910 C GLY A 242 12.393 -1.423 23.411 1.00 0.00 ATOM 1911 N GLN A 243 12.584 -2.615 23.970 1.00 0.00 ATOM 1912 CA GLN A 243 12.358 -3.847 23.231 1.00 0.00 ATOM 1913 CB GLN A 243 13.626 -4.704 23.218 1.00 0.00 ATOM 1914 CG GLN A 243 13.489 -6.002 22.439 1.00 0.00 ATOM 1915 CD GLN A 243 14.772 -6.811 22.424 1.00 0.00 ATOM 1916 OE1 GLN A 243 15.723 -6.498 23.142 1.00 0.00 ATOM 1917 NE2 GLN A 243 14.802 -7.855 21.606 1.00 0.00 ATOM 1918 O GLN A 243 11.294 -5.040 25.063 1.00 0.00 ATOM 1919 C GLN A 243 11.239 -4.660 23.863 1.00 0.00 ATOM 1920 N ARG A 244 10.228 -4.961 23.041 1.00 0.00 ATOM 1921 CA ARG A 244 9.123 -5.837 23.446 1.00 0.00 ATOM 1922 CB ARG A 244 8.129 -6.011 22.295 1.00 0.00 ATOM 1923 CG ARG A 244 7.314 -4.767 21.985 1.00 0.00 ATOM 1924 CD ARG A 244 6.384 -4.997 20.805 1.00 0.00 ATOM 1925 NE ARG A 244 5.628 -3.794 20.461 1.00 0.00 ATOM 1926 CZ ARG A 244 4.788 -3.708 19.436 1.00 0.00 ATOM 1927 NH1 ARG A 244 4.144 -2.573 19.200 1.00 0.00 ATOM 1928 NH2 ARG A 244 4.592 -4.756 18.648 1.00 0.00 ATOM 1929 O ARG A 244 9.154 -7.785 24.828 1.00 0.00 ATOM 1930 C ARG A 244 9.604 -7.220 23.842 1.00 0.00 ATOM 1931 N GLY A 245 10.496 -7.822 23.057 1.00 0.00 ATOM 1932 CA GLY A 245 10.912 -9.167 23.389 1.00 0.00 ATOM 1933 O GLY A 245 11.518 -10.090 25.524 1.00 0.00 ATOM 1934 C GLY A 245 11.692 -9.185 24.712 1.00 0.00 ATOM 1935 N GLY A 246 12.541 -8.183 24.932 1.00 0.00 ATOM 1936 CA GLY A 246 13.336 -8.137 26.164 1.00 0.00 ATOM 1937 O GLY A 246 12.926 -8.333 28.506 1.00 0.00 ATOM 1938 C GLY A 246 12.489 -7.969 27.418 1.00 0.00 ATOM 1939 N LEU A 247 11.290 -7.414 27.281 1.00 0.00 ATOM 1940 CA LEU A 247 10.391 -7.199 28.423 1.00 0.00 ATOM 1941 CB LEU A 247 10.352 -5.719 28.813 1.00 0.00 ATOM 1942 CG LEU A 247 11.615 -5.240 29.522 1.00 0.00 ATOM 1943 CD1 LEU A 247 11.576 -3.750 29.694 1.00 0.00 ATOM 1944 CD2 LEU A 247 11.826 -5.921 30.892 1.00 0.00 ATOM 1945 O LEU A 247 8.171 -7.746 29.199 1.00 0.00 ATOM 1946 C LEU A 247 8.972 -7.740 28.237 1.00 0.00 ATOM 1947 N GLY A 248 8.665 -8.179 27.020 1.00 0.00 ATOM 1948 CA GLY A 248 7.375 -8.782 26.716 1.00 0.00 ATOM 1949 O GLY A 248 5.045 -8.249 26.579 1.00 0.00 ATOM 1950 C GLY A 248 6.209 -7.818 26.585 1.00 0.00 ATOM 1951 N ILE A 249 6.514 -6.527 26.461 1.00 0.00 ATOM 1952 CA ILE A 249 5.497 -5.486 26.344 1.00 0.00 ATOM 1953 CB ILE A 249 5.526 -4.524 27.546 1.00 0.00 ATOM 1954 CG1 ILE A 249 5.263 -5.310 28.848 1.00 0.00 ATOM 1955 CG2 ILE A 249 4.468 -3.441 27.354 1.00 0.00 ATOM 1956 CD1 ILE A 249 5.365 -4.468 30.106 1.00 0.00 ATOM 1957 O ILE A 249 6.958 -4.446 24.766 1.00 0.00 ATOM 1958 C ILE A 249 5.801 -4.571 25.180 1.00 0.00 ATOM 1959 N GLY A 250 8.448 -4.916 26.411 1.00 0.00 ATOM 1960 CA GLY A 250 9.128 -4.933 27.687 1.00 0.00 ATOM 1961 O GLY A 250 10.212 -4.561 29.786 1.00 0.00 ATOM 1962 C GLY A 250 10.330 -4.624 28.568 1.00 0.00 ATOM 1963 N GLY A 251 11.488 -4.458 27.929 1.00 0.00 ATOM 1964 CA GLY A 251 12.725 -4.063 28.618 1.00 0.00 ATOM 1965 O GLY A 251 12.915 -2.619 26.686 1.00 0.00 ATOM 1966 C GLY A 251 13.353 -2.930 27.795 1.00 0.00 ATOM 1967 N GLN A 252 14.373 -2.292 28.351 1.00 0.00 ATOM 1968 CA GLN A 252 15.041 -1.181 27.683 1.00 0.00 ATOM 1969 CB GLN A 252 14.763 0.132 28.418 1.00 0.00 ATOM 1970 CG GLN A 252 13.300 0.547 28.412 1.00 0.00 ATOM 1971 CD GLN A 252 13.067 1.869 29.119 1.00 0.00 ATOM 1972 OE1 GLN A 252 14.004 2.487 29.623 1.00 0.00 ATOM 1973 NE2 GLN A 252 11.813 2.305 29.157 1.00 0.00 ATOM 1974 O GLN A 252 17.094 -1.889 28.650 1.00 0.00 ATOM 1975 C GLN A 252 16.536 -1.422 27.664 1.00 0.00 ATOM 1976 N HIS A 253 17.185 -1.114 26.550 1.00 0.00 ATOM 1977 CA HIS A 253 18.627 -1.265 26.520 1.00 0.00 ATOM 1978 CB HIS A 253 19.013 -2.619 25.920 1.00 0.00 ATOM 1979 CG HIS A 253 18.501 -3.790 26.699 1.00 0.00 ATOM 1980 CD2 HIS A 253 17.406 -4.738 26.550 1.00 0.00 ATOM 1981 ND1 HIS A 253 19.090 -4.222 27.868 1.00 0.00 ATOM 1982 CE1 HIS A 253 18.414 -5.286 28.332 1.00 0.00 ATOM 1983 NE2 HIS A 253 17.402 -5.602 27.546 1.00 0.00 ATOM 1984 O HIS A 253 18.927 -0.001 24.500 1.00 0.00 ATOM 1985 C HIS A 253 19.409 -0.364 25.582 1.00 0.00 ATOM 1986 N GLY A 254 20.664 0.010 26.068 1.00 0.00 ATOM 1987 CA GLY A 254 21.484 0.875 25.243 1.00 0.00 ATOM 1988 O GLY A 254 22.988 -1.010 25.209 1.00 0.00 ATOM 1989 C GLY A 254 22.459 -0.070 24.570 1.00 0.00 ATOM 1990 N GLY A 255 22.682 0.152 23.275 1.00 0.00 ATOM 1991 CA GLY A 255 23.567 -0.724 22.538 1.00 0.00 ATOM 1992 O GLY A 255 24.606 0.982 21.251 1.00 0.00 ATOM 1993 C GLY A 255 24.711 -0.124 21.749 1.00 0.00 ATOM 1994 N ASP A 256 25.797 -0.899 21.643 1.00 0.00 ATOM 1995 CA ASP A 256 26.983 -0.516 20.868 1.00 0.00 ATOM 1996 CB ASP A 256 28.176 -0.275 21.795 1.00 0.00 ATOM 1997 CG ASP A 256 27.974 0.920 22.705 1.00 0.00 ATOM 1998 OD1 ASP A 256 27.821 2.046 22.182 1.00 0.00 ATOM 1999 OD2 ASP A 256 27.969 0.735 23.939 1.00 0.00 ATOM 2000 O ASP A 256 28.028 -2.591 20.497 1.00 0.00 ATOM 2001 C ASP A 256 27.520 -1.603 19.985 1.00 0.00 ATOM 2002 N ASN A 257 27.280 -1.503 18.880 1.00 0.00 ATOM 2003 CA ASN A 257 27.801 -2.522 17.964 1.00 0.00 ATOM 2004 CB ASN A 257 26.697 -3.424 17.555 1.00 0.00 ATOM 2005 CG ASN A 257 26.210 -4.185 18.778 1.00 0.00 ATOM 2006 ND2 ASN A 257 24.890 -4.269 18.938 1.00 0.00 ATOM 2007 OD1 ASN A 257 27.012 -4.688 19.574 1.00 0.00 ATOM 2008 O ASN A 257 27.764 -1.746 15.679 1.00 0.00 ATOM 2009 C ASN A 257 28.338 -1.739 16.767 1.00 0.00 ATOM 2010 N ALA A 258 29.497 -1.089 16.930 1.00 0.00 ATOM 2011 CA ALA A 258 30.043 -0.288 15.823 1.00 0.00 ATOM 2012 CB ALA A 258 31.359 0.354 16.232 1.00 0.00 ATOM 2013 O ALA A 258 30.058 -0.451 13.423 1.00 0.00 ATOM 2014 C ALA A 258 30.363 -0.983 14.502 1.00 0.00 ATOM 2015 N PRO A 259 30.971 -2.158 14.602 1.00 0.00 ATOM 2016 CA PRO A 259 31.358 -2.927 13.426 1.00 0.00 ATOM 2017 CB PRO A 259 32.257 -4.032 13.986 1.00 0.00 ATOM 2018 CG PRO A 259 31.898 -4.109 15.431 1.00 0.00 ATOM 2019 CD PRO A 259 31.455 -2.728 15.826 1.00 0.00 ATOM 2020 O PRO A 259 29.988 -3.580 11.532 1.00 0.00 ATOM 2021 C PRO A 259 30.102 -3.538 12.780 1.00 0.00 ATOM 2022 N TRP A 260 28.360 -4.231 13.930 1.00 0.00 ATOM 2023 CA TRP A 260 27.079 -4.730 13.394 1.00 0.00 ATOM 2024 CB TRP A 260 25.937 -4.594 14.570 1.00 0.00 ATOM 2025 CG TRP A 260 24.824 -5.607 14.749 1.00 0.00 ATOM 2026 CD1 TRP A 260 24.358 -6.507 13.829 1.00 0.00 ATOM 2027 CD2 TRP A 260 24.036 -5.800 15.932 1.00 0.00 ATOM 2028 CE2 TRP A 260 23.110 -6.835 15.659 1.00 0.00 ATOM 2029 CE3 TRP A 260 24.024 -5.200 17.201 1.00 0.00 ATOM 2030 NE1 TRP A 260 23.327 -7.246 14.368 1.00 0.00 ATOM 2031 CZ2 TRP A 260 22.184 -7.288 16.607 1.00 0.00 ATOM 2032 CZ3 TRP A 260 23.104 -5.653 18.148 1.00 0.00 ATOM 2033 CH2 TRP A 260 22.196 -6.687 17.840 1.00 0.00 ATOM 2034 O TRP A 260 25.775 -3.882 11.562 1.00 0.00 ATOM 2035 C TRP A 260 26.288 -3.642 12.666 1.00 0.00 ATOM 2036 N PHE A 261 26.155 -2.451 13.246 1.00 0.00 ATOM 2037 CA PHE A 261 25.404 -1.381 12.618 1.00 0.00 ATOM 2038 CB PHE A 261 24.005 -1.383 13.249 1.00 0.00 ATOM 2039 CG PHE A 261 23.041 -0.404 12.658 1.00 0.00 ATOM 2040 CD1 PHE A 261 22.857 -0.269 11.270 1.00 0.00 ATOM 2041 CD2 PHE A 261 22.247 0.374 13.514 1.00 0.00 ATOM 2042 CE1 PHE A 261 21.915 0.635 10.760 1.00 0.00 ATOM 2043 CE2 PHE A 261 21.316 1.263 13.013 1.00 0.00 ATOM 2044 CZ PHE A 261 21.140 1.395 11.609 1.00 0.00 ATOM 2045 O PHE A 261 26.605 0.199 13.964 1.00 0.00 ATOM 2046 C PHE A 261 26.049 -0.045 12.899 1.00 0.00 ATOM 2047 N VAL A 262 25.910 0.814 11.984 1.00 0.00 ATOM 2048 CA VAL A 262 26.413 2.150 12.164 1.00 0.00 ATOM 2049 CB VAL A 262 27.652 2.336 11.269 1.00 0.00 ATOM 2050 CG1 VAL A 262 28.231 3.731 11.445 1.00 0.00 ATOM 2051 CG2 VAL A 262 28.727 1.321 11.629 1.00 0.00 ATOM 2052 O VAL A 262 24.864 3.194 10.635 1.00 0.00 ATOM 2053 C VAL A 262 25.331 3.155 11.780 1.00 0.00 ATOM 2054 N VAL A 263 24.906 3.956 12.753 1.00 0.00 ATOM 2055 CA VAL A 263 23.869 4.938 12.516 1.00 0.00 ATOM 2056 CB VAL A 263 23.418 5.609 13.826 1.00 0.00 ATOM 2057 CG1 VAL A 263 22.411 6.713 13.541 1.00 0.00 ATOM 2058 CG2 VAL A 263 22.764 4.591 14.750 1.00 0.00 ATOM 2059 O VAL A 263 25.738 6.283 11.829 1.00 0.00 ATOM 2060 C VAL A 263 24.590 5.903 11.575 1.00 0.00 ATOM 2061 N GLY A 264 23.946 6.257 10.469 1.00 0.00 ATOM 2062 CA GLY A 264 24.566 7.163 9.517 1.00 0.00 ATOM 2063 O GLY A 264 25.641 7.083 7.385 1.00 0.00 ATOM 2064 C GLY A 264 25.272 6.452 8.374 1.00 0.00 ATOM 2065 N LYS A 265 25.472 5.145 8.515 1.00 0.00 ATOM 2066 CA LYS A 265 26.132 4.343 7.482 1.00 0.00 ATOM 2067 CB LYS A 265 27.388 3.672 8.042 1.00 0.00 ATOM 2068 CG LYS A 265 28.470 4.648 8.476 1.00 0.00 ATOM 2069 CD LYS A 265 29.707 3.915 8.968 1.00 0.00 ATOM 2070 CE LYS A 265 30.755 4.887 9.486 1.00 0.00 ATOM 2071 NZ LYS A 265 31.966 4.182 9.989 1.00 0.00 ATOM 2072 O LYS A 265 25.063 3.024 5.782 1.00 0.00 ATOM 2073 C LYS A 265 25.174 3.267 6.988 1.00 0.00 ATOM 2074 N ASP A 266 25.984 -0.596 6.099 1.00 0.00 ATOM 2075 CA ASP A 266 26.536 -0.868 4.774 1.00 0.00 ATOM 2076 CB ASP A 266 28.017 -1.234 4.876 1.00 0.00 ATOM 2077 CG ASP A 266 28.670 -1.407 3.518 1.00 0.00 ATOM 2078 OD1 ASP A 266 28.710 -0.422 2.750 1.00 0.00 ATOM 2079 OD2 ASP A 266 29.140 -2.525 3.223 1.00 0.00 ATOM 2080 O ASP A 266 25.509 -1.946 2.894 1.00 0.00 ATOM 2081 C ASP A 266 25.818 -2.029 4.078 1.00 0.00 ATOM 2082 N LEU A 267 25.520 -3.098 4.825 1.00 0.00 ATOM 2083 CA LEU A 267 24.841 -4.258 4.269 1.00 0.00 ATOM 2084 CB LEU A 267 24.652 -5.333 5.340 1.00 0.00 ATOM 2085 CG LEU A 267 25.918 -6.049 5.814 1.00 0.00 ATOM 2086 CD1 LEU A 267 25.615 -6.946 7.003 1.00 0.00 ATOM 2087 CD2 LEU A 267 26.494 -6.912 4.702 1.00 0.00 ATOM 2088 O LEU A 267 23.130 -4.184 2.584 1.00 0.00 ATOM 2089 C LEU A 267 23.465 -3.847 3.731 1.00 0.00 ATOM 2090 N SER A 268 22.683 -3.110 4.526 1.00 0.00 ATOM 2091 CA SER A 268 21.364 -2.711 4.025 1.00 0.00 ATOM 2092 CB SER A 268 20.560 -2.017 5.128 1.00 0.00 ATOM 2093 OG SER A 268 21.157 -0.786 5.496 1.00 0.00 ATOM 2094 O SER A 268 20.583 -1.815 1.964 1.00 0.00 ATOM 2095 C SER A 268 21.429 -1.746 2.853 1.00 0.00 ATOM 2096 N LYS A 269 22.410 -0.842 2.819 1.00 0.00 ATOM 2097 CA LYS A 269 22.479 0.044 1.673 1.00 0.00 ATOM 2098 CB LYS A 269 23.614 1.056 1.845 1.00 0.00 ATOM 2099 CG LYS A 269 23.721 2.066 0.716 1.00 0.00 ATOM 2100 CD LYS A 269 22.532 3.013 0.705 1.00 0.00 ATOM 2101 CE LYS A 269 22.704 4.104 -0.337 1.00 0.00 ATOM 2102 NZ LYS A 269 21.549 5.045 -0.353 1.00 0.00 ATOM 2103 O LYS A 269 22.104 -0.568 -0.621 1.00 0.00 ATOM 2104 C LYS A 269 22.735 -0.800 0.408 1.00 0.00 ATOM 2105 N ASN A 270 23.636 -1.775 0.455 1.00 0.00 ATOM 2106 CA ASN A 270 23.890 -2.636 -0.683 1.00 0.00 ATOM 2107 CB ASN A 270 25.019 -3.620 -0.368 1.00 0.00 ATOM 2108 CG ASN A 270 26.380 -2.953 -0.336 1.00 0.00 ATOM 2109 ND2 ASN A 270 27.341 -3.604 0.311 1.00 0.00 ATOM 2110 OD1 ASN A 270 26.564 -1.868 -0.887 1.00 0.00 ATOM 2111 O ASN A 270 22.286 -3.508 -2.217 1.00 0.00 ATOM 2112 C ASN A 270 22.647 -3.441 -1.050 1.00 0.00 ATOM 2113 N ILE A 271 21.918 -3.991 0.006 1.00 0.00 ATOM 2114 CA ILE A 271 20.693 -4.747 -0.220 1.00 0.00 ATOM 2115 CB ILE A 271 20.134 -5.321 1.095 1.00 0.00 ATOM 2116 CG1 ILE A 271 21.072 -6.397 1.648 1.00 0.00 ATOM 2117 CG2 ILE A 271 18.767 -5.947 0.864 1.00 0.00 ATOM 2118 CD1 ILE A 271 20.746 -6.822 3.064 1.00 0.00 ATOM 2119 O ILE A 271 18.968 -4.248 -1.850 1.00 0.00 ATOM 2120 C ILE A 271 19.589 -3.874 -0.842 1.00 0.00 ATOM 2121 N LEU A 272 19.363 -2.710 -0.243 1.00 0.00 ATOM 2122 CA LEU A 272 18.351 -1.779 -0.720 1.00 0.00 ATOM 2123 CB LEU A 272 18.322 -0.524 0.155 1.00 0.00 ATOM 2124 CG LEU A 272 17.290 0.541 -0.222 1.00 0.00 ATOM 2125 CD1 LEU A 272 15.879 -0.018 -0.119 1.00 0.00 ATOM 2126 CD2 LEU A 272 17.395 1.741 0.706 1.00 0.00 ATOM 2127 O LEU A 272 17.750 -1.298 -3.016 1.00 0.00 ATOM 2128 C LEU A 272 18.647 -1.355 -2.167 1.00 0.00 ATOM 2129 N TYR A 273 19.923 -1.106 -2.445 1.00 0.00 ATOM 2130 CA TYR A 273 20.382 -0.720 -3.778 1.00 0.00 ATOM 2131 CB TYR A 273 21.891 -0.465 -3.773 1.00 0.00 ATOM 2132 CG TYR A 273 22.439 -0.003 -5.103 1.00 0.00 ATOM 2133 CD1 TYR A 273 22.246 1.303 -5.536 1.00 0.00 ATOM 2134 CD2 TYR A 273 23.147 -0.872 -5.921 1.00 0.00 ATOM 2135 CE1 TYR A 273 22.744 1.735 -6.751 1.00 0.00 ATOM 2136 CE2 TYR A 273 23.651 -0.458 -7.141 1.00 0.00 ATOM 2137 CZ TYR A 273 23.444 0.857 -7.551 1.00 0.00 ATOM 2138 OH TYR A 273 23.941 1.285 -8.761 1.00 0.00 ATOM 2139 O TYR A 273 19.522 -1.574 -5.873 1.00 0.00 ATOM 2140 C TYR A 273 20.087 -1.826 -4.803 1.00 0.00 ATOM 2141 N VAL A 274 18.838 -4.349 -5.003 1.00 0.00 ATOM 2142 CA VAL A 274 17.665 -5.208 -5.077 1.00 0.00 ATOM 2143 CB VAL A 274 17.415 -5.938 -3.745 1.00 0.00 ATOM 2144 CG1 VAL A 274 18.603 -6.818 -3.389 1.00 0.00 ATOM 2145 CG2 VAL A 274 17.202 -4.937 -2.619 1.00 0.00 ATOM 2146 O VAL A 274 16.092 -3.364 -5.110 1.00 0.00 ATOM 2147 C VAL A 274 16.327 -4.561 -5.393 1.00 0.00 ATOM 2148 N GLY A 275 15.432 -5.368 -5.972 1.00 0.00 ATOM 2149 CA GLY A 275 14.109 -4.855 -6.324 1.00 0.00 ATOM 2150 O GLY A 275 13.535 -5.170 -4.019 1.00 0.00 ATOM 2151 C GLY A 275 13.205 -4.700 -5.108 1.00 0.00 ATOM 2152 N GLN A 276 12.072 -4.013 -5.287 1.00 0.00 ATOM 2153 CA GLN A 276 11.211 -3.727 -4.151 1.00 0.00 ATOM 2154 CB GLN A 276 9.985 -2.927 -4.596 1.00 0.00 ATOM 2155 CG GLN A 276 10.292 -1.495 -5.002 1.00 0.00 ATOM 2156 CD GLN A 276 9.077 -0.768 -5.544 1.00 0.00 ATOM 2157 OE1 GLN A 276 8.010 -1.361 -5.704 1.00 0.00 ATOM 2158 NE2 GLN A 276 9.236 0.520 -5.827 1.00 0.00 ATOM 2159 O GLN A 276 10.674 -4.973 -2.181 1.00 0.00 ATOM 2160 C GLN A 276 10.664 -4.940 -3.414 1.00 0.00 ATOM 2161 N GLY A 277 10.184 -5.941 -4.151 1.00 0.00 ATOM 2162 CA GLY A 277 9.659 -7.145 -3.491 1.00 0.00 ATOM 2163 O GLY A 277 10.460 -8.313 -1.530 1.00 0.00 ATOM 2164 C GLY A 277 10.741 -7.799 -2.633 1.00 0.00 ATOM 2165 N PHE A 278 11.972 -7.804 -3.142 1.00 0.00 ATOM 2166 CA PHE A 278 13.074 -8.438 -2.436 1.00 0.00 ATOM 2167 CB PHE A 278 14.301 -8.548 -3.344 1.00 0.00 ATOM 2168 CG PHE A 278 14.207 -9.652 -4.358 1.00 0.00 ATOM 2169 CD1 PHE A 278 13.873 -9.378 -5.673 1.00 0.00 ATOM 2170 CD2 PHE A 278 14.454 -10.964 -3.997 1.00 0.00 ATOM 2171 CE1 PHE A 278 13.787 -10.394 -6.605 1.00 0.00 ATOM 2172 CE2 PHE A 278 14.369 -11.982 -4.930 1.00 0.00 ATOM 2173 CZ PHE A 278 14.036 -11.701 -6.229 1.00 0.00 ATOM 2174 O PHE A 278 13.731 -8.204 -0.134 1.00 0.00 ATOM 2175 C PHE A 278 13.475 -7.634 -1.195 1.00 0.00 ATOM 2176 N TYR A 279 13.488 -6.393 -1.342 1.00 0.00 ATOM 2177 CA TYR A 279 13.818 -5.560 -0.187 1.00 0.00 ATOM 2178 CB TYR A 279 13.921 -4.090 -0.598 1.00 0.00 ATOM 2179 CG TYR A 279 14.233 -3.155 0.549 1.00 0.00 ATOM 2180 CD1 TYR A 279 15.526 -3.040 1.041 1.00 0.00 ATOM 2181 CD2 TYR A 279 13.232 -2.389 1.134 1.00 0.00 ATOM 2182 CE1 TYR A 279 15.821 -2.186 2.088 1.00 0.00 ATOM 2183 CE2 TYR A 279 13.509 -1.531 2.182 1.00 0.00 ATOM 2184 CZ TYR A 279 14.815 -1.435 2.657 1.00 0.00 ATOM 2185 OH TYR A 279 15.106 -0.585 3.699 1.00 0.00 ATOM 2186 O TYR A 279 13.019 -5.784 2.088 1.00 0.00 ATOM 2187 C TYR A 279 12.726 -5.699 0.886 1.00 0.00 ATOM 2188 N HIS A 280 11.462 -5.763 0.475 1.00 0.00 ATOM 2189 CA HIS A 280 10.428 -5.886 1.467 1.00 0.00 ATOM 2190 CB HIS A 280 9.049 -5.722 0.825 1.00 0.00 ATOM 2191 CG HIS A 280 8.753 -4.324 0.378 1.00 0.00 ATOM 2192 CD2 HIS A 280 9.340 -3.013 0.612 1.00 0.00 ATOM 2193 ND1 HIS A 280 7.706 -4.018 -0.463 1.00 0.00 ATOM 2194 CE1 HIS A 280 7.695 -2.692 -0.685 1.00 0.00 ATOM 2195 NE2 HIS A 280 8.673 -2.083 -0.043 1.00 0.00 ATOM 2196 O HIS A 280 10.212 -7.343 3.356 1.00 0.00 ATOM 2197 C HIS A 280 10.468 -7.253 2.151 1.00 0.00 ATOM 2198 N ASP A 281 10.840 -8.299 1.423 1.00 0.00 ATOM 2199 CA ASP A 281 10.978 -9.615 2.045 1.00 0.00 ATOM 2200 CB ASP A 281 11.336 -10.670 0.995 1.00 0.00 ATOM 2201 CG ASP A 281 10.167 -11.010 0.090 1.00 0.00 ATOM 2202 OD1 ASP A 281 9.028 -10.618 0.418 1.00 0.00 ATOM 2203 OD2 ASP A 281 10.392 -11.672 -0.946 1.00 0.00 ATOM 2204 O ASP A 281 11.947 -10.166 4.172 1.00 0.00 ATOM 2205 C ASP A 281 12.075 -9.583 3.096 1.00 0.00 ATOM 2206 N SER A 282 13.140 -8.919 2.731 1.00 0.00 ATOM 2207 CA SER A 282 14.293 -8.764 3.620 1.00 0.00 ATOM 2208 CB SER A 282 15.416 -8.005 2.912 1.00 0.00 ATOM 2209 OG SER A 282 16.534 -7.834 3.766 1.00 0.00 ATOM 2210 O SER A 282 14.397 -8.281 5.969 1.00 0.00 ATOM 2211 C SER A 282 13.911 -7.988 4.876 1.00 0.00 ATOM 2212 N LEU A 283 13.050 -6.995 4.726 1.00 0.00 ATOM 2213 CA LEU A 283 12.550 -6.178 5.833 1.00 0.00 ATOM 2214 CB LEU A 283 11.861 -4.920 5.300 1.00 0.00 ATOM 2215 CG LEU A 283 12.756 -3.906 4.586 1.00 0.00 ATOM 2216 CD1 LEU A 283 11.926 -2.771 4.007 1.00 0.00 ATOM 2217 CD2 LEU A 283 13.770 -3.311 5.552 1.00 0.00 ATOM 2218 O LEU A 283 11.232 -6.544 7.804 1.00 0.00 ATOM 2219 C LEU A 283 11.554 -6.924 6.693 1.00 0.00 ATOM 2220 N MET A 284 11.058 -7.998 6.144 1.00 0.00 ATOM 2221 CA MET A 284 10.068 -8.767 6.831 1.00 0.00 ATOM 2222 CB MET A 284 9.015 -9.278 5.846 1.00 0.00 ATOM 2223 CG MET A 284 8.125 -8.190 5.268 1.00 0.00 ATOM 2224 SD MET A 284 6.751 -8.852 4.306 1.00 0.00 ATOM 2225 CE MET A 284 7.596 -9.351 2.808 1.00 0.00 ATOM 2226 O MET A 284 10.011 -10.618 8.383 1.00 0.00 ATOM 2227 C MET A 284 10.698 -9.956 7.583 1.00 0.00 ATOM 2228 N SER A 285 11.960 -10.213 7.309 1.00 0.00 ATOM 2229 CA SER A 285 12.695 -11.283 7.990 1.00 0.00 ATOM 2230 CB SER A 285 13.702 -11.865 6.997 1.00 0.00 ATOM 2231 OG SER A 285 14.696 -10.914 6.659 1.00 0.00 ATOM 2232 O SER A 285 13.895 -11.859 9.969 1.00 0.00 ATOM 2233 C SER A 285 13.498 -10.949 9.247 1.00 0.00 ATOM 2234 N THR A 286 13.825 -9.666 9.469 1.00 0.00 ATOM 2235 CA THR A 286 14.650 -9.265 10.605 1.00 0.00 ATOM 2236 CB THR A 286 16.151 -9.363 10.274 1.00 0.00 ATOM 2237 CG2 THR A 286 16.501 -10.763 9.795 1.00 0.00 ATOM 2238 OG1 THR A 286 16.477 -8.424 9.242 1.00 0.00 ATOM 2239 O THR A 286 13.823 -7.046 10.311 1.00 0.00 ATOM 2240 C THR A 286 14.383 -7.850 11.044 1.00 0.00 ATOM 2241 N SER A 287 14.880 -7.498 12.216 1.00 0.00 ATOM 2242 CA SER A 287 14.767 -6.141 12.690 1.00 0.00 ATOM 2243 CB SER A 287 15.320 -6.022 14.112 1.00 0.00 ATOM 2244 OG SER A 287 16.724 -6.215 14.131 1.00 0.00 ATOM 2245 O SER A 287 16.440 -5.714 11.021 1.00 0.00 ATOM 2246 C SER A 287 15.570 -5.238 11.755 1.00 0.00 ATOM 2247 N LEU A 288 15.339 -3.863 11.799 1.00 0.00 ATOM 2248 CA LEU A 288 16.053 -2.930 10.944 1.00 0.00 ATOM 2249 CB LEU A 288 15.665 -1.468 11.170 1.00 0.00 ATOM 2250 CG LEU A 288 16.370 -0.436 10.287 1.00 0.00 ATOM 2251 CD1 LEU A 288 16.053 -0.676 8.819 1.00 0.00 ATOM 2252 CD2 LEU A 288 15.922 0.974 10.645 1.00 0.00 ATOM 2253 O LEU A 288 18.278 -3.302 10.154 1.00 0.00 ATOM 2254 C LEU A 288 17.563 -3.039 11.130 1.00 0.00 ATOM 2255 N GLU A 289 18.044 -2.866 12.369 1.00 0.00 ATOM 2256 CA GLU A 289 19.485 -2.939 12.658 1.00 0.00 ATOM 2257 CB GLU A 289 19.735 -2.825 14.164 1.00 0.00 ATOM 2258 CG GLU A 289 19.473 -1.441 14.734 1.00 0.00 ATOM 2259 CD GLU A 289 19.597 -1.400 16.244 1.00 0.00 ATOM 2260 OE1 GLU A 289 19.806 -2.470 16.853 1.00 0.00 ATOM 2261 OE2 GLU A 289 19.484 -0.297 16.821 1.00 0.00 ATOM 2262 O GLU A 289 21.229 -4.247 11.656 1.00 0.00 ATOM 2263 C GLU A 289 20.137 -4.250 12.224 1.00 0.00 ATOM 2264 N ALA A 290 19.460 -5.357 12.492 1.00 0.00 ATOM 2265 CA ALA A 290 19.986 -6.670 12.131 1.00 0.00 ATOM 2266 CB ALA A 290 19.069 -7.774 12.633 1.00 0.00 ATOM 2267 O ALA A 290 21.164 -7.242 10.133 1.00 0.00 ATOM 2268 C ALA A 290 20.111 -6.832 10.618 1.00 0.00 ATOM 2269 N SER A 291 19.073 -6.511 9.867 1.00 0.00 ATOM 2270 CA SER A 291 19.117 -6.660 8.412 1.00 0.00 ATOM 2271 CB SER A 291 17.736 -6.409 7.805 1.00 0.00 ATOM 2272 OG SER A 291 17.332 -5.064 7.993 1.00 0.00 ATOM 2273 O SER A 291 20.750 -6.005 6.805 1.00 0.00 ATOM 2274 C SER A 291 20.093 -5.673 7.786 1.00 0.00 ATOM 2275 N GLN A 292 20.192 -4.466 8.341 1.00 0.00 ATOM 2276 CA GLN A 292 21.143 -3.479 7.830 1.00 0.00 ATOM 2277 CB GLN A 292 20.910 -2.118 8.493 1.00 0.00 ATOM 2278 CG GLN A 292 19.619 -1.436 8.072 1.00 0.00 ATOM 2279 CD GLN A 292 19.368 -0.147 8.830 1.00 0.00 ATOM 2280 OE1 GLN A 292 20.109 0.197 9.750 1.00 0.00 ATOM 2281 NE2 GLN A 292 18.319 0.570 8.443 1.00 0.00 ATOM 2282 O GLN A 292 23.417 -3.828 7.143 1.00 0.00 ATOM 2283 C GLN A 292 22.562 -3.983 8.015 1.00 0.00 ATOM 2284 N VAL A 293 23.126 -4.917 9.276 1.00 0.00 ATOM 2285 CA VAL A 293 24.441 -5.454 9.562 1.00 0.00 ATOM 2286 CB VAL A 293 25.272 -4.357 10.252 1.00 0.00 ATOM 2287 CG1 VAL A 293 26.656 -4.879 10.605 1.00 0.00 ATOM 2288 CG2 VAL A 293 25.432 -3.153 9.336 1.00 0.00 ATOM 2289 O VAL A 293 23.460 -6.664 11.389 1.00 0.00 ATOM 2290 C VAL A 293 24.313 -6.651 10.497 1.00 0.00 ATOM 2291 N HIS A 294 25.134 -7.671 10.261 1.00 0.00 ATOM 2292 CA HIS A 294 25.125 -8.865 11.095 1.00 0.00 ATOM 2293 CB HIS A 294 25.434 -10.107 10.257 1.00 0.00 ATOM 2294 CG HIS A 294 25.279 -11.395 11.004 1.00 0.00 ATOM 2295 CD2 HIS A 294 24.210 -12.367 11.186 1.00 0.00 ATOM 2296 ND1 HIS A 294 26.291 -11.944 11.759 1.00 0.00 ATOM 2297 CE1 HIS A 294 25.856 -13.093 12.307 1.00 0.00 ATOM 2298 NE2 HIS A 294 24.607 -13.353 11.966 1.00 0.00 ATOM 2299 O HIS A 294 27.206 -8.051 11.926 1.00 0.00 ATOM 2300 C HIS A 294 26.188 -8.689 12.165 1.00 0.00 ATOM 2301 N PHE A 295 25.945 -9.234 13.347 1.00 0.00 ATOM 2302 CA PHE A 295 26.918 -9.104 14.424 1.00 0.00 ATOM 2303 CB PHE A 295 26.653 -7.834 15.234 1.00 0.00 ATOM 2304 CG PHE A 295 27.754 -7.486 16.195 1.00 0.00 ATOM 2305 CD1 PHE A 295 28.969 -7.007 15.734 1.00 0.00 ATOM 2306 CD2 PHE A 295 27.577 -7.638 17.560 1.00 0.00 ATOM 2307 CE1 PHE A 295 29.982 -6.688 16.617 1.00 0.00 ATOM 2308 CE2 PHE A 295 28.590 -7.319 18.442 1.00 0.00 ATOM 2309 CZ PHE A 295 29.789 -6.846 17.977 1.00 0.00 ATOM 2310 O PHE A 295 25.846 -11.006 15.398 1.00 0.00 ATOM 2311 C PHE A 295 26.843 -10.292 15.363 1.00 0.00 ATOM 2312 N THR A 296 20.669 -16.490 17.207 1.00 0.00 ATOM 2313 CA THR A 296 20.141 -17.608 16.482 1.00 0.00 ATOM 2314 CB THR A 296 20.978 -18.879 16.717 1.00 0.00 ATOM 2315 CG2 THR A 296 22.410 -18.669 16.248 1.00 0.00 ATOM 2316 OG1 THR A 296 20.989 -19.197 18.114 1.00 0.00 ATOM 2317 O THR A 296 18.385 -17.537 18.092 1.00 0.00 ATOM 2318 C THR A 296 18.727 -17.848 16.959 1.00 0.00 ATOM 2319 N ARG A 297 17.986 -18.491 16.113 1.00 0.00 ATOM 2320 CA ARG A 297 16.652 -18.909 16.450 1.00 0.00 ATOM 2321 CB ARG A 297 15.826 -17.487 16.189 1.00 0.00 ATOM 2322 CG ARG A 297 16.371 -16.298 17.034 1.00 0.00 ATOM 2323 CD ARG A 297 15.766 -14.918 16.713 1.00 0.00 ATOM 2324 NE ARG A 297 16.676 -14.040 15.951 1.00 0.00 ATOM 2325 CZ ARG A 297 17.913 -13.686 16.333 1.00 0.00 ATOM 2326 NH1 ARG A 297 18.416 -14.123 17.469 1.00 0.00 ATOM 2327 NH2 ARG A 297 18.644 -12.890 15.574 1.00 0.00 ATOM 2328 O ARG A 297 15.510 -20.964 16.466 1.00 0.00 ATOM 2329 C ARG A 297 16.588 -20.409 16.403 1.00 0.00 ATOM 2330 N GLU A 298 17.753 -21.026 16.334 1.00 0.00 ATOM 2331 CA GLU A 298 17.860 -22.450 16.372 1.00 0.00 ATOM 2332 CB GLU A 298 18.948 -22.931 15.410 1.00 0.00 ATOM 2333 CG GLU A 298 18.615 -22.723 13.942 1.00 0.00 ATOM 2334 CD GLU A 298 19.806 -22.963 13.035 1.00 0.00 ATOM 2335 OE1 GLU A 298 20.901 -23.256 13.558 1.00 0.00 ATOM 2336 OE2 GLU A 298 19.644 -22.857 11.801 1.00 0.00 ATOM 2337 O GLU A 298 19.075 -22.276 18.428 1.00 0.00 ATOM 2338 C GLU A 298 18.214 -22.866 17.785 1.00 0.00 ATOM 2339 N MET A 299 13.776 -24.409 14.127 1.00 0.00 ATOM 2340 CA MET A 299 13.482 -24.535 12.698 1.00 0.00 ATOM 2341 CB MET A 299 12.472 -25.657 12.456 1.00 0.00 ATOM 2342 CG MET A 299 13.019 -27.052 12.712 1.00 0.00 ATOM 2343 SD MET A 299 14.407 -27.463 11.637 1.00 0.00 ATOM 2344 CE MET A 299 13.583 -27.582 10.051 1.00 0.00 ATOM 2345 O MET A 299 13.248 -22.965 10.902 1.00 0.00 ATOM 2346 C MET A 299 12.895 -23.303 12.036 1.00 0.00 ATOM 2347 N PRO A 300 11.992 -22.634 12.746 1.00 0.00 ATOM 2348 CA PRO A 300 11.337 -21.456 12.196 1.00 0.00 ATOM 2349 CB PRO A 300 10.259 -21.117 13.227 1.00 0.00 ATOM 2350 CG PRO A 300 10.744 -21.739 14.493 1.00 0.00 ATOM 2351 CD PRO A 300 11.473 -22.989 14.091 1.00 0.00 ATOM 2352 O PRO A 300 12.053 -19.411 11.150 1.00 0.00 ATOM 2353 C PRO A 300 12.291 -20.282 12.007 1.00 0.00 ATOM 2354 N GLU A 301 13.373 -20.255 12.792 1.00 0.00 ATOM 2355 CA GLU A 301 14.376 -19.206 12.623 1.00 0.00 ATOM 2356 CB GLU A 301 15.121 -18.961 13.937 1.00 0.00 ATOM 2357 CG GLU A 301 16.306 -18.016 13.811 1.00 0.00 ATOM 2358 CD GLU A 301 15.892 -16.609 13.429 1.00 0.00 ATOM 2359 OE1 GLU A 301 14.681 -16.309 13.491 1.00 0.00 ATOM 2360 OE2 GLU A 301 16.779 -15.807 13.067 1.00 0.00 ATOM 2361 O GLU A 301 15.704 -18.855 10.664 1.00 0.00 ATOM 2362 C GLU A 301 15.388 -19.635 11.547 1.00 0.00 ATOM 2363 N GLU A 302 15.886 -20.872 11.625 1.00 0.00 ATOM 2364 CA GLU A 302 16.853 -21.334 10.632 1.00 0.00 ATOM 2365 CB GLU A 302 17.198 -22.807 10.864 1.00 0.00 ATOM 2366 CG GLU A 302 18.247 -23.355 9.911 1.00 0.00 ATOM 2367 CD GLU A 302 18.605 -24.799 10.206 1.00 0.00 ATOM 2368 OE1 GLU A 302 18.046 -25.362 11.171 1.00 0.00 ATOM 2369 OE2 GLU A 302 19.444 -25.364 9.475 1.00 0.00 ATOM 2370 O GLU A 302 17.050 -20.821 8.295 1.00 0.00 ATOM 2371 C GLU A 302 16.309 -21.201 9.204 1.00 0.00 ATOM 2372 N PHE A 303 15.019 -21.513 9.000 1.00 0.00 ATOM 2373 CA PHE A 303 14.430 -21.426 7.657 1.00 0.00 ATOM 2374 CB PHE A 303 12.982 -21.922 7.674 1.00 0.00 ATOM 2375 CG PHE A 303 12.348 -21.988 6.313 1.00 0.00 ATOM 2376 CD1 PHE A 303 12.693 -22.987 5.420 1.00 0.00 ATOM 2377 CD2 PHE A 303 11.406 -21.051 5.926 1.00 0.00 ATOM 2378 CE1 PHE A 303 12.111 -23.048 4.168 1.00 0.00 ATOM 2379 CE2 PHE A 303 10.822 -21.112 4.675 1.00 0.00 ATOM 2380 CZ PHE A 303 11.171 -22.105 3.797 1.00 0.00 ATOM 2381 O PHE A 303 14.464 -19.827 5.844 1.00 0.00 ATOM 2382 C PHE A 303 14.395 -20.005 7.072 1.00 0.00 ATOM 2383 N THR A 304 14.232 -18.945 7.959 1.00 0.00 ATOM 2384 CA THR A 304 14.288 -17.539 7.536 1.00 0.00 ATOM 2385 CB THR A 304 13.670 -16.606 8.593 1.00 0.00 ATOM 2386 CG2 THR A 304 13.739 -15.158 8.132 1.00 0.00 ATOM 2387 OG1 THR A 304 12.297 -16.960 8.804 1.00 0.00 ATOM 2388 O THR A 304 16.069 -16.451 6.315 1.00 0.00 ATOM 2389 C THR A 304 15.741 -17.108 7.317 1.00 0.00 ATOM 2390 N LEU A 305 16.617 -17.465 8.250 1.00 0.00 ATOM 2391 CA LEU A 305 18.024 -17.077 8.145 1.00 0.00 ATOM 2392 CB LEU A 305 18.798 -17.535 9.384 1.00 0.00 ATOM 2393 CG LEU A 305 20.294 -17.211 9.404 1.00 0.00 ATOM 2394 CD1 LEU A 305 20.520 -15.708 9.365 1.00 0.00 ATOM 2395 CD2 LEU A 305 20.943 -17.757 10.667 1.00 0.00 ATOM 2396 O LEU A 305 19.486 -16.986 6.232 1.00 0.00 ATOM 2397 C LEU A 305 18.738 -17.676 6.934 1.00 0.00 ATOM 2398 N GLU A 306 18.543 -18.975 6.720 1.00 0.00 ATOM 2399 CA GLU A 306 19.133 -19.640 5.570 1.00 0.00 ATOM 2400 CB GLU A 306 18.804 -21.134 5.588 1.00 0.00 ATOM 2401 CG GLU A 306 19.521 -21.914 6.678 1.00 0.00 ATOM 2402 CD GLU A 306 19.080 -23.363 6.745 1.00 0.00 ATOM 2403 OE1 GLU A 306 18.160 -23.738 5.988 1.00 0.00 ATOM 2404 OE2 GLU A 306 19.653 -24.121 7.554 1.00 0.00 ATOM 2405 O GLU A 306 19.382 -18.852 3.301 1.00 0.00 ATOM 2406 C GLU A 306 18.612 -19.064 4.240 1.00 0.00 ATOM 2407 N CYS A 307 17.312 -18.797 4.186 1.00 0.00 ATOM 2408 CA CYS A 307 16.684 -18.237 3.000 1.00 0.00 ATOM 2409 CB CYS A 307 15.188 -18.027 3.235 1.00 0.00 ATOM 2410 SG CYS A 307 14.286 -17.402 1.798 1.00 0.00 ATOM 2411 O CYS A 307 17.809 -16.697 1.534 1.00 0.00 ATOM 2412 C CYS A 307 17.315 -16.886 2.650 1.00 0.00 ATOM 2413 N THR A 308 17.360 -15.982 3.634 1.00 0.00 ATOM 2414 CA THR A 308 17.873 -14.635 3.407 1.00 0.00 ATOM 2415 CB THR A 308 17.728 -13.756 4.663 1.00 0.00 ATOM 2416 CG2 THR A 308 18.305 -12.370 4.413 1.00 0.00 ATOM 2417 OG1 THR A 308 16.343 -13.627 5.004 1.00 0.00 ATOM 2418 O THR A 308 19.793 -13.951 2.137 1.00 0.00 ATOM 2419 C THR A 308 19.365 -14.682 3.031 1.00 0.00 ATOM 2420 N ALA A 309 20.205 -15.577 3.753 1.00 0.00 ATOM 2421 CA ALA A 309 21.623 -15.694 3.409 1.00 0.00 ATOM 2422 CB ALA A 309 22.312 -16.684 4.335 1.00 0.00 ATOM 2423 O ALA A 309 22.613 -15.624 1.231 1.00 0.00 ATOM 2424 C ALA A 309 21.804 -16.177 1.981 1.00 0.00 ATOM 2425 N LYS A 310 21.028 -17.174 1.579 1.00 0.00 ATOM 2426 CA LYS A 310 21.190 -17.721 0.239 1.00 0.00 ATOM 2427 CB LYS A 310 20.390 -19.016 0.090 1.00 0.00 ATOM 2428 CG LYS A 310 20.954 -20.188 0.879 1.00 0.00 ATOM 2429 CD LYS A 310 20.116 -21.441 0.682 1.00 0.00 ATOM 2430 CE LYS A 310 20.659 -22.602 1.497 1.00 0.00 ATOM 2431 NZ LYS A 310 19.833 -23.831 1.332 1.00 0.00 ATOM 2432 O LYS A 310 21.426 -16.711 -1.911 1.00 0.00 ATOM 2433 C LYS A 310 20.733 -16.842 -0.903 1.00 0.00 ATOM 2434 N PHE A 311 19.586 -16.197 -0.751 1.00 0.00 ATOM 2435 CA PHE A 311 19.033 -15.456 -1.878 1.00 0.00 ATOM 2436 CB PHE A 311 17.535 -15.730 -2.024 1.00 0.00 ATOM 2437 CG PHE A 311 17.208 -17.157 -2.358 1.00 0.00 ATOM 2438 CD1 PHE A 311 16.728 -18.019 -1.388 1.00 0.00 ATOM 2439 CD2 PHE A 311 17.383 -17.639 -3.644 1.00 0.00 ATOM 2440 CE1 PHE A 311 16.428 -19.332 -1.696 1.00 0.00 ATOM 2441 CE2 PHE A 311 17.083 -18.953 -3.952 1.00 0.00 ATOM 2442 CZ PHE A 311 16.608 -19.799 -2.984 1.00 0.00 ATOM 2443 O PHE A 311 19.090 -13.290 -2.882 1.00 0.00 ATOM 2444 C PHE A 311 19.141 -13.943 -1.841 1.00 0.00 ATOM 2445 N ARG A 312 19.298 -13.389 -0.647 1.00 0.00 ATOM 2446 CA ARG A 312 19.443 -11.954 -0.515 1.00 0.00 ATOM 2447 CB ARG A 312 18.677 -11.449 0.710 1.00 0.00 ATOM 2448 CG ARG A 312 17.170 -11.636 0.620 1.00 0.00 ATOM 2449 CD ARG A 312 16.568 -10.754 -0.460 1.00 0.00 ATOM 2450 NE ARG A 312 16.705 -9.333 -0.146 1.00 0.00 ATOM 2451 CZ ARG A 312 16.491 -8.351 -1.016 1.00 0.00 ATOM 2452 NH1 ARG A 312 16.640 -7.089 -0.641 1.00 0.00 ATOM 2453 NH2 ARG A 312 16.131 -8.635 -2.261 1.00 0.00 ATOM 2454 O ARG A 312 21.482 -10.904 -1.204 1.00 0.00 ATOM 2455 C ARG A 312 20.912 -11.600 -0.355 1.00 0.00 ATOM 2456 N TYR A 313 21.436 -12.295 0.761 1.00 0.00 ATOM 2457 CA TYR A 313 22.839 -11.966 1.045 1.00 0.00 ATOM 2458 CB TYR A 313 23.305 -12.663 2.324 1.00 0.00 ATOM 2459 CG TYR A 313 22.764 -12.041 3.592 1.00 0.00 ATOM 2460 CD1 TYR A 313 21.747 -12.658 4.308 1.00 0.00 ATOM 2461 CD2 TYR A 313 23.272 -10.840 4.069 1.00 0.00 ATOM 2462 CE1 TYR A 313 21.245 -12.098 5.469 1.00 0.00 ATOM 2463 CE2 TYR A 313 22.784 -10.265 5.225 1.00 0.00 ATOM 2464 CZ TYR A 313 21.762 -10.905 5.926 1.00 0.00 ATOM 2465 OH TYR A 313 21.264 -10.345 7.080 1.00 0.00 ATOM 2466 O TYR A 313 24.810 -11.644 -0.280 1.00 0.00 ATOM 2467 C TYR A 313 23.836 -12.369 -0.035 1.00 0.00 ATOM 2468 N ARG A 314 23.593 -13.508 -0.680 1.00 0.00 ATOM 2469 CA ARG A 314 24.532 -13.999 -1.689 1.00 0.00 ATOM 2470 CB ARG A 314 23.981 -15.257 -2.366 1.00 0.00 ATOM 2471 CG ARG A 314 24.931 -15.884 -3.374 1.00 0.00 ATOM 2472 CD ARG A 314 24.397 -17.213 -3.881 1.00 0.00 ATOM 2473 NE ARG A 314 25.254 -17.787 -4.915 1.00 0.00 ATOM 2474 CZ ARG A 314 24.961 -18.887 -5.603 1.00 0.00 ATOM 2475 NH1 ARG A 314 25.800 -19.335 -6.526 1.00 0.00 ATOM 2476 NH2 ARG A 314 23.828 -19.535 -5.365 1.00 0.00 ATOM 2477 O ARG A 314 25.922 -13.040 -3.387 1.00 0.00 ATOM 2478 C ARG A 314 24.828 -13.002 -2.800 1.00 0.00 ATOM 2479 N GLN A 315 23.875 -12.116 -3.105 1.00 0.00 ATOM 2480 CA GLN A 315 24.082 -11.131 -4.157 1.00 0.00 ATOM 2481 CB GLN A 315 22.768 -10.842 -4.887 1.00 0.00 ATOM 2482 CG GLN A 315 22.156 -12.054 -5.568 1.00 0.00 ATOM 2483 CD GLN A 315 23.067 -12.650 -6.622 1.00 0.00 ATOM 2484 OE1 GLN A 315 23.619 -11.934 -7.457 1.00 0.00 ATOM 2485 NE2 GLN A 315 23.226 -13.969 -6.587 1.00 0.00 ATOM 2486 O GLN A 315 24.805 -8.861 -4.475 1.00 0.00 ATOM 2487 C GLN A 315 24.608 -9.778 -3.671 1.00 0.00 ATOM 2488 N PRO A 316 24.841 -9.650 -2.365 1.00 0.00 ATOM 2489 CA PRO A 316 25.326 -8.380 -1.841 1.00 0.00 ATOM 2490 CB PRO A 316 24.561 -7.951 -0.786 1.00 0.00 ATOM 2491 CG PRO A 316 23.859 -9.239 -0.241 1.00 0.00 ATOM 2492 CD PRO A 316 23.482 -9.937 -1.534 1.00 0.00 ATOM 2493 O PRO A 316 27.591 -8.628 -0.994 1.00 0.00 ATOM 2494 C PRO A 316 26.856 -8.305 -1.931 1.00 0.00 ATOM 2495 N ASP A 317 27.317 -7.879 -3.103 1.00 0.00 ATOM 2496 CA ASP A 317 28.729 -7.673 -3.376 1.00 0.00 ATOM 2497 CB ASP A 317 29.187 -8.564 -4.533 1.00 0.00 ATOM 2498 CG ASP A 317 30.673 -8.444 -4.809 1.00 0.00 ATOM 2499 OD1 ASP A 317 31.321 -7.569 -4.197 1.00 0.00 ATOM 2500 OD2 ASP A 317 31.189 -9.226 -5.635 1.00 0.00 ATOM 2501 O ASP A 317 28.155 -5.736 -4.657 1.00 0.00 ATOM 2502 C ASP A 317 28.826 -6.198 -3.732 1.00 0.00 ATOM 2503 N SER A 318 29.634 -5.437 -3.002 1.00 0.00 ATOM 2504 CA SER A 318 29.698 -4.013 -3.298 1.00 0.00 ATOM 2505 CB SER A 318 28.292 -3.438 -3.477 1.00 0.00 ATOM 2506 OG SER A 318 27.599 -3.388 -2.240 1.00 0.00 ATOM 2507 O SER A 318 30.829 -3.874 -1.228 1.00 0.00 ATOM 2508 C SER A 318 30.377 -3.262 -2.177 1.00 0.00 ATOM 2509 N LYS A 319 30.410 -1.933 -2.279 1.00 0.00 ATOM 2510 CA LYS A 319 31.083 -1.093 -1.294 1.00 0.00 ATOM 2511 CB LYS A 319 32.496 -0.743 -1.764 1.00 0.00 ATOM 2512 CG LYS A 319 33.442 -1.933 -1.826 1.00 0.00 ATOM 2513 CD LYS A 319 34.848 -1.501 -2.212 1.00 0.00 ATOM 2514 CE LYS A 319 35.793 -2.690 -2.270 1.00 0.00 ATOM 2515 NZ LYS A 319 37.168 -2.286 -2.675 1.00 0.00 ATOM 2516 O LYS A 319 29.867 0.841 -2.032 1.00 0.00 ATOM 2517 C LYS A 319 30.318 0.202 -1.081 1.00 0.00 ATOM 2518 N VAL A 320 30.177 0.598 0.182 1.00 0.00 ATOM 2519 CA VAL A 320 29.490 1.824 0.510 1.00 0.00 ATOM 2520 CB VAL A 320 28.264 1.560 1.404 1.00 0.00 ATOM 2521 CG1 VAL A 320 27.591 2.872 1.783 1.00 0.00 ATOM 2522 CG2 VAL A 320 27.250 0.694 0.675 1.00 0.00 ATOM 2523 O VAL A 320 31.191 2.278 2.102 1.00 0.00 ATOM 2524 C VAL A 320 30.444 2.734 1.250 1.00 0.00 ATOM 2525 N THR A 321 30.410 4.011 0.900 1.00 0.00 ATOM 2526 CA THR A 321 31.248 5.011 1.561 1.00 0.00 ATOM 2527 CB THR A 321 32.321 5.576 1.112 1.00 0.00 ATOM 2528 CG2 THR A 321 32.499 6.979 1.667 1.00 0.00 ATOM 2529 OG1 THR A 321 33.346 4.719 1.633 1.00 0.00 ATOM 2530 O THR A 321 29.323 6.399 1.907 1.00 0.00 ATOM 2531 C THR A 321 30.351 5.907 2.401 1.00 0.00 ATOM 2532 N VAL A 322 30.882 6.350 3.661 1.00 0.00 ATOM 2533 CA VAL A 322 30.079 7.218 4.516 1.00 0.00 ATOM 2534 CB VAL A 322 29.434 6.431 5.672 1.00 0.00 ATOM 2535 CG1 VAL A 322 28.491 5.368 5.131 1.00 0.00 ATOM 2536 CG2 VAL A 322 30.501 5.746 6.510 1.00 0.00 ATOM 2537 O VAL A 322 32.168 8.171 5.181 1.00 0.00 ATOM 2538 C VAL A 322 30.949 8.311 5.116 1.00 0.00 ATOM 2539 N HIS A 323 30.300 9.391 5.524 1.00 0.00 ATOM 2540 CA HIS A 323 30.972 10.432 6.302 1.00 0.00 ATOM 2541 CB HIS A 323 30.734 11.797 5.664 1.00 0.00 ATOM 2542 CG HIS A 323 31.505 12.913 6.306 1.00 0.00 ATOM 2543 CD2 HIS A 323 31.139 13.832 7.234 1.00 0.00 ATOM 2544 ND1 HIS A 323 32.808 13.209 5.969 1.00 0.00 ATOM 2545 CE1 HIS A 323 33.218 14.249 6.674 1.00 0.00 ATOM 2546 NE2 HIS A 323 32.226 14.644 7.452 1.00 0.00 ATOM 2547 O HIS A 323 29.075 10.605 7.791 1.00 0.00 ATOM 2548 C HIS A 323 30.278 10.356 7.681 1.00 0.00 ATOM 2549 N VAL A 324 31.002 10.048 8.715 1.00 0.00 ATOM 2550 CA VAL A 324 30.436 9.934 10.059 1.00 0.00 ATOM 2551 CB VAL A 324 31.067 8.767 10.840 1.00 0.00 ATOM 2552 CG1 VAL A 324 30.504 8.704 12.252 1.00 0.00 ATOM 2553 CG2 VAL A 324 30.779 7.444 10.148 1.00 0.00 ATOM 2554 O VAL A 324 31.813 11.758 10.801 1.00 0.00 ATOM 2555 C VAL A 324 30.690 11.221 10.830 1.00 0.00 ATOM 2556 N LYS A 325 29.665 11.723 11.513 1.00 0.00 ATOM 2557 CA LYS A 325 29.814 12.942 12.292 1.00 0.00 ATOM 2558 CB LYS A 325 28.809 14.000 11.831 1.00 0.00 ATOM 2559 CG LYS A 325 29.045 14.505 10.417 1.00 0.00 ATOM 2560 CD LYS A 325 28.033 15.574 10.036 1.00 0.00 ATOM 2561 CE LYS A 325 28.259 16.067 8.616 1.00 0.00 ATOM 2562 NZ LYS A 325 27.267 17.106 8.225 1.00 0.00 ATOM 2563 O LYS A 325 30.372 11.868 14.333 1.00 0.00 ATOM 2564 C LYS A 325 29.562 12.585 13.747 1.00 0.00 ATOM 2565 N GLY A 326 28.459 13.030 14.346 1.00 0.00 ATOM 2566 CA GLY A 326 28.194 12.671 15.744 1.00 0.00 ATOM 2567 O GLY A 326 25.942 11.948 15.259 1.00 0.00 ATOM 2568 C GLY A 326 26.987 11.735 15.898 1.00 0.00 ATOM 2569 N GLU A 327 27.112 10.723 16.763 1.00 0.00 ATOM 2570 CA GLU A 327 25.985 9.824 16.995 1.00 0.00 ATOM 2571 CB GLU A 327 24.814 10.581 17.623 1.00 0.00 ATOM 2572 CG GLU A 327 25.073 11.054 19.046 1.00 0.00 ATOM 2573 CD GLU A 327 25.355 9.908 19.998 1.00 0.00 ATOM 2574 OE1 GLU A 327 24.540 8.963 20.048 1.00 0.00 ATOM 2575 OE2 GLU A 327 26.391 9.955 20.693 1.00 0.00 ATOM 2576 O GLU A 327 25.652 7.820 15.718 1.00 0.00 ATOM 2577 C GLU A 327 25.410 9.022 15.831 1.00 0.00 ATOM 2578 N LYS A 328 24.690 9.633 14.826 1.00 0.00 ATOM 2579 CA LYS A 328 24.088 8.947 13.681 1.00 0.00 ATOM 2580 CB LYS A 328 23.003 9.845 13.083 1.00 0.00 ATOM 2581 CG LYS A 328 22.363 9.288 11.821 1.00 0.00 ATOM 2582 CD LYS A 328 21.248 10.192 11.322 1.00 0.00 ATOM 2583 CE LYS A 328 20.606 9.634 10.061 1.00 0.00 ATOM 2584 NZ LYS A 328 19.506 10.505 9.565 1.00 0.00 ATOM 2585 O LYS A 328 24.860 8.428 11.478 1.00 0.00 ATOM 2586 C LYS A 328 25.163 8.787 12.617 1.00 0.00 ATOM 2587 N THR A 329 24.976 10.443 10.828 1.00 0.00 ATOM 2588 CA THR A 329 25.975 10.132 9.803 1.00 0.00 ATOM 2589 CB THR A 329 26.424 8.660 9.880 1.00 0.00 ATOM 2590 CG2 THR A 329 27.015 8.355 11.248 1.00 0.00 ATOM 2591 OG1 THR A 329 25.299 7.801 9.659 1.00 0.00 ATOM 2592 O THR A 329 24.118 10.574 8.367 1.00 0.00 ATOM 2593 C THR A 329 25.324 10.400 8.451 1.00 0.00 ATOM 2594 N GLU A 330 26.130 10.417 7.391 1.00 0.00 ATOM 2595 CA GLU A 330 25.574 10.599 6.050 1.00 0.00 ATOM 2596 CB GLU A 330 25.897 11.998 5.523 1.00 0.00 ATOM 2597 CG GLU A 330 25.261 13.124 6.322 1.00 0.00 ATOM 2598 CD GLU A 330 25.591 14.494 5.765 1.00 0.00 ATOM 2599 OE1 GLU A 330 26.360 14.565 4.781 1.00 0.00 ATOM 2600 OE2 GLU A 330 25.083 15.496 6.309 1.00 0.00 ATOM 2601 O GLU A 330 27.318 9.147 5.306 1.00 0.00 ATOM 2602 C GLU A 330 26.174 9.574 5.127 1.00 0.00 ATOM 2603 N VAL A 331 25.394 9.142 4.137 1.00 0.00 ATOM 2604 CA VAL A 331 25.947 8.199 3.158 1.00 0.00 ATOM 2605 CB VAL A 331 24.853 7.287 2.573 1.00 0.00 ATOM 2606 CG1 VAL A 331 25.447 6.330 1.552 1.00 0.00 ATOM 2607 CG2 VAL A 331 24.197 6.468 3.675 1.00 0.00 ATOM 2608 O VAL A 331 25.907 9.834 1.411 1.00 0.00 ATOM 2609 C VAL A 331 26.571 8.945 1.964 1.00 0.00 ATOM 2610 N ILE A 332 27.767 8.480 1.344 1.00 0.00 ATOM 2611 CA ILE A 332 28.396 9.227 0.258 1.00 0.00 ATOM 2612 CB ILE A 332 29.822 9.553 0.743 1.00 0.00 ATOM 2613 CG1 ILE A 332 29.775 10.560 1.894 1.00 0.00 ATOM 2614 CG2 ILE A 332 30.645 10.149 -0.387 1.00 0.00 ATOM 2615 CD1 ILE A 332 31.100 10.739 2.602 1.00 0.00 ATOM 2616 O ILE A 332 28.361 9.182 -2.148 1.00 0.00 ATOM 2617 C ILE A 332 28.503 8.539 -1.109 1.00 0.00 ATOM 2618 N PHE A 333 28.676 7.255 -1.117 1.00 0.00 ATOM 2619 CA PHE A 333 28.768 6.442 -2.334 1.00 0.00 ATOM 2620 CB PHE A 333 30.231 6.204 -2.640 1.00 0.00 ATOM 2621 CG PHE A 333 30.552 5.330 -3.841 1.00 0.00 ATOM 2622 CD1 PHE A 333 30.397 5.845 -5.121 1.00 0.00 ATOM 2623 CD2 PHE A 333 31.003 4.026 -3.698 1.00 0.00 ATOM 2624 CE1 PHE A 333 30.702 5.072 -6.232 1.00 0.00 ATOM 2625 CE2 PHE A 333 31.305 3.234 -4.809 1.00 0.00 ATOM 2626 CZ PHE A 333 31.147 3.773 -6.066 1.00 0.00 ATOM 2627 O PHE A 333 28.342 4.476 -1.030 1.00 0.00 ATOM 2628 C PHE A 333 28.291 5.012 -2.149 1.00 0.00 ATOM 2629 N ALA A 334 27.853 4.407 -3.254 1.00 0.00 ATOM 2630 CA ALA A 334 27.375 3.026 -3.286 1.00 0.00 ATOM 2631 CB ALA A 334 25.862 2.985 -3.149 1.00 0.00 ATOM 2632 O ALA A 334 27.421 2.972 -5.655 1.00 0.00 ATOM 2633 C ALA A 334 27.795 2.439 -4.616 1.00 0.00 ATOM 2634 N GLU A 335 28.581 1.370 -4.573 1.00 0.00 ATOM 2635 CA GLU A 335 29.017 0.682 -5.783 1.00 0.00 ATOM 2636 CB GLU A 335 30.512 0.828 -5.964 1.00 0.00 ATOM 2637 CG GLU A 335 31.007 0.193 -7.254 1.00 0.00 ATOM 2638 CD GLU A 335 32.514 0.215 -7.393 1.00 0.00 ATOM 2639 OE1 GLU A 335 33.197 0.710 -6.466 1.00 0.00 ATOM 2640 OE2 GLU A 335 33.016 -0.262 -8.432 1.00 0.00 ATOM 2641 O GLU A 335 28.933 -1.416 -4.571 1.00 0.00 ATOM 2642 C GLU A 335 28.842 -0.827 -5.663 1.00 0.00 ATOM 2643 N PRO A 336 28.155 -1.561 -6.967 1.00 0.00 ATOM 2644 CA PRO A 336 28.031 -3.013 -6.995 1.00 0.00 ATOM 2645 CB PRO A 336 26.748 -3.290 -6.208 1.00 0.00 ATOM 2646 CG PRO A 336 25.929 -2.055 -6.381 1.00 0.00 ATOM 2647 CD PRO A 336 26.904 -0.911 -6.425 1.00 0.00 ATOM 2648 O PRO A 336 27.132 -3.025 -9.213 1.00 0.00 ATOM 2649 C PRO A 336 27.928 -3.531 -8.421 1.00 0.00 ATOM 2650 N GLN A 337 29.163 -4.441 -8.554 1.00 0.00 ATOM 2651 CA GLN A 337 29.109 -5.041 -9.888 1.00 0.00 ATOM 2652 CB GLN A 337 30.226 -6.074 -10.056 1.00 0.00 ATOM 2653 CG GLN A 337 31.624 -5.478 -10.087 1.00 0.00 ATOM 2654 CD GLN A 337 32.703 -6.532 -10.226 1.00 0.00 ATOM 2655 OE1 GLN A 337 32.414 -7.729 -10.264 1.00 0.00 ATOM 2656 NE2 GLN A 337 33.953 -6.091 -10.302 1.00 0.00 ATOM 2657 O GLN A 337 27.361 -6.093 -11.195 1.00 0.00 ATOM 2658 C GLN A 337 27.735 -5.738 -10.073 1.00 0.00 ATOM 2659 N ARG A 338 26.988 -5.901 -8.974 1.00 0.00 ATOM 2660 CA ARG A 338 25.674 -6.546 -8.993 1.00 0.00 ATOM 2661 CB ARG A 338 25.529 -7.500 -7.806 1.00 0.00 ATOM 2662 CG ARG A 338 26.598 -8.580 -7.742 1.00 0.00 ATOM 2663 CD ARG A 338 26.527 -9.500 -8.951 1.00 0.00 ATOM 2664 NE ARG A 338 25.263 -10.228 -9.010 1.00 0.00 ATOM 2665 CZ ARG A 338 24.832 -10.892 -10.079 1.00 0.00 ATOM 2666 NH1 ARG A 338 23.669 -11.527 -10.040 1.00 0.00 ATOM 2667 NH2 ARG A 338 25.568 -10.922 -11.180 1.00 0.00 ATOM 2668 O ARG A 338 23.329 -6.031 -8.814 1.00 0.00 ATOM 2669 C ARG A 338 24.483 -5.586 -8.915 1.00 0.00 ATOM 2670 N ALA A 339 24.739 -4.280 -8.948 1.00 0.00 ATOM 2671 CA ALA A 339 23.629 -3.339 -8.892 1.00 0.00 ATOM 2672 CB ALA A 339 24.139 -1.911 -8.999 1.00 0.00 ATOM 2673 O ALA A 339 23.008 -3.774 -11.168 1.00 0.00 ATOM 2674 C ALA A 339 22.626 -3.539 -10.004 1.00 0.00 ATOM 2675 N ILE A 340 21.345 -3.458 -9.653 1.00 0.00 ATOM 2676 CA ILE A 340 20.303 -3.473 -10.671 1.00 0.00 ATOM 2677 CB ILE A 340 19.110 -4.346 -10.245 1.00 0.00 ATOM 2678 CG1 ILE A 340 18.443 -3.766 -8.994 1.00 0.00 ATOM 2679 CG2 ILE A 340 19.571 -5.761 -9.932 1.00 0.00 ATOM 2680 CD1 ILE A 340 17.136 -4.436 -8.634 1.00 0.00 ATOM 2681 O ILE A 340 19.101 -1.704 -11.771 1.00 0.00 ATOM 2682 C ILE A 340 19.851 -2.019 -10.851 1.00 0.00 ATOM 2683 N THR A 341 20.307 -1.133 -9.966 1.00 0.00 ATOM 2684 CA THR A 341 20.070 0.291 -10.168 1.00 0.00 ATOM 2685 CB THR A 341 20.246 1.084 -8.860 1.00 0.00 ATOM 2686 CG2 THR A 341 20.006 2.567 -9.100 1.00 0.00 ATOM 2687 OG1 THR A 341 19.308 0.615 -7.883 1.00 0.00 ATOM 2688 O THR A 341 22.297 0.425 -11.102 1.00 0.00 ATOM 2689 C THR A 341 21.112 0.746 -11.218 1.00 0.00 ATOM 2690 N PRO A 342 20.417 1.475 -12.367 1.00 0.00 ATOM 2691 CA PRO A 342 21.322 2.036 -13.385 1.00 0.00 ATOM 2692 CB PRO A 342 21.185 1.077 -14.569 1.00 0.00 ATOM 2693 CG PRO A 342 19.816 0.502 -14.428 1.00 0.00 ATOM 2694 CD PRO A 342 19.564 0.384 -12.951 1.00 0.00 ATOM 2695 O PRO A 342 19.626 3.646 -13.897 1.00 0.00 ATOM 2696 C PRO A 342 20.810 3.442 -13.679 1.00 0.00 ATOM 2697 N GLY A 343 21.688 4.468 -12.358 1.00 0.00 ATOM 2698 CA GLY A 343 21.332 5.837 -12.578 1.00 0.00 ATOM 2699 O GLY A 343 20.518 7.732 -11.531 1.00 0.00 ATOM 2700 C GLY A 343 20.805 6.546 -11.350 1.00 0.00 ATOM 2701 N GLN A 344 20.734 5.837 -10.227 1.00 0.00 ATOM 2702 CA GLN A 344 20.173 6.415 -9.009 1.00 0.00 ATOM 2703 CB GLN A 344 19.704 5.310 -8.060 1.00 0.00 ATOM 2704 CG GLN A 344 19.014 5.822 -6.804 1.00 0.00 ATOM 2705 CD GLN A 344 17.660 6.442 -7.096 1.00 0.00 ATOM 2706 OE1 GLN A 344 16.876 5.904 -7.878 1.00 0.00 ATOM 2707 NE2 GLN A 344 17.383 7.578 -6.467 1.00 0.00 ATOM 2708 O GLN A 344 21.067 8.506 -8.285 1.00 0.00 ATOM 2709 C GLN A 344 21.212 7.268 -8.264 1.00 0.00 ATOM 2710 N ALA A 345 22.174 6.632 -7.605 1.00 0.00 ATOM 2711 CA ALA A 345 23.116 7.373 -6.775 1.00 0.00 ATOM 2712 CB ALA A 345 23.843 6.435 -5.823 1.00 0.00 ATOM 2713 O ALA A 345 24.762 7.532 -8.556 1.00 0.00 ATOM 2714 C ALA A 345 24.174 8.088 -7.609 1.00 0.00 ATOM 2715 N VAL A 346 24.487 9.324 -7.234 1.00 0.00 ATOM 2716 CA VAL A 346 25.450 10.084 -8.025 1.00 0.00 ATOM 2717 CB VAL A 346 24.836 11.395 -8.551 1.00 0.00 ATOM 2718 CG1 VAL A 346 23.706 11.101 -9.527 1.00 0.00 ATOM 2719 CG2 VAL A 346 24.277 12.221 -7.403 1.00 0.00 ATOM 2720 O VAL A 346 27.437 11.369 -7.658 1.00 0.00 ATOM 2721 C VAL A 346 26.690 10.473 -7.245 1.00 0.00 ATOM 2722 N VAL A 347 26.950 9.818 -6.125 1.00 0.00 ATOM 2723 CA VAL A 347 28.106 10.127 -5.308 1.00 0.00 ATOM 2724 CB VAL A 347 27.696 10.545 -3.885 1.00 0.00 ATOM 2725 CG1 VAL A 347 28.927 10.828 -3.037 1.00 0.00 ATOM 2726 CG2 VAL A 347 26.840 11.802 -3.923 1.00 0.00 ATOM 2727 O VAL A 347 28.579 7.833 -4.824 1.00 0.00 ATOM 2728 C VAL A 347 29.026 8.922 -5.190 1.00 0.00 ATOM 2729 N PHE A 348 30.294 9.126 -5.554 1.00 0.00 ATOM 2730 CA PHE A 348 31.191 8.023 -5.524 1.00 0.00 ATOM 2731 CB PHE A 348 31.954 7.917 -6.845 1.00 0.00 ATOM 2732 CG PHE A 348 31.089 7.550 -8.017 1.00 0.00 ATOM 2733 CD1 PHE A 348 30.494 8.530 -8.790 1.00 0.00 ATOM 2734 CD2 PHE A 348 30.870 6.223 -8.347 1.00 0.00 ATOM 2735 CE1 PHE A 348 29.698 8.194 -9.868 1.00 0.00 ATOM 2736 CE2 PHE A 348 30.074 5.886 -9.425 1.00 0.00 ATOM 2737 CZ PHE A 348 29.490 6.865 -10.185 1.00 0.00 ATOM 2738 O PHE A 348 32.842 9.206 -4.335 1.00 0.00 ATOM 2739 C PHE A 348 32.187 8.173 -4.421 1.00 0.00 ATOM 2740 N TYR A 349 32.287 7.168 -3.589 1.00 0.00 ATOM 2741 CA TYR A 349 33.229 7.135 -2.491 1.00 0.00 ATOM 2742 CB TYR A 349 33.030 7.567 -1.237 1.00 0.00 ATOM 2743 CG TYR A 349 34.063 7.126 -0.235 1.00 0.00 ATOM 2744 CD1 TYR A 349 35.379 7.480 -0.480 1.00 0.00 ATOM 2745 CD2 TYR A 349 33.732 6.361 0.861 1.00 0.00 ATOM 2746 CE1 TYR A 349 36.388 7.138 0.325 1.00 0.00 ATOM 2747 CE2 TYR A 349 34.824 5.983 1.747 1.00 0.00 ATOM 2748 CZ TYR A 349 36.106 6.374 1.407 1.00 0.00 ATOM 2749 OH TYR A 349 37.187 6.046 2.281 1.00 0.00 ATOM 2750 O TYR A 349 34.106 5.028 -3.223 1.00 0.00 ATOM 2751 C TYR A 349 34.370 6.217 -2.956 1.00 0.00 ATOM 2752 N ASP A 350 35.437 6.686 -3.214 1.00 0.00 ATOM 2753 CA ASP A 350 36.598 5.918 -3.591 1.00 0.00 ATOM 2754 CB ASP A 350 37.030 6.264 -5.018 1.00 0.00 ATOM 2755 CG ASP A 350 37.904 5.193 -5.638 1.00 0.00 ATOM 2756 OD1 ASP A 350 38.191 4.190 -4.953 1.00 0.00 ATOM 2757 OD2 ASP A 350 38.304 5.358 -6.810 1.00 0.00 ATOM 2758 O ASP A 350 37.675 6.978 -1.778 1.00 0.00 ATOM 2759 C ASP A 350 37.764 6.167 -2.704 1.00 0.00 ATOM 2760 N GLY A 351 38.861 5.495 -3.019 1.00 0.00 ATOM 2761 CA GLY A 351 40.063 5.645 -2.218 1.00 0.00 ATOM 2762 O GLY A 351 41.153 7.521 -1.211 1.00 0.00 ATOM 2763 C GLY A 351 40.545 7.095 -2.184 1.00 0.00 ATOM 2764 N GLU A 352 40.256 7.883 -3.304 1.00 0.00 ATOM 2765 CA GLU A 352 40.674 9.268 -3.361 1.00 0.00 ATOM 2766 CB GLU A 352 41.102 9.639 -4.783 1.00 0.00 ATOM 2767 CG GLU A 352 42.338 8.904 -5.273 1.00 0.00 ATOM 2768 CD GLU A 352 42.720 9.285 -6.689 1.00 0.00 ATOM 2769 OE1 GLU A 352 42.058 10.174 -7.264 1.00 0.00 ATOM 2770 OE2 GLU A 352 43.681 8.694 -7.224 1.00 0.00 ATOM 2771 O GLU A 352 39.543 11.398 -3.302 1.00 0.00 ATOM 2772 C GLU A 352 39.538 10.221 -2.944 1.00 0.00 ATOM 2773 N GLU A 353 38.098 9.778 -2.090 1.00 0.00 ATOM 2774 CA GLU A 353 37.074 10.703 -1.654 1.00 0.00 ATOM 2775 CB GLU A 353 37.508 12.147 -1.918 1.00 0.00 ATOM 2776 CG GLU A 353 38.685 12.605 -1.073 1.00 0.00 ATOM 2777 CD GLU A 353 39.124 14.019 -1.403 1.00 0.00 ATOM 2778 OE1 GLU A 353 38.535 14.623 -2.324 1.00 0.00 ATOM 2779 OE2 GLU A 353 40.057 14.522 -0.741 1.00 0.00 ATOM 2780 O GLU A 353 35.469 9.600 -3.035 1.00 0.00 ATOM 2781 C GLU A 353 35.711 10.563 -2.320 1.00 0.00 ATOM 2782 N CYS A 354 34.818 11.405 -1.696 1.00 0.00 ATOM 2783 CA CYS A 354 33.489 11.356 -2.258 1.00 0.00 ATOM 2784 CB CYS A 354 32.447 11.735 -1.202 1.00 0.00 ATOM 2785 SG CYS A 354 30.737 11.674 -1.787 1.00 0.00 ATOM 2786 O CYS A 354 33.941 13.448 -3.302 1.00 0.00 ATOM 2787 C CYS A 354 33.426 12.339 -3.411 1.00 0.00 ATOM 2788 N LEU A 355 32.824 11.978 -4.485 1.00 0.00 ATOM 2789 CA LEU A 355 32.654 12.851 -5.635 1.00 0.00 ATOM 2790 CB LEU A 355 33.474 12.269 -6.788 1.00 0.00 ATOM 2791 CG LEU A 355 34.988 12.207 -6.579 1.00 0.00 ATOM 2792 CD1 LEU A 355 35.658 11.452 -7.717 1.00 0.00 ATOM 2793 CD2 LEU A 355 35.580 13.607 -6.526 1.00 0.00 ATOM 2794 O LEU A 355 30.415 11.930 -5.775 1.00 0.00 ATOM 2795 C LEU A 355 31.183 12.869 -6.022 1.00 0.00 ATOM 2796 N GLY A 356 30.772 13.941 -6.655 1.00 0.00 ATOM 2797 CA GLY A 356 29.397 14.081 -7.125 1.00 0.00 ATOM 2798 O GLY A 356 27.201 13.621 -6.268 1.00 0.00 ATOM 2799 C GLY A 356 28.348 14.010 -6.030 1.00 0.00 ATOM 2800 N GLY A 357 28.731 14.426 -4.828 1.00 0.00 ATOM 2801 CA GLY A 357 27.817 14.370 -3.706 1.00 0.00 ATOM 2802 O GLY A 357 26.989 16.610 -4.075 1.00 0.00 ATOM 2803 C GLY A 357 26.876 15.534 -3.471 1.00 0.00 ATOM 2804 N GLY A 358 25.910 15.261 -2.584 1.00 0.00 ATOM 2805 CA GLY A 358 24.934 16.255 -2.199 1.00 0.00 ATOM 2806 O GLY A 358 24.926 15.143 -0.067 1.00 0.00 ATOM 2807 C GLY A 358 24.500 16.070 -0.758 1.00 0.00 ATOM 2808 N LEU A 359 23.649 16.972 -0.292 1.00 0.00 ATOM 2809 CA LEU A 359 23.116 16.879 1.049 1.00 0.00 ATOM 2810 CB LEU A 359 23.666 18.010 1.922 1.00 0.00 ATOM 2811 CG LEU A 359 23.137 18.076 3.357 1.00 0.00 ATOM 2812 CD1 LEU A 359 23.604 16.871 4.158 1.00 0.00 ATOM 2813 CD2 LEU A 359 23.632 19.332 4.055 1.00 0.00 ATOM 2814 O LEU A 359 21.088 17.919 0.332 1.00 0.00 ATOM 2815 C LEU A 359 21.599 16.990 0.952 1.00 0.00 ATOM 2816 N ILE A 360 20.890 16.027 1.540 1.00 0.00 ATOM 2817 CA ILE A 360 19.419 16.007 1.539 1.00 0.00 ATOM 2818 CB ILE A 360 18.871 14.770 2.275 1.00 0.00 ATOM 2819 CG1 ILE A 360 19.323 13.488 1.574 1.00 0.00 ATOM 2820 CG2 ILE A 360 17.350 14.796 2.300 1.00 0.00 ATOM 2821 CD1 ILE A 360 18.850 13.376 0.141 1.00 0.00 ATOM 2822 O ILE A 360 19.037 17.401 3.446 1.00 0.00 ATOM 2823 C ILE A 360 18.796 17.189 2.254 1.00 0.00 ATOM 2824 N ASP A 361 18.059 18.036 1.516 1.00 0.00 ATOM 2825 CA ASP A 361 17.464 19.241 2.070 1.00 0.00 ATOM 2826 CB ASP A 361 16.985 20.178 0.959 1.00 0.00 ATOM 2827 CG ASP A 361 15.922 19.546 0.083 1.00 0.00 ATOM 2828 OD1 ASP A 361 16.181 18.459 -0.475 1.00 0.00 ATOM 2829 OD2 ASP A 361 14.830 20.138 -0.045 1.00 0.00 ATOM 2830 O ASP A 361 15.842 19.753 3.762 1.00 0.00 ATOM 2831 C ASP A 361 16.260 18.932 2.952 1.00 0.00 ATOM 2832 N ASN A 362 15.698 17.742 2.780 1.00 0.00 ATOM 2833 CA ASN A 362 14.543 17.317 3.557 1.00 0.00 ATOM 2834 CB ASN A 362 13.240 17.621 2.815 1.00 0.00 ATOM 2835 CG ASN A 362 13.141 16.891 1.490 1.00 0.00 ATOM 2836 ND2 ASN A 362 13.040 17.649 0.405 1.00 0.00 ATOM 2837 OD1 ASN A 362 13.154 15.660 1.446 1.00 0.00 ATOM 2838 O ASN A 362 15.499 15.193 3.102 1.00 0.00 ATOM 2839 C ASN A 362 14.692 15.832 3.767 1.00 0.00 ATOM 2840 N ALA A 363 13.913 15.273 4.679 1.00 0.00 ATOM 2841 CA ALA A 363 13.943 13.830 4.863 1.00 0.00 ATOM 2842 CB ALA A 363 13.263 13.447 6.168 1.00 0.00 ATOM 2843 O ALA A 363 12.518 13.839 2.905 1.00 0.00 ATOM 2844 C ALA A 363 13.201 13.173 3.683 1.00 0.00 ATOM 2845 N TYR A 364 13.316 11.859 3.576 1.00 0.00 ATOM 2846 CA TYR A 364 12.629 11.138 2.528 1.00 0.00 ATOM 2847 CB TYR A 364 12.804 9.629 2.712 1.00 0.00 ATOM 2848 CG TYR A 364 12.065 8.797 1.688 1.00 0.00 ATOM 2849 CD1 TYR A 364 12.597 8.590 0.422 1.00 0.00 ATOM 2850 CD2 TYR A 364 10.839 8.221 1.992 1.00 0.00 ATOM 2851 CE1 TYR A 364 11.929 7.831 -0.520 1.00 0.00 ATOM 2852 CE2 TYR A 364 10.156 7.459 1.062 1.00 0.00 ATOM 2853 CZ TYR A 364 10.713 7.267 -0.202 1.00 0.00 ATOM 2854 OH TYR A 364 10.045 6.512 -1.137 1.00 0.00 ATOM 2855 O TYR A 364 10.559 11.829 1.521 1.00 0.00 ATOM 2856 C TYR A 364 11.129 11.453 2.542 1.00 0.00 ATOM 2857 N ARG A 365 10.501 11.308 3.702 1.00 0.00 ATOM 2858 CA ARG A 365 9.063 11.586 3.821 1.00 0.00 ATOM 2859 CB ARG A 365 8.247 10.338 3.477 1.00 0.00 ATOM 2860 CG ARG A 365 6.750 10.582 3.383 1.00 0.00 ATOM 2861 CD ARG A 365 6.008 9.317 2.983 1.00 0.00 ATOM 2862 NE ARG A 365 4.558 9.488 3.052 1.00 0.00 ATOM 2863 CZ ARG A 365 3.681 8.653 2.503 1.00 0.00 ATOM 2864 NH1 ARG A 365 2.381 8.889 2.618 1.00 0.00 ATOM 2865 NH2 ARG A 365 4.105 7.584 1.845 1.00 0.00 ATOM 2866 O ARG A 365 9.005 11.294 6.204 1.00 0.00 ATOM 2867 C ARG A 365 8.730 12.014 5.248 1.00 0.00 ATOM 2868 N ASP A 366 8.174 13.198 5.385 1.00 0.00 ATOM 2869 CA ASP A 366 7.789 13.743 6.683 1.00 0.00 ATOM 2870 CB ASP A 366 6.643 12.911 7.262 1.00 0.00 ATOM 2871 CG ASP A 366 5.384 12.993 6.421 1.00 0.00 ATOM 2872 OD1 ASP A 366 4.971 14.120 6.076 1.00 0.00 ATOM 2873 OD2 ASP A 366 4.808 11.928 6.109 1.00 0.00 ATOM 2874 O ASP A 366 8.655 13.325 8.871 1.00 0.00 ATOM 2875 C ASP A 366 8.894 13.731 7.718 1.00 0.00 ATOM 2876 N GLY A 367 10.122 14.174 7.257 1.00 0.00 ATOM 2877 CA GLY A 367 11.201 14.236 8.233 1.00 0.00 ATOM 2878 O GLY A 367 12.948 12.990 9.269 1.00 0.00 ATOM 2879 C GLY A 367 11.972 12.940 8.513 1.00 0.00 ATOM 2880 N GLN A 368 11.577 11.794 7.956 1.00 0.00 ATOM 2881 CA GLN A 368 12.290 10.547 8.205 1.00 0.00 ATOM 2882 CB GLN A 368 11.371 9.346 7.970 1.00 0.00 ATOM 2883 CG GLN A 368 12.024 8.002 8.241 1.00 0.00 ATOM 2884 CD GLN A 368 11.049 6.846 8.123 1.00 0.00 ATOM 2885 OE1 GLN A 368 9.862 7.046 7.874 1.00 0.00 ATOM 2886 NE2 GLN A 368 11.553 5.629 8.302 1.00 0.00 ATOM 2887 O GLN A 368 13.404 10.411 6.074 1.00 0.00 ATOM 2888 C GLN A 368 13.506 10.362 7.304 1.00 0.00 ATOM 2889 N VAL A 369 14.649 10.135 7.942 1.00 0.00 ATOM 2890 CA VAL A 369 15.915 9.917 7.254 1.00 0.00 ATOM 2891 CB VAL A 369 17.029 9.510 8.237 1.00 0.00 ATOM 2892 CG1 VAL A 369 18.296 9.142 7.483 1.00 0.00 ATOM 2893 CG2 VAL A 369 17.350 10.658 9.182 1.00 0.00 ATOM 2894 O VAL A 369 15.182 7.759 6.498 1.00 0.00 ATOM 2895 C VAL A 369 15.765 8.808 6.224 1.00 0.00 ATOM 2896 N CYS A 370 16.299 9.083 5.025 1.00 0.00 ATOM 2897 CA CYS A 370 16.227 8.089 3.961 1.00 0.00 ATOM 2898 CB CYS A 370 15.029 8.363 3.051 1.00 0.00 ATOM 2899 SG CYS A 370 14.603 6.999 1.943 1.00 0.00 ATOM 2900 O CYS A 370 18.350 9.014 3.212 1.00 0.00 ATOM 2901 C CYS A 370 17.491 8.116 3.110 1.00 0.00 ATOM 2902 N GLN A 371 17.665 7.123 2.268 1.00 0.00 ATOM 2903 CA GLN A 371 18.707 7.151 1.242 1.00 0.00 ATOM 2904 CB GLN A 371 18.708 8.498 0.516 1.00 0.00 ATOM 2905 CG GLN A 371 17.446 8.770 -0.287 1.00 0.00 ATOM 2906 CD GLN A 371 17.471 10.124 -0.968 1.00 0.00 ATOM 2907 OE1 GLN A 371 18.460 10.852 -0.889 1.00 0.00 ATOM 2908 NE2 GLN A 371 16.378 10.467 -1.642 1.00 0.00 ATOM 2909 O GLN A 371 20.941 6.176 1.324 1.00 0.00 ATOM 2910 C GLN A 371 20.066 6.851 1.893 1.00 0.00 ATOM 2911 N TYR A 372 20.196 7.389 3.205 1.00 0.00 ATOM 2912 CA TYR A 372 21.451 7.174 3.919 1.00 0.00 ATOM 2913 CB TYR A 372 21.586 8.330 4.911 1.00 0.00 ATOM 2914 CG TYR A 372 21.778 9.680 4.257 1.00 0.00 ATOM 2915 CD1 TYR A 372 20.689 10.490 3.967 1.00 0.00 ATOM 2916 CD2 TYR A 372 23.049 10.138 3.932 1.00 0.00 ATOM 2917 CE1 TYR A 372 20.855 11.726 3.369 1.00 0.00 ATOM 2918 CE2 TYR A 372 23.234 11.371 3.333 1.00 0.00 ATOM 2919 CZ TYR A 372 22.122 12.164 3.054 1.00 0.00 ATOM 2920 OH TYR A 372 22.290 13.394 2.459 1.00 0.00 ATOM 2921 O TYR A 372 20.514 5.478 5.345 1.00 0.00 ATOM 2922 C TYR A 372 21.494 5.857 4.692 1.00 0.00 ATOM 2923 N ILE A 373 22.622 5.159 4.611 1.00 0.00 ATOM 2924 CA ILE A 373 22.777 3.892 5.315 1.00 0.00 ATOM 2925 CB ILE A 373 24.068 3.166 4.891 1.00 0.00 ATOM 2926 CG1 ILE A 373 24.077 2.934 3.379 1.00 0.00 ATOM 2927 CG2 ILE A 373 24.173 1.817 5.587 1.00 0.00 ATOM 2928 CD1 ILE A 373 25.380 2.369 2.856 1.00 0.00 ATOM 2929 O ILE A 373 23.030 5.285 7.262 1.00 0.00 ATOM 2930 C ILE A 373 22.840 4.147 6.821 1.00 0.00 ENDMDL EXPDTA 2hmaA MODEL 2 REMARK 44 REMARK 44 model 2 is called 2hmaA ATOM 1 N SER 2 17.672 35.697 36.692 1.00 0.00 ATOM 2 CA SER 2 18.888 34.961 37.179 1.00 0.00 ATOM 3 CB SER 2 19.203 35.300 38.660 1.00 0.00 ATOM 4 OG SER 2 18.088 35.079 39.519 1.00 0.00 ATOM 5 O SER 2 19.649 32.677 37.508 1.00 0.00 ATOM 6 C SER 2 18.853 33.433 36.931 1.00 0.00 ATOM 7 N ASP 3 17.933 32.996 36.074 1.00 0.00 ATOM 8 CA ASP 3 17.825 31.590 35.695 1.00 0.00 ATOM 9 CB ASP 3 16.416 31.295 35.143 1.00 0.00 ATOM 10 CG ASP 3 16.042 29.803 35.209 1.00 0.00 ATOM 11 OD1 ASP 3 16.834 28.950 34.717 1.00 0.00 ATOM 12 OD2 ASP 3 14.938 29.496 35.738 1.00 0.00 ATOM 13 O ASP 3 19.899 30.622 34.906 1.00 0.00 ATOM 14 C ASP 3 18.903 31.319 34.641 1.00 0.00 ATOM 15 N ASN 4 18.722 31.921 33.466 1.00 0.00 ATOM 16 CA ASN 4 19.695 31.838 32.387 1.00 0.00 ATOM 17 CB ASN 4 19.089 32.379 31.102 1.00 0.00 ATOM 18 CG ASN 4 17.997 31.485 30.552 1.00 0.00 ATOM 19 ND2 ASN 4 17.992 30.212 30.954 1.00 0.00 ATOM 20 OD1 ASN 4 17.173 31.932 29.762 1.00 0.00 ATOM 21 O ASN 4 22.033 32.250 32.051 1.00 0.00 ATOM 22 C ASN 4 21.020 32.541 32.689 1.00 0.00 ATOM 23 N SER 5 21.015 33.439 33.676 1.00 0.00 ATOM 24 CA SER 5 22.206 34.222 34.043 1.00 0.00 ATOM 25 CB SER 5 21.839 35.340 35.013 1.00 0.00 ATOM 26 OG SER 5 21.475 34.818 36.277 1.00 0.00 ATOM 27 O SER 5 24.487 33.813 34.655 1.00 0.00 ATOM 28 C SER 5 23.343 33.369 34.597 1.00 0.00 ATOM 29 N LYS 6 23.002 32.135 34.963 1.00 0.00 ATOM 30 CA LYS 6 23.968 31.126 35.384 1.00 0.00 ATOM 31 CB LYS 6 23.350 30.197 36.444 1.00 0.00 ATOM 32 CG LYS 6 23.474 30.780 37.865 1.00 0.00 ATOM 33 CD LYS 6 23.042 29.819 38.993 1.00 0.00 ATOM 34 CE LYS 6 21.512 29.808 39.167 1.00 0.00 ATOM 35 NZ LYS 6 21.145 29.545 40.607 1.00 0.00 ATOM 36 O LYS 6 25.463 29.505 34.447 1.00 0.00 ATOM 37 C LYS 6 24.556 30.308 34.234 1.00 0.00 ATOM 38 N THR 7 24.030 30.509 33.026 1.00 0.00 ATOM 39 CA THR 7 24.521 29.843 31.839 1.00 0.00 ATOM 40 CB THR 7 23.368 29.255 31.018 1.00 0.00 ATOM 41 CG2 THR 7 23.866 28.501 29.823 1.00 0.00 ATOM 42 OG1 THR 7 22.658 28.328 31.832 1.00 0.00 ATOM 43 O THR 7 24.806 31.833 30.533 1.00 0.00 ATOM 44 C THR 7 25.333 30.829 31.012 1.00 0.00 ATOM 45 N ARG 8 26.624 30.536 30.875 1.00 0.00 ATOM 46 CA ARG 8 27.495 31.336 30.028 1.00 0.00 ATOM 47 CB ARG 8 28.941 31.392 30.568 1.00 0.00 ATOM 48 CG ARG 8 29.854 32.214 29.663 1.00 0.00 ATOM 49 CD ARG 8 31.142 32.589 30.351 1.00 0.00 ATOM 50 NE ARG 8 30.914 33.372 31.556 1.00 0.00 ATOM 51 CZ ARG 8 31.770 33.412 32.575 1.00 0.00 ATOM 52 NH1 ARG 8 32.907 32.734 32.526 1.00 0.00 ATOM 53 NH2 ARG 8 31.485 34.125 33.647 1.00 0.00 ATOM 54 O ARG 8 27.813 29.633 28.366 1.00 0.00 ATOM 55 C ARG 8 27.496 30.801 28.602 1.00 0.00 ATOM 56 N VAL 9 27.167 31.679 27.662 1.00 0.00 ATOM 57 CA VAL 9 27.149 31.355 26.240 1.00 0.00 ATOM 58 CB VAL 9 25.737 31.606 25.626 1.00 0.00 ATOM 59 CG1 VAL 9 25.696 31.225 24.147 1.00 0.00 ATOM 60 CG2 VAL 9 24.676 30.826 26.407 1.00 0.00 ATOM 61 O VAL 9 28.116 33.474 25.640 1.00 0.00 ATOM 62 C VAL 9 28.166 32.239 25.535 1.00 0.00 ATOM 63 N VAL 10 29.117 31.608 24.855 1.00 0.00 ATOM 64 CA VAL 10 30.018 32.349 24.000 1.00 0.00 ATOM 65 CB VAL 10 31.463 31.826 24.076 1.00 0.00 ATOM 66 CG1 VAL 10 32.317 32.490 23.011 1.00 0.00 ATOM 67 CG2 VAL 10 32.038 32.079 25.466 1.00 0.00 ATOM 68 O VAL 10 29.287 31.257 22.000 1.00 0.00 ATOM 69 C VAL 10 29.478 32.324 22.588 1.00 0.00 ATOM 70 N VAL 11 29.203 33.508 22.051 1.00 0.00 ATOM 71 CA VAL 11 28.679 33.647 20.687 1.00 0.00 ATOM 72 CB VAL 11 27.427 34.643 20.624 1.00 0.00 ATOM 73 CG1 VAL 11 27.689 35.894 21.342 1.00 0.00 ATOM 74 CG2 VAL 11 26.991 34.935 19.183 1.00 0.00 ATOM 75 O VAL 11 30.462 34.990 19.882 1.00 0.00 ATOM 76 C VAL 11 29.756 34.015 19.692 1.00 0.00 ATOM 77 N GLY 12 29.892 33.242 18.625 1.00 0.00 ATOM 78 CA GLY 12 30.701 33.667 17.495 1.00 0.00 ATOM 79 O GLY 12 29.007 34.868 16.311 1.00 0.00 ATOM 80 C GLY 12 30.112 34.907 16.841 1.00 0.00 ATOM 81 N MET 13 30.832 36.012 16.906 1.00 0.00 ATOM 82 CA MET 13 30.417 37.232 16.241 1.00 0.00 ATOM 83 CB MET 13 30.339 38.392 17.253 1.00 0.00 ATOM 84 CG MET 13 29.098 38.289 18.179 1.00 0.00 ATOM 85 SD MET 13 29.066 39.705 19.469 1.00 0.00 ATOM 86 CE MET 13 28.117 41.014 18.402 1.00 0.00 ATOM 87 O MET 13 32.513 37.898 15.195 1.00 0.00 ATOM 88 C MET 13 31.313 37.576 15.045 1.00 0.00 ATOM 89 N SER 14 30.719 37.532 13.856 1.00 0.00 ATOM 90 CA SER 14 31.459 37.756 12.629 1.00 0.00 ATOM 91 CB SER 14 30.869 36.904 11.526 1.00 0.00 ATOM 92 OG SER 14 29.542 37.331 11.289 1.00 0.00 ATOM 93 O SER 14 32.263 39.586 11.341 1.00 0.00 ATOM 94 C SER 14 31.458 39.207 12.181 1.00 0.00 ATOM 95 N GLY 15 30.555 40.010 12.733 1.00 0.00 ATOM 96 CA GLY 15 30.322 41.366 12.261 1.00 0.00 ATOM 97 O GLY 15 28.690 42.527 10.974 1.00 0.00 ATOM 98 C GLY 15 29.095 41.443 11.362 1.00 0.00 ATOM 99 N GLY 16 28.498 40.300 11.041 1.00 0.00 ATOM 100 CA GLY 16 27.277 40.241 10.226 1.00 0.00 ATOM 101 O GLY 16 25.982 40.457 12.241 1.00 0.00 ATOM 102 C GLY 16 25.982 40.420 11.004 1.00 0.00 ATOM 103 N VAL 17 24.860 40.532 10.287 1.00 0.00 ATOM 104 CA VAL 17 23.568 40.747 10.956 1.00 0.00 ATOM 105 CB VAL 17 22.500 41.309 10.000 1.00 0.00 ATOM 106 CG1 VAL 17 22.015 40.207 9.034 1.00 0.00 ATOM 107 CG2 VAL 17 21.342 41.923 10.803 1.00 0.00 ATOM 108 O VAL 17 22.535 39.615 12.799 1.00 0.00 ATOM 109 C VAL 17 23.080 39.501 11.711 1.00 0.00 ATOM 110 N ASP 18 23.339 38.316 11.169 1.00 0.00 ATOM 111 CA ASP 18 22.948 37.075 11.846 1.00 0.00 ATOM 112 CB ASP 18 23.252 35.874 10.942 1.00 0.00 ATOM 113 CG ASP 18 22.513 35.961 9.583 1.00 0.00 ATOM 114 OD1 ASP 18 21.435 36.610 9.503 1.00 0.00 ATOM 115 OD2 ASP 18 23.004 35.387 8.575 1.00 0.00 ATOM 116 O ASP 18 22.818 36.775 14.246 1.00 0.00 ATOM 117 C ASP 18 23.547 36.927 13.254 1.00 0.00 ATOM 118 N SER 19 24.875 37.008 13.350 1.00 0.00 ATOM 119 CA SER 19 25.548 36.896 14.653 1.00 0.00 ATOM 120 CB SER 19 27.073 36.646 14.511 1.00 0.00 ATOM 121 OG SER 19 27.715 37.538 13.611 1.00 0.00 ATOM 122 O SER 19 25.162 37.885 16.799 1.00 0.00 ATOM 123 C SER 19 25.230 38.056 15.585 1.00 0.00 ATOM 124 N SER 20 25.008 39.241 15.029 1.00 0.00 ATOM 125 CA SER 20 24.600 40.388 15.852 1.00 0.00 ATOM 126 CB SER 20 24.495 41.659 15.009 1.00 0.00 ATOM 127 OG SER 20 25.645 41.825 14.164 1.00 0.00 ATOM 128 O SER 20 23.073 40.403 17.679 1.00 0.00 ATOM 129 C SER 20 23.272 40.122 16.495 1.00 0.00 ATOM 130 N VAL 21 22.335 39.586 15.708 1.00 0.00 ATOM 131 CA VAL 21 21.019 39.290 16.237 1.00 0.00 ATOM 132 CB VAL 21 19.973 39.084 15.098 1.00 0.00 ATOM 133 CG1 VAL 21 18.666 38.474 15.644 1.00 0.00 ATOM 134 CG2 VAL 21 19.684 40.425 14.400 1.00 0.00 ATOM 135 O VAL 21 20.416 38.091 18.226 1.00 0.00 ATOM 136 C VAL 21 21.112 38.105 17.214 1.00 0.00 ATOM 137 N THR 22 21.979 37.136 16.918 1.00 0.00 ATOM 138 CA THR 22 22.178 35.955 17.781 1.00 0.00 ATOM 139 CB THR 22 23.262 35.032 17.198 1.00 0.00 ATOM 140 CG2 THR 22 23.568 33.888 18.102 1.00 0.00 ATOM 141 OG1 THR 22 22.808 34.511 15.960 1.00 0.00 ATOM 142 O THR 22 21.950 35.988 20.181 1.00 0.00 ATOM 143 C THR 22 22.571 36.412 19.183 1.00 0.00 ATOM 144 N ALA 23 23.560 37.305 19.254 1.00 0.00 ATOM 145 CA ALA 23 23.972 37.933 20.497 1.00 0.00 ATOM 146 CB ALA 23 25.199 38.844 20.255 1.00 0.00 ATOM 147 O ALA 23 22.698 38.614 22.418 1.00 0.00 ATOM 148 C ALA 23 22.848 38.716 21.205 1.00 0.00 ATOM 149 N LEU 24 22.087 39.526 20.479 1.00 0.00 ATOM 150 CA LEU 24 21.003 40.317 21.086 1.00 0.00 ATOM 151 CB LEU 24 20.359 41.235 20.043 1.00 0.00 ATOM 152 CG LEU 24 18.951 41.829 20.252 1.00 0.00 ATOM 153 CD1 LEU 24 18.966 43.079 21.119 1.00 0.00 ATOM 154 CD2 LEU 24 18.270 42.128 18.888 1.00 0.00 ATOM 155 O LEU 24 19.527 39.590 22.807 1.00 0.00 ATOM 156 C LEU 24 19.951 39.388 21.679 1.00 0.00 ATOM 157 N LEU 25 19.542 38.354 20.938 1.00 0.00 ATOM 158 CA LEU 25 18.507 37.436 21.440 1.00 0.00 ATOM 159 CB LEU 25 18.112 36.398 20.396 1.00 0.00 ATOM 160 CG LEU 25 17.543 37.057 19.162 1.00 0.00 ATOM 161 CD1 LEU 25 17.179 36.000 18.174 1.00 0.00 ATOM 162 CD2 LEU 25 16.339 37.985 19.549 1.00 0.00 ATOM 163 O LEU 25 18.148 36.650 23.667 1.00 0.00 ATOM 164 C LEU 25 18.935 36.735 22.722 1.00 0.00 ATOM 165 N LEU 26 20.191 36.275 22.765 1.00 0.00 ATOM 166 CA LEU 26 20.716 35.614 23.944 1.00 0.00 ATOM 167 CB LEU 26 22.095 35.034 23.666 1.00 0.00 ATOM 168 CG LEU 26 22.194 33.758 22.828 1.00 0.00 ATOM 169 CD1 LEU 26 23.662 33.588 22.460 1.00 0.00 ATOM 170 CD2 LEU 26 21.633 32.534 23.570 1.00 0.00 ATOM 171 O LEU 26 20.594 36.119 26.278 1.00 0.00 ATOM 172 C LEU 26 20.812 36.547 25.134 1.00 0.00 ATOM 173 N LYS 27 21.184 37.802 24.888 1.00 0.00 ATOM 174 CA LYS 27 21.262 38.781 25.967 1.00 0.00 ATOM 175 CB LYS 27 21.871 40.095 25.476 1.00 0.00 ATOM 176 CG LYS 27 21.761 41.280 26.440 1.00 0.00 ATOM 177 CD LYS 27 22.931 41.324 27.386 1.00 0.00 ATOM 178 CE LYS 27 22.727 42.375 28.476 1.00 0.00 ATOM 179 NZ LYS 27 23.527 42.023 29.703 1.00 0.00 ATOM 180 O LYS 27 19.632 38.950 27.709 1.00 0.00 ATOM 181 C LYS 27 19.857 38.996 26.514 1.00 0.00 ATOM 182 N GLU 28 18.905 39.172 25.609 1.00 0.00 ATOM 183 CA GLU 28 17.520 39.471 25.974 1.00 0.00 ATOM 184 CB GLU 28 16.695 39.739 24.709 1.00 0.00 ATOM 185 CG GLU 28 16.802 41.173 24.191 1.00 0.00 ATOM 186 CD GLU 28 15.987 41.404 22.905 1.00 0.00 ATOM 187 OE1 GLU 28 15.931 42.579 22.455 1.00 0.00 ATOM 188 OE2 GLU 28 15.374 40.432 22.354 1.00 0.00 ATOM 189 O GLU 28 16.109 38.632 27.693 1.00 0.00 ATOM 190 C GLU 28 16.906 38.354 26.813 1.00 0.00 ATOM 191 N GLN 29 17.322 37.107 26.553 1.00 0.00 ATOM 192 CA GLN 29 16.871 35.927 27.291 1.00 0.00 ATOM 193 CB GLN 29 17.010 34.674 26.440 1.00 0.00 ATOM 194 CG GLN 29 15.942 34.576 25.344 1.00 0.00 ATOM 195 CD GLN 29 16.117 33.332 24.481 1.00 0.00 ATOM 196 OE1 GLN 29 16.718 33.379 23.380 1.00 0.00 ATOM 197 NE2 GLN 29 15.613 32.196 24.979 1.00 0.00 ATOM 198 O GLN 29 17.387 34.732 29.305 1.00 0.00 ATOM 199 C GLN 29 17.601 35.730 28.612 1.00 0.00 ATOM 200 N GLY 30 18.463 36.678 28.968 1.00 0.00 ATOM 201 CA GLY 30 19.073 36.670 30.272 1.00 0.00 ATOM 202 O GLY 30 20.804 35.601 31.492 1.00 0.00 ATOM 203 C GLY 30 20.321 35.823 30.391 1.00 0.00 ATOM 204 N TYR 31 20.870 35.347 29.286 1.00 0.00 ATOM 205 CA TYR 31 22.114 34.582 29.383 1.00 0.00 ATOM 206 CB TYR 31 22.362 33.816 28.110 1.00 0.00 ATOM 207 CG TYR 31 21.410 32.690 27.897 1.00 0.00 ATOM 208 CD1 TYR 31 21.620 31.477 28.526 1.00 0.00 ATOM 209 CD2 TYR 31 20.312 32.822 27.041 1.00 0.00 ATOM 210 CE1 TYR 31 20.761 30.421 28.337 1.00 0.00 ATOM 211 CE2 TYR 31 19.456 31.769 26.832 1.00 0.00 ATOM 212 CZ TYR 31 19.684 30.569 27.501 1.00 0.00 ATOM 213 OH TYR 31 18.864 29.490 27.341 1.00 0.00 ATOM 214 O TYR 31 23.320 36.675 29.551 1.00 0.00 ATOM 215 C TYR 31 23.337 35.453 29.722 1.00 0.00 ATOM 216 N ASP 32 24.366 34.810 30.258 1.00 0.00 ATOM 217 CA ASP 32 25.657 35.421 30.496 1.00 0.00 ATOM 218 CB ASP 32 26.344 34.614 31.596 1.00 0.00 ATOM 219 CG ASP 32 27.724 35.129 31.971 1.00 0.00 ATOM 220 OD1 ASP 32 28.193 36.172 31.466 1.00 0.00 ATOM 221 OD2 ASP 32 28.359 34.449 32.804 1.00 0.00 ATOM 222 O ASP 32 27.025 34.282 28.862 1.00 0.00 ATOM 223 C ASP 32 26.419 35.317 29.161 1.00 0.00 ATOM 224 N VAL 33 26.375 36.390 28.368 1.00 0.00 ATOM 225 CA VAL 33 26.815 36.356 26.971 1.00 0.00 ATOM 226 CB VAL 33 25.754 36.996 26.044 1.00 0.00 ATOM 227 CG1 VAL 33 26.118 36.788 24.541 1.00 0.00 ATOM 228 CG2 VAL 33 24.379 36.417 26.353 1.00 0.00 ATOM 229 O VAL 33 28.430 38.106 27.225 1.00 0.00 ATOM 230 C VAL 33 28.165 37.011 26.739 1.00 0.00 ATOM 231 N ILE 34 29.044 36.312 26.030 1.00 0.00 ATOM 232 CA ILE 34 30.347 36.882 25.634 1.00 0.00 ATOM 233 CB ILE 34 31.521 36.161 26.316 1.00 0.00 ATOM 234 CG1 ILE 34 31.426 36.279 27.837 1.00 0.00 ATOM 235 CG2 ILE 34 32.919 36.689 25.817 1.00 0.00 ATOM 236 CD1 ILE 34 32.457 35.377 28.543 1.00 0.00 ATOM 237 O ILE 34 30.317 35.669 23.584 1.00 0.00 ATOM 238 C ILE 34 30.464 36.764 24.128 1.00 0.00 ATOM 239 N GLY 35 30.695 37.890 23.448 1.00 0.00 ATOM 240 CA GLY 35 30.891 37.870 21.974 1.00 0.00 ATOM 241 O GLY 35 33.222 38.336 22.213 1.00 0.00 ATOM 242 C GLY 35 32.345 37.688 21.618 1.00 0.00 ATOM 243 N ILE 36 32.631 36.778 20.691 1.00 0.00 ATOM 244 CA ILE 36 34.021 36.549 20.251 1.00 0.00 ATOM 245 CB ILE 36 34.611 35.198 20.736 1.00 0.00 ATOM 246 CG1 ILE 36 34.428 34.996 22.231 1.00 0.00 ATOM 247 CG2 ILE 36 36.129 35.106 20.413 1.00 0.00 ATOM 248 CD1 ILE 36 35.434 35.673 23.054 1.00 0.00 ATOM 249 O ILE 36 33.368 35.904 18.018 1.00 0.00 ATOM 250 C ILE 36 34.132 36.587 18.739 1.00 0.00 ATOM 251 N PHE 37 35.094 37.386 18.274 1.00 0.00 ATOM 252 CA PHE 37 35.414 37.514 16.865 1.00 0.00 ATOM 253 CB PHE 37 35.662 38.991 16.536 1.00 0.00 ATOM 254 CG PHE 37 36.084 39.242 15.097 1.00 0.00 ATOM 255 CD1 PHE 37 35.149 39.263 14.078 1.00 0.00 ATOM 256 CD2 PHE 37 37.420 39.457 14.776 1.00 0.00 ATOM 257 CE1 PHE 37 35.532 39.470 12.781 1.00 0.00 ATOM 258 CE2 PHE 37 37.820 39.682 13.461 1.00 0.00 ATOM 259 CZ PHE 37 36.875 39.684 12.465 1.00 0.00 ATOM 260 O PHE 37 37.687 36.817 17.120 1.00 0.00 ATOM 261 C PHE 37 36.638 36.664 16.514 1.00 0.00 ATOM 262 N MET 38 36.523 35.776 15.528 1.00 0.00 ATOM 263 CA MET 38 37.719 35.059 15.061 1.00 0.00 ATOM 264 CB MET 38 37.410 33.619 14.689 1.00 0.00 ATOM 265 CG MET 38 37.045 32.743 15.848 1.00 0.00 ATOM 266 SD MET 38 36.370 31.080 15.151 1.00 0.00 ATOM 267 CE MET 38 34.481 31.467 14.933 1.00 0.00 ATOM 268 O MET 38 37.690 36.035 12.897 1.00 0.00 ATOM 269 C MET 38 38.361 35.730 13.866 1.00 0.00 ATOM 270 N LYS 39 39.661 35.956 13.934 1.00 0.00 ATOM 271 CA LYS 39 40.412 36.260 12.746 1.00 0.00 ATOM 272 CB LYS 39 41.381 37.415 12.954 1.00 0.00 ATOM 273 CG LYS 39 41.820 38.004 11.626 1.00 0.00 ATOM 274 CD LYS 39 43.009 38.935 11.732 1.00 0.00 ATOM 275 CE LYS 39 43.464 39.308 10.322 1.00 0.00 ATOM 276 NZ LYS 39 44.149 40.634 10.282 1.00 0.00 ATOM 277 O LYS 39 42.080 34.556 12.968 1.00 0.00 ATOM 278 C LYS 39 41.145 35.009 12.312 1.00 0.00 ATOM 279 N ASN 40 40.704 34.455 11.188 1.00 0.00 ATOM 280 CA ASN 40 41.237 33.185 10.683 1.00 0.00 ATOM 281 CB ASN 40 40.113 32.148 10.591 1.00 0.00 ATOM 282 CG ASN 40 39.459 31.894 11.936 1.00 0.00 ATOM 283 ND2 ASN 40 38.238 31.411 11.912 1.00 0.00 ATOM 284 OD1 ASN 40 40.052 32.147 12.985 1.00 0.00 ATOM 285 O ASN 40 42.528 32.323 8.891 1.00 0.00 ATOM 286 C ASN 40 41.959 33.294 9.361 1.00 0.00 ATOM 287 N TRP 41 41.942 34.482 8.773 1.00 0.00 ATOM 288 CA TRP 41 42.579 34.714 7.491 1.00 0.00 ATOM 289 CB TRP 41 41.549 34.557 6.355 1.00 0.00 ATOM 290 CG TRP 41 42.203 34.589 5.022 1.00 0.00 ATOM 291 CD1 TRP 41 42.291 35.653 4.182 1.00 0.00 ATOM 292 CD2 TRP 41 42.917 33.519 4.394 1.00 0.00 ATOM 293 CE2 TRP 41 43.397 34.010 3.160 1.00 0.00 ATOM 294 CE3 TRP 41 43.171 32.184 4.739 1.00 0.00 ATOM 295 NE1 TRP 41 43.002 35.317 3.060 1.00 0.00 ATOM 296 CZ2 TRP 41 44.134 33.219 2.273 1.00 0.00 ATOM 297 CZ3 TRP 41 43.911 31.393 3.859 1.00 0.00 ATOM 298 CH2 TRP 41 44.387 31.917 2.642 1.00 0.00 ATOM 299 O TRP 41 42.626 37.083 7.792 1.00 0.00 ATOM 300 C TRP 41 43.247 36.088 7.453 1.00 0.00 ATOM 301 N ASP 42 44.507 36.137 7.047 1.00 0.00 ATOM 302 CA ASP 42 45.226 37.410 6.909 1.00 0.00 ATOM 303 CB ASP 42 46.675 37.279 7.382 1.00 0.00 ATOM 304 CG ASP 42 47.377 38.635 7.515 1.00 0.00 ATOM 305 OD1 ASP 42 46.708 39.623 7.934 1.00 0.00 ATOM 306 OD2 ASP 42 48.599 38.698 7.202 1.00 0.00 ATOM 307 O ASP 42 45.878 37.465 4.571 1.00 0.00 ATOM 308 C ASP 42 45.180 37.959 5.473 1.00 0.00 ATOM 309 N ASP 43 44.377 39.013 5.303 1.00 0.00 ATOM 310 CA ASP 43 43.952 39.514 3.994 1.00 0.00 ATOM 311 CB ASP 43 42.440 39.275 3.866 1.00 0.00 ATOM 312 CG ASP 43 42.019 38.879 2.458 1.00 0.00 ATOM 313 OD1 ASP 43 40.820 39.063 2.130 1.00 0.00 ATOM 314 OD2 ASP 43 42.874 38.375 1.687 1.00 0.00 ATOM 315 O ASP 43 43.311 41.796 3.522 1.00 0.00 ATOM 316 C ASP 43 44.237 41.016 3.796 1.00 0.00 ATOM 317 N THR 44 45.499 41.422 3.926 1.00 0.00 ATOM 318 CA THR 44 45.841 42.854 3.966 1.00 0.00 ATOM 319 CB THR 44 47.004 43.140 4.999 1.00 0.00 ATOM 320 CG2 THR 44 47.576 44.574 4.886 1.00 0.00 ATOM 321 OG1 THR 44 46.512 42.948 6.334 1.00 0.00 ATOM 322 O THR 44 46.595 42.768 1.662 1.00 0.00 ATOM 323 C THR 44 46.109 43.458 2.569 1.00 0.00 ATOM 324 N ASP 45 45.761 44.743 2.417 1.00 0.00 ATOM 325 CA ASP 45 46.017 45.538 1.199 1.00 0.00 ATOM 326 CB ASP 45 45.304 46.900 1.292 1.00 0.00 ATOM 327 CG ASP 45 43.847 46.849 0.825 1.00 0.00 ATOM 328 OD1 ASP 45 43.224 45.759 0.820 1.00 0.00 ATOM 329 OD2 ASP 45 43.321 47.925 0.466 1.00 0.00 ATOM 330 O ASP 45 47.909 46.731 0.289 1.00 0.00 ATOM 331 C ASP 45 47.511 45.757 0.938 1.00 0.00 ATOM 332 N CYS 50 42.600 43.401 7.678 1.00 0.00 ATOM 333 CA CYS 50 42.087 44.540 6.920 1.00 0.00 ATOM 334 CB CYS 50 42.823 44.684 5.592 1.00 0.00 ATOM 335 SG CYS 50 42.433 46.233 4.719 1.00 0.00 ATOM 336 O CYS 50 39.822 45.346 6.953 1.00 0.00 ATOM 337 C CYS 50 40.588 44.419 6.663 1.00 0.00 ATOM 338 N THR 51 40.176 43.283 6.100 1.00 0.00 ATOM 339 CA THR 51 38.762 42.907 6.061 1.00 0.00 ATOM 340 CB THR 51 38.555 41.609 5.260 1.00 0.00 ATOM 341 CG2 THR 51 37.051 41.366 4.947 1.00 0.00 ATOM 342 OG1 THR 51 39.327 41.664 4.051 1.00 0.00 ATOM 343 O THR 51 37.217 43.145 7.904 1.00 0.00 ATOM 344 C THR 51 38.292 42.678 7.499 1.00 0.00 ATOM 345 N ALA 52 39.126 41.967 8.259 1.00 0.00 ATOM 346 CA ALA 52 38.872 41.644 9.656 1.00 0.00 ATOM 347 CB ALA 52 39.952 40.715 10.186 1.00 0.00 ATOM 348 O ALA 52 38.007 42.894 11.504 1.00 0.00 ATOM 349 C ALA 52 38.755 42.888 10.528 1.00 0.00 ATOM 350 N THR 53 39.486 43.935 10.160 1.00 0.00 ATOM 351 CA THR 53 39.478 45.199 10.885 1.00 0.00 ATOM 352 CB THR 53 40.606 46.171 10.368 1.00 0.00 ATOM 353 CG2 THR 53 40.787 47.395 11.289 1.00 0.00 ATOM 354 OG1 THR 53 41.847 45.459 10.307 1.00 0.00 ATOM 355 O THR 53 37.572 46.194 11.944 1.00 0.00 ATOM 356 C THR 53 38.088 45.852 10.880 1.00 0.00 ATOM 357 N GLU 54 37.467 46.018 9.718 1.00 0.00 ATOM 358 CA GLU 54 36.159 46.688 9.681 1.00 0.00 ATOM 359 CB GLU 54 35.836 47.241 8.282 1.00 0.00 ATOM 360 CG GLU 54 36.099 48.768 8.091 1.00 0.00 ATOM 361 CD GLU 54 37.511 49.247 8.511 1.00 0.00 ATOM 362 OE1 GLU 54 38.529 48.730 7.974 1.00 0.00 ATOM 363 OE2 GLU 54 37.594 50.167 9.369 1.00 0.00 ATOM 364 O GLU 54 34.066 46.373 10.808 1.00 0.00 ATOM 365 C GLU 54 35.017 45.830 10.251 1.00 0.00 ATOM 366 N ASP 55 35.129 44.502 10.134 1.00 0.00 ATOM 367 CA ASP 55 34.165 43.582 10.751 1.00 0.00 ATOM 368 CB ASP 55 34.397 42.157 10.259 1.00 0.00 ATOM 369 CG ASP 55 33.946 41.934 8.817 1.00 0.00 ATOM 370 OD1 ASP 55 33.277 42.811 8.216 1.00 0.00 ATOM 371 OD2 ASP 55 34.262 40.849 8.273 1.00 0.00 ATOM 372 O ASP 55 33.232 43.556 12.962 1.00 0.00 ATOM 373 C ASP 55 34.261 43.594 12.268 1.00 0.00 ATOM 374 N TYR 56 35.488 43.658 12.788 1.00 0.00 ATOM 375 CA TYR 56 35.679 43.776 14.227 1.00 0.00 ATOM 376 CB TYR 56 37.147 43.590 14.629 1.00 0.00 ATOM 377 CG TYR 56 37.375 43.399 16.125 1.00 0.00 ATOM 378 CD1 TYR 56 36.761 42.347 16.817 1.00 0.00 ATOM 379 CD2 TYR 56 38.203 44.271 16.850 1.00 0.00 ATOM 380 CE1 TYR 56 36.942 42.164 18.195 1.00 0.00 ATOM 381 CE2 TYR 56 38.413 44.093 18.231 1.00 0.00 ATOM 382 CZ TYR 56 37.780 43.024 18.897 1.00 0.00 ATOM 383 OH TYR 56 37.964 42.819 20.265 1.00 0.00 ATOM 384 O TYR 56 34.629 45.089 15.919 1.00 0.00 ATOM 385 C TYR 56 35.074 45.069 14.777 1.00 0.00 ATOM 386 N LYS 57 35.054 46.128 13.965 1.00 0.00 ATOM 387 CA LYS 57 34.407 47.401 14.318 1.00 0.00 ATOM 388 CB LYS 57 34.625 48.453 13.215 1.00 0.00 ATOM 389 CG LYS 57 35.722 49.505 13.497 1.00 0.00 ATOM 390 CD LYS 57 37.141 48.908 13.583 1.00 0.00 ATOM 391 CE LYS 57 38.129 49.814 14.362 1.00 0.00 ATOM 392 NZ LYS 57 39.241 50.353 13.521 1.00 0.00 ATOM 393 O LYS 57 32.329 47.724 15.468 1.00 0.00 ATOM 394 C LYS 57 32.919 47.192 14.533 1.00 0.00 ATOM 395 N ASP 58 32.325 46.387 13.668 1.00 0.00 ATOM 396 CA ASP 58 30.914 46.079 13.738 1.00 0.00 ATOM 397 CB ASP 58 30.495 45.418 12.442 1.00 0.00 ATOM 398 CG ASP 58 30.469 46.391 11.293 1.00 0.00 ATOM 399 OD1 ASP 58 30.217 47.594 11.521 1.00 0.00 ATOM 400 OD2 ASP 58 30.693 45.957 10.156 1.00 0.00 ATOM 401 O ASP 58 29.596 45.426 15.613 1.00 0.00 ATOM 402 C ASP 58 30.590 45.195 14.929 1.00 0.00 ATOM 403 N VAL 59 31.445 44.206 15.188 1.00 0.00 ATOM 404 CA VAL 59 31.331 43.398 16.391 1.00 0.00 ATOM 405 CB VAL 59 32.481 42.358 16.509 1.00 0.00 ATOM 406 CG1 VAL 59 32.435 41.631 17.870 1.00 0.00 ATOM 407 CG2 VAL 59 32.413 41.386 15.362 1.00 0.00 ATOM 408 O VAL 59 30.389 44.304 18.359 1.00 0.00 ATOM 409 C VAL 59 31.317 44.339 17.576 1.00 0.00 ATOM 410 N VAL 60 32.309 45.220 17.677 1.00 0.00 ATOM 411 CA VAL 60 32.435 46.164 18.817 1.00 0.00 ATOM 412 CB VAL 60 33.769 47.030 18.733 1.00 0.00 ATOM 413 CG1 VAL 60 33.823 48.110 19.796 1.00 0.00 ATOM 414 CG2 VAL 60 35.022 46.148 18.809 1.00 0.00 ATOM 415 O VAL 60 30.629 47.212 20.003 1.00 0.00 ATOM 416 C VAL 60 31.200 47.082 18.935 1.00 0.00 ATOM 417 N ALA 61 30.804 47.725 17.843 1.00 0.00 ATOM 418 CA ALA 61 29.637 48.596 17.842 1.00 0.00 ATOM 419 CB ALA 61 29.396 49.158 16.453 1.00 0.00 ATOM 420 O ALA 61 27.658 48.365 19.157 1.00 0.00 ATOM 421 C ALA 61 28.401 47.846 18.339 1.00 0.00 ATOM 422 N VAL 62 28.220 46.603 17.904 1.00 0.00 ATOM 423 CA VAL 62 27.036 45.835 18.308 1.00 0.00 ATOM 424 CB VAL 62 26.697 44.679 17.309 1.00 0.00 ATOM 425 CG1 VAL 62 25.682 43.701 17.907 1.00 0.00 ATOM 426 CG2 VAL 62 26.158 45.281 16.022 1.00 0.00 ATOM 427 O VAL 62 26.159 45.540 20.515 1.00 0.00 ATOM 428 C VAL 62 27.111 45.369 19.756 1.00 0.00 ATOM 429 N ALA 63 28.254 44.826 20.145 1.00 0.00 ATOM 430 CA ALA 63 28.477 44.373 21.493 1.00 0.00 ATOM 431 CB ALA 63 29.862 43.825 21.596 1.00 0.00 ATOM 432 O ALA 63 27.697 45.325 23.564 1.00 0.00 ATOM 433 C ALA 63 28.260 45.525 22.472 1.00 0.00 ATOM 434 N ASP 64 28.682 46.733 22.092 1.00 0.00 ATOM 435 CA ASP 64 28.426 47.899 22.927 1.00 0.00 ATOM 436 CB ASP 64 29.316 49.075 22.525 1.00 0.00 ATOM 437 CG ASP 64 30.761 48.941 23.035 1.00 0.00 ATOM 438 OD1 ASP 64 31.029 48.144 23.972 1.00 0.00 ATOM 439 OD2 ASP 64 31.636 49.666 22.492 1.00 0.00 ATOM 440 O ASP 64 26.472 48.751 23.981 1.00 0.00 ATOM 441 C ASP 64 26.951 48.331 22.948 1.00 0.00 ATOM 442 N GLN 65 26.271 48.208 21.805 1.00 0.00 ATOM 443 CA GLN 65 24.855 48.573 21.644 1.00 0.00 ATOM 444 CB GLN 65 24.409 48.450 20.164 1.00 0.00 ATOM 445 CG GLN 65 24.985 49.552 19.247 1.00 0.00 ATOM 446 CD GLN 65 24.586 49.465 17.759 1.00 0.00 ATOM 447 OE1 GLN 65 24.722 48.423 17.099 1.00 0.00 ATOM 448 NE2 GLN 65 24.139 50.602 17.218 1.00 0.00 ATOM 449 O GLN 65 23.037 48.215 23.171 1.00 0.00 ATOM 450 C GLN 65 23.970 47.715 22.550 1.00 0.00 ATOM 451 N ILE 66 24.287 46.426 22.636 1.00 0.00 ATOM 452 CA ILE 66 23.550 45.510 23.493 1.00 0.00 ATOM 453 CB ILE 66 23.249 44.183 22.784 1.00 0.00 ATOM 454 CG1 ILE 66 24.401 43.210 22.914 1.00 0.00 ATOM 455 CG2 ILE 66 22.931 44.444 21.317 1.00 0.00 ATOM 456 CD1 ILE 66 24.347 42.089 21.937 1.00 0.00 ATOM 457 O ILE 66 23.544 44.748 25.771 1.00 0.00 ATOM 458 C ILE 66 24.169 45.325 24.882 1.00 0.00 ATOM 459 N GLY 67 25.375 45.841 25.083 1.00 0.00 ATOM 460 CA GLY 67 25.998 45.766 26.395 1.00 0.00 ATOM 461 O GLY 67 26.090 43.848 27.825 1.00 0.00 ATOM 462 C GLY 67 26.457 44.367 26.773 1.00 0.00 ATOM 463 N ILE 68 27.250 43.749 25.907 1.00 0.00 ATOM 464 CA ILE 68 27.966 42.520 26.264 1.00 0.00 ATOM 465 CB ILE 68 27.474 41.271 25.458 1.00 0.00 ATOM 466 CG1 ILE 68 27.601 41.479 23.934 1.00 0.00 ATOM 467 CG2 ILE 68 26.055 40.886 25.864 1.00 0.00 ATOM 468 CD1 ILE 68 27.732 40.191 23.153 1.00 0.00 ATOM 469 O ILE 68 29.973 43.550 25.393 1.00 0.00 ATOM 470 C ILE 68 29.493 42.685 26.134 1.00 0.00 ATOM 471 N PRO 69 30.266 41.884 26.892 1.00 0.00 ATOM 472 CA PRO 69 31.704 41.890 26.572 1.00 0.00 ATOM 473 CB PRO 69 32.351 41.113 27.722 1.00 0.00 ATOM 474 CG PRO 69 31.265 40.378 28.390 1.00 0.00 ATOM 475 CD PRO 69 29.932 41.017 28.039 1.00 0.00 ATOM 476 O PRO 69 31.242 40.418 24.705 1.00 0.00 ATOM 477 C PRO 69 32.009 41.252 25.212 1.00 0.00 ATOM 478 N TYR 70 33.104 41.697 24.603 1.00 0.00 ATOM 479 CA TYR 70 33.572 41.161 23.338 1.00 0.00 ATOM 480 CB TYR 70 33.223 42.134 22.200 1.00 0.00 ATOM 481 CG TYR 70 33.878 43.479 22.354 1.00 0.00 ATOM 482 CD1 TYR 70 35.174 43.695 21.882 1.00 0.00 ATOM 483 CD2 TYR 70 33.236 44.524 23.008 1.00 0.00 ATOM 484 CE1 TYR 70 35.806 44.904 22.046 1.00 0.00 ATOM 485 CE2 TYR 70 33.875 45.773 23.184 1.00 0.00 ATOM 486 CZ TYR 70 35.156 45.943 22.678 1.00 0.00 ATOM 487 OH TYR 70 35.831 47.139 22.820 1.00 0.00 ATOM 488 O TYR 70 35.833 41.677 24.066 1.00 0.00 ATOM 489 C TYR 70 35.103 40.930 23.413 1.00 0.00 ATOM 490 N TYR 71 35.571 39.874 22.761 1.00 0.00 ATOM 491 CA TYR 71 36.996 39.620 22.627 1.00 0.00 ATOM 492 CB TYR 71 37.496 38.588 23.656 1.00 0.00 ATOM 493 CG TYR 71 37.182 39.008 25.069 1.00 0.00 ATOM 494 CD1 TYR 71 38.011 39.922 25.757 1.00 0.00 ATOM 495 CD2 TYR 71 36.041 38.532 25.711 1.00 0.00 ATOM 496 CE1 TYR 71 37.707 40.341 27.037 1.00 0.00 ATOM 497 CE2 TYR 71 35.716 38.948 27.002 1.00 0.00 ATOM 498 CZ TYR 71 36.545 39.844 27.659 1.00 0.00 ATOM 499 OH TYR 71 36.215 40.235 28.938 1.00 0.00 ATOM 500 O TYR 71 36.346 38.972 20.425 1.00 0.00 ATOM 501 C TYR 71 37.265 39.161 21.216 1.00 0.00 ATOM 502 N SER 72 38.536 38.936 20.934 1.00 0.00 ATOM 503 CA SER 72 39.028 38.724 19.593 1.00 0.00 ATOM 504 CB SER 72 39.723 40.015 19.163 1.00 0.00 ATOM 505 OG SER 72 40.053 39.976 17.813 1.00 0.00 ATOM 506 O SER 72 41.053 37.793 20.452 1.00 0.00 ATOM 507 C SER 72 40.078 37.639 19.697 1.00 0.00 ATOM 508 N VAL 73 39.897 36.544 18.975 1.00 0.00 ATOM 509 CA VAL 73 40.911 35.496 18.955 1.00 0.00 ATOM 510 CB VAL 73 40.420 34.224 19.708 1.00 0.00 ATOM 511 CG1 VAL 73 39.294 33.517 18.947 1.00 0.00 ATOM 512 CG2 VAL 73 41.599 33.268 19.994 1.00 0.00 ATOM 513 O VAL 73 40.639 35.311 16.563 1.00 0.00 ATOM 514 C VAL 73 41.392 35.179 17.511 1.00 0.00 ATOM 515 N ASN 74 42.637 34.763 17.368 1.00 0.00 ATOM 516 CA ASN 74 43.233 34.486 16.076 1.00 0.00 ATOM 517 CB ASN 74 44.541 35.270 15.962 1.00 0.00 ATOM 518 CG ASN 74 45.079 35.295 14.566 1.00 0.00 ATOM 519 ND2 ASN 74 45.168 36.488 13.994 1.00 0.00 ATOM 520 OD1 ASN 74 45.410 34.256 13.997 1.00 0.00 ATOM 521 O ASN 74 44.311 32.418 16.597 1.00 0.00 ATOM 522 C ASN 74 43.523 32.992 15.872 1.00 0.00 ATOM 523 N PHE 75 42.880 32.379 14.885 1.00 0.00 ATOM 524 CA PHE 75 43.066 30.967 14.558 1.00 0.00 ATOM 525 CB PHE 75 41.733 30.192 14.699 1.00 0.00 ATOM 526 CG PHE 75 41.227 30.072 16.111 1.00 0.00 ATOM 527 CD1 PHE 75 42.080 29.713 17.152 1.00 0.00 ATOM 528 CD2 PHE 75 39.881 30.274 16.397 1.00 0.00 ATOM 529 CE1 PHE 75 41.603 29.596 18.461 1.00 0.00 ATOM 530 CE2 PHE 75 39.396 30.152 17.705 1.00 0.00 ATOM 531 CZ PHE 75 40.247 29.827 18.728 1.00 0.00 ATOM 532 O PHE 75 43.268 29.810 12.453 1.00 0.00 ATOM 533 C PHE 75 43.578 30.806 13.120 1.00 0.00 ATOM 534 N GLU 76 44.331 31.797 12.637 1.00 0.00 ATOM 535 CA GLU 76 44.935 31.742 11.299 1.00 0.00 ATOM 536 CB GLU 76 45.899 32.903 11.055 1.00 0.00 ATOM 537 CG GLU 76 45.206 34.201 10.709 1.00 0.00 ATOM 538 CD GLU 76 46.154 35.378 10.703 1.00 0.00 ATOM 539 OE1 GLU 76 45.697 36.495 11.016 1.00 0.00 ATOM 540 OE2 GLU 76 47.356 35.202 10.397 1.00 0.00 ATOM 541 O GLU 76 45.530 29.835 10.047 1.00 0.00 ATOM 542 C GLU 76 45.676 30.452 11.088 1.00 0.00 ATOM 543 N LYS 77 46.465 30.039 12.078 1.00 0.00 ATOM 544 CA LYS 77 47.254 28.818 11.930 1.00 0.00 ATOM 545 CB LYS 77 48.177 28.603 13.124 1.00 0.00 ATOM 546 CG LYS 77 49.254 27.566 12.884 1.00 0.00 ATOM 547 CD LYS 77 49.672 26.916 14.200 1.00 0.00 ATOM 548 CE LYS 77 51.098 26.354 14.153 1.00 0.00 ATOM 549 NZ LYS 77 51.297 25.427 13.006 1.00 0.00 ATOM 550 O LYS 77 46.512 26.859 10.759 1.00 0.00 ATOM 551 C LYS 77 46.349 27.601 11.726 1.00 0.00 ATOM 552 N GLU 78 45.401 27.423 12.640 1.00 0.00 ATOM 553 CA GLU 78 44.527 26.272 12.676 1.00 0.00 ATOM 554 CB GLU 78 43.612 26.363 13.896 1.00 0.00 ATOM 555 CG GLU 78 44.305 26.126 15.240 1.00 0.00 ATOM 556 CD GLU 78 44.868 27.395 15.891 1.00 0.00 ATOM 557 OE1 GLU 78 45.092 28.433 15.209 1.00 0.00 ATOM 558 OE2 GLU 78 45.109 27.337 17.120 1.00 0.00 ATOM 559 O GLU 78 43.473 25.156 10.840 1.00 0.00 ATOM 560 C GLU 78 43.685 26.226 11.420 1.00 0.00 ATOM 561 N TYR 79 43.193 27.396 11.013 1.00 0.00 ATOM 562 CA TYR 79 42.380 27.507 9.833 1.00 0.00 ATOM 563 CB TYR 79 41.814 28.912 9.682 1.00 0.00 ATOM 564 CG TYR 79 40.911 28.987 8.496 1.00 0.00 ATOM 565 CD1 TYR 79 39.527 28.829 8.641 1.00 0.00 ATOM 566 CD2 TYR 79 41.432 29.176 7.210 1.00 0.00 ATOM 567 CE1 TYR 79 38.696 28.869 7.543 1.00 0.00 ATOM 568 CE2 TYR 79 40.606 29.213 6.096 1.00 0.00 ATOM 569 CZ TYR 79 39.246 29.055 6.273 1.00 0.00 ATOM 570 OH TYR 79 38.420 29.090 5.176 1.00 0.00 ATOM 571 O TYR 79 42.721 26.376 7.732 1.00 0.00 ATOM 572 C TYR 79 43.194 27.130 8.597 1.00 0.00 ATOM 573 N TRP 80 44.402 27.681 8.503 1.00 0.00 ATOM 574 CA TRP 80 45.290 27.345 7.412 1.00 0.00 ATOM 575 CB TRP 80 46.645 28.044 7.544 1.00 0.00 ATOM 576 CG TRP 80 47.522 27.691 6.401 1.00 0.00 ATOM 577 CD1 TRP 80 48.310 26.576 6.279 1.00 0.00 ATOM 578 CD2 TRP 80 47.662 28.422 5.180 1.00 0.00 ATOM 579 CE2 TRP 80 48.560 27.698 4.364 1.00 0.00 ATOM 580 CE3 TRP 80 47.119 29.623 4.696 1.00 0.00 ATOM 581 NE1 TRP 80 48.928 26.575 5.058 1.00 0.00 ATOM 582 CZ2 TRP 80 48.935 28.137 3.088 1.00 0.00 ATOM 583 CZ3 TRP 80 47.485 30.059 3.431 1.00 0.00 ATOM 584 CH2 TRP 80 48.391 29.317 2.641 1.00 0.00 ATOM 585 O TRP 80 45.316 25.225 6.313 1.00 0.00 ATOM 586 C TRP 80 45.501 25.839 7.363 1.00 0.00 ATOM 587 N ASP 81 45.885 25.263 8.504 1.00 0.00 ATOM 588 CA ASP 81 46.256 23.858 8.613 1.00 0.00 ATOM 589 CB ASP 81 46.904 23.595 9.969 1.00 0.00 ATOM 590 CG ASP 81 48.346 24.079 10.040 1.00 0.00 ATOM 591 OD1 ASP 81 48.939 24.421 8.984 1.00 0.00 ATOM 592 OD2 ASP 81 48.893 24.085 11.163 1.00 0.00 ATOM 593 O ASP 81 45.296 21.792 7.882 1.00 0.00 ATOM 594 C ASP 81 45.105 22.875 8.428 1.00 0.00 ATOM 595 N ARG 82 43.919 23.239 8.890 1.00 0.00 ATOM 596 CA ARG 82 42.817 22.291 8.951 1.00 0.00 ATOM 597 CB ARG 82 42.201 22.290 10.352 1.00 0.00 ATOM 598 CG ARG 82 43.037 21.603 11.424 1.00 0.00 ATOM 599 CD ARG 82 42.216 21.480 12.693 1.00 0.00 ATOM 600 NE ARG 82 42.975 21.946 13.865 1.00 0.00 ATOM 601 CZ ARG 82 42.439 22.511 14.949 1.00 0.00 ATOM 602 NH1 ARG 82 41.126 22.682 15.056 1.00 0.00 ATOM 603 NH2 ARG 82 43.231 22.910 15.936 1.00 0.00 ATOM 604 O ARG 82 40.912 21.686 7.615 1.00 0.00 ATOM 605 C ARG 82 41.741 22.564 7.906 1.00 0.00 ATOM 606 N VAL 83 41.745 23.774 7.345 1.00 0.00 ATOM 607 CA VAL 83 40.756 24.134 6.336 1.00 0.00 ATOM 608 CB VAL 83 39.771 25.277 6.813 1.00 0.00 ATOM 609 CG1 VAL 83 38.652 25.480 5.807 1.00 0.00 ATOM 610 CG2 VAL 83 39.178 24.919 8.130 1.00 0.00 ATOM 611 O VAL 83 41.080 23.849 3.990 1.00 0.00 ATOM 612 C VAL 83 41.418 24.451 4.998 1.00 0.00 ATOM 613 N PHE 84 42.370 25.379 4.997 1.00 0.00 ATOM 614 CA PHE 84 42.955 25.834 3.746 1.00 0.00 ATOM 615 CB PHE 84 43.692 27.166 3.870 1.00 0.00 ATOM 616 CG PHE 84 43.890 27.841 2.544 1.00 0.00 ATOM 617 CD1 PHE 84 42.804 28.377 1.856 1.00 0.00 ATOM 618 CD2 PHE 84 45.145 27.893 1.952 1.00 0.00 ATOM 619 CE1 PHE 84 42.975 28.987 0.618 1.00 0.00 ATOM 620 CE2 PHE 84 45.317 28.514 0.734 1.00 0.00 ATOM 621 CZ PHE 84 44.227 29.056 0.069 1.00 0.00 ATOM 622 O PHE 84 43.784 24.697 1.822 1.00 0.00 ATOM 623 C PHE 84 43.829 24.800 3.048 1.00 0.00 ATOM 624 N GLU 85 44.623 24.055 3.812 1.00 0.00 ATOM 625 CA GLU 85 45.335 22.923 3.243 1.00 0.00 ATOM 626 CB GLU 85 46.329 22.322 4.220 1.00 0.00 ATOM 627 CG GLU 85 47.427 23.284 4.652 1.00 0.00 ATOM 628 CD GLU 85 48.564 23.462 3.651 1.00 0.00 ATOM 629 OE1 GLU 85 48.393 23.244 2.427 1.00 0.00 ATOM 630 OE2 GLU 85 49.662 23.843 4.105 1.00 0.00 ATOM 631 O GLU 85 44.612 21.316 1.651 1.00 0.00 ATOM 632 C GLU 85 44.372 21.864 2.720 1.00 0.00 ATOM 633 N TYR 86 43.266 21.606 3.427 1.00 0.00 ATOM 634 CA TYR 86 42.258 20.690 2.907 1.00 0.00 ATOM 635 CB TYR 86 41.134 20.418 3.952 1.00 0.00 ATOM 636 CG TYR 86 39.758 20.204 3.319 1.00 0.00 ATOM 637 CD1 TYR 86 39.331 18.927 2.928 1.00 0.00 ATOM 638 CD2 TYR 86 38.914 21.293 3.050 1.00 0.00 ATOM 639 CE1 TYR 86 38.098 18.744 2.311 1.00 0.00 ATOM 640 CE2 TYR 86 37.718 21.121 2.419 1.00 0.00 ATOM 641 CZ TYR 86 37.309 19.841 2.060 1.00 0.00 ATOM 642 OH TYR 86 36.084 19.676 1.430 1.00 0.00 ATOM 643 O TYR 86 41.645 20.456 0.556 1.00 0.00 ATOM 644 C TYR 86 41.735 21.204 1.532 1.00 0.00 ATOM 645 N PHE 87 41.420 22.492 1.481 1.00 0.00 ATOM 646 CA PHE 87 40.885 23.185 0.313 1.00 0.00 ATOM 647 CB PHE 87 40.745 24.667 0.690 1.00 0.00 ATOM 648 CG PHE 87 40.233 25.573 -0.407 1.00 0.00 ATOM 649 CD1 PHE 87 38.869 25.658 -0.687 1.00 0.00 ATOM 650 CD2 PHE 87 41.107 26.402 -1.105 1.00 0.00 ATOM 651 CE1 PHE 87 38.391 26.518 -1.676 1.00 0.00 ATOM 652 CE2 PHE 87 40.646 27.271 -2.101 1.00 0.00 ATOM 653 CZ PHE 87 39.283 27.324 -2.386 1.00 0.00 ATOM 654 O PHE 87 41.406 22.505 -1.946 1.00 0.00 ATOM 655 C PHE 87 41.830 22.969 -0.884 1.00 0.00 ATOM 656 N LEU 88 43.115 23.270 -0.688 1.00 0.00 ATOM 657 CA LEU 88 44.132 23.098 -1.715 1.00 0.00 ATOM 658 CB LEU 88 45.463 23.713 -1.277 1.00 0.00 ATOM 659 CG LEU 88 45.526 25.232 -1.071 1.00 0.00 ATOM 660 CD1 LEU 88 46.977 25.661 -0.812 1.00 0.00 ATOM 661 CD2 LEU 88 44.929 26.030 -2.228 1.00 0.00 ATOM 662 O LEU 88 44.435 21.338 -3.300 1.00 0.00 ATOM 663 C LEU 88 44.325 21.645 -2.114 1.00 0.00 ATOM 664 N ALA 89 44.359 20.751 -1.131 1.00 0.00 ATOM 665 CA ALA 89 44.594 19.343 -1.420 1.00 0.00 ATOM 666 CB ALA 89 44.873 18.550 -0.168 1.00 0.00 ATOM 667 O ALA 89 43.649 17.898 -3.070 1.00 0.00 ATOM 668 C ALA 89 43.432 18.759 -2.214 1.00 0.00 ATOM 669 N GLU 90 42.217 19.254 -1.995 1.00 0.00 ATOM 670 CA GLU 90 41.081 18.823 -2.812 1.00 0.00 ATOM 671 CB GLU 90 39.739 19.383 -2.283 1.00 0.00 ATOM 672 CG GLU 90 39.290 18.706 -0.976 1.00 0.00 ATOM 673 CD GLU 90 39.095 17.215 -1.166 1.00 0.00 ATOM 674 OE1 GLU 90 38.011 16.818 -1.623 1.00 0.00 ATOM 675 OE2 GLU 90 40.034 16.438 -0.910 1.00 0.00 ATOM 676 O GLU 90 41.097 18.268 -5.169 1.00 0.00 ATOM 677 C GLU 90 41.270 19.139 -4.298 1.00 0.00 ATOM 678 N TYR 91 41.644 20.383 -4.567 1.00 0.00 ATOM 679 CA TYR 91 41.925 20.815 -5.922 1.00 0.00 ATOM 680 CB TYR 91 42.192 22.316 -5.977 1.00 0.00 ATOM 681 CG TYR 91 40.927 23.141 -5.880 1.00 0.00 ATOM 682 CD1 TYR 91 39.915 23.014 -6.830 1.00 0.00 ATOM 683 CD2 TYR 91 40.737 24.047 -4.837 1.00 0.00 ATOM 684 CE1 TYR 91 38.750 23.763 -6.756 1.00 0.00 ATOM 685 CE2 TYR 91 39.555 24.811 -4.746 1.00 0.00 ATOM 686 CZ TYR 91 38.576 24.667 -5.710 1.00 0.00 ATOM 687 OH TYR 91 37.431 25.421 -5.633 1.00 0.00 ATOM 688 O TYR 91 42.921 19.647 -7.724 1.00 0.00 ATOM 689 C TYR 91 43.041 20.015 -6.563 1.00 0.00 ATOM 690 N ARG 92 44.098 19.713 -5.805 1.00 0.00 ATOM 691 CA ARG 92 45.211 18.936 -6.337 1.00 0.00 ATOM 692 CB ARG 92 46.383 18.857 -5.357 1.00 0.00 ATOM 693 CG ARG 92 47.189 20.130 -5.338 1.00 0.00 ATOM 694 CD ARG 92 48.535 20.013 -4.614 1.00 0.00 ATOM 695 NE ARG 92 48.373 20.183 -3.173 1.00 0.00 ATOM 696 CZ ARG 92 48.638 21.291 -2.483 1.00 0.00 ATOM 697 NH1 ARG 92 49.111 22.389 -3.061 1.00 0.00 ATOM 698 NH2 ARG 92 48.440 21.276 -1.185 1.00 0.00 ATOM 699 O ARG 92 45.283 16.974 -7.678 1.00 0.00 ATOM 700 C ARG 92 44.744 17.553 -6.740 1.00 0.00 ATOM 701 N ALA 93 43.720 17.048 -6.050 1.00 0.00 ATOM 702 CA ALA 93 43.213 15.686 -6.270 1.00 0.00 ATOM 703 CB ALA 93 42.723 15.078 -4.962 1.00 0.00 ATOM 704 O ALA 93 41.616 14.537 -7.629 1.00 0.00 ATOM 705 C ALA 93 42.119 15.622 -7.334 1.00 0.00 ATOM 706 N GLY 94 41.754 16.781 -7.891 1.00 0.00 ATOM 707 CA GLY 94 40.729 16.882 -8.909 1.00 0.00 ATOM 708 O GLY 94 38.339 16.781 -9.078 1.00 0.00 ATOM 709 C GLY 94 39.329 16.960 -8.356 1.00 0.00 ATOM 710 N ARG 95 39.214 17.238 -7.065 1.00 0.00 ATOM 711 CA ARG 95 37.902 17.307 -6.495 1.00 0.00 ATOM 712 CB ARG 95 37.830 16.425 -5.261 1.00 0.00 ATOM 713 CG ARG 95 38.155 14.960 -5.538 1.00 0.00 ATOM 714 CD ARG 95 37.805 14.050 -4.349 1.00 0.00 ATOM 715 NE ARG 95 38.724 14.275 -3.229 1.00 0.00 ATOM 716 CZ ARG 95 39.881 13.630 -3.067 1.00 0.00 ATOM 717 NH1 ARG 95 40.252 12.679 -3.931 1.00 0.00 ATOM 718 NH2 ARG 95 40.665 13.927 -2.034 1.00 0.00 ATOM 719 O ARG 95 38.273 19.680 -6.443 1.00 0.00 ATOM 720 C ARG 95 37.488 18.758 -6.249 1.00 0.00 ATOM 721 N THR 96 36.228 18.953 -5.881 1.00 0.00 ATOM 722 CA THR 96 35.708 20.276 -5.514 1.00 0.00 ATOM 723 CB THR 96 34.470 20.636 -6.320 1.00 0.00 ATOM 724 CG2 THR 96 33.929 22.040 -5.947 1.00 0.00 ATOM 725 OG1 THR 96 34.835 20.667 -7.702 1.00 0.00 ATOM 726 O THR 96 34.498 19.661 -3.522 1.00 0.00 ATOM 727 C THR 96 35.428 20.326 -4.011 1.00 0.00 ATOM 728 N PRO 97 36.237 21.113 -3.272 1.00 0.00 ATOM 729 CA PRO 97 36.100 21.200 -1.819 1.00 0.00 ATOM 730 CB PRO 97 37.366 21.951 -1.387 1.00 0.00 ATOM 731 CG PRO 97 37.697 22.791 -2.539 1.00 0.00 ATOM 732 CD PRO 97 37.303 21.998 -3.775 1.00 0.00 ATOM 733 O PRO 97 34.249 22.762 -2.071 1.00 0.00 ATOM 734 C PRO 97 34.849 21.958 -1.339 1.00 0.00 ATOM 735 N ASN 98 34.475 21.650 -0.098 1.00 0.00 ATOM 736 CA ASN 98 33.525 22.413 0.699 1.00 0.00 ATOM 737 CB ASN 98 32.323 21.563 1.056 1.00 0.00 ATOM 738 CG ASN 98 31.153 22.395 1.500 1.00 0.00 ATOM 739 ND2 ASN 98 29.979 22.093 0.960 1.00 0.00 ATOM 740 OD1 ASN 98 31.293 23.287 2.344 1.00 0.00 ATOM 741 O ASN 98 34.270 22.148 2.979 1.00 0.00 ATOM 742 C ASN 98 34.253 22.861 1.963 1.00 0.00 ATOM 743 N PRO 99 34.916 24.027 1.886 1.00 0.00 ATOM 744 CA PRO 99 35.674 24.495 3.039 1.00 0.00 ATOM 745 CB PRO 99 36.392 25.743 2.504 1.00 0.00 ATOM 746 CG PRO 99 35.558 26.213 1.364 1.00 0.00 ATOM 747 CD PRO 99 35.028 24.943 0.739 1.00 0.00 ATOM 748 O PRO 99 35.278 24.611 5.405 1.00 0.00 ATOM 749 C PRO 99 34.801 24.802 4.272 1.00 0.00 ATOM 750 N ASP 100 33.542 25.223 4.069 1.00 0.00 ATOM 751 CA ASP 100 32.634 25.509 5.187 1.00 0.00 ATOM 752 CB ASP 100 31.324 26.160 4.739 1.00 0.00 ATOM 753 CG ASP 100 31.541 27.549 4.177 1.00 0.00 ATOM 754 OD1 ASP 100 32.348 28.308 4.775 1.00 0.00 ATOM 755 OD2 ASP 100 30.933 27.873 3.130 1.00 0.00 ATOM 756 O ASP 100 32.307 24.465 7.280 1.00 0.00 ATOM 757 C ASP 100 32.336 24.332 6.066 1.00 0.00 ATOM 758 N VAL 101 32.100 23.182 5.453 1.00 0.00 ATOM 759 CA VAL 101 31.913 21.931 6.194 1.00 0.00 ATOM 760 CB VAL 101 31.650 20.744 5.233 1.00 0.00 ATOM 761 CG1 VAL 101 31.823 19.409 5.910 1.00 0.00 ATOM 762 CG2 VAL 101 30.280 20.868 4.604 1.00 0.00 ATOM 763 O VAL 101 32.997 21.417 8.256 1.00 0.00 ATOM 764 C VAL 101 33.129 21.686 7.069 1.00 0.00 ATOM 765 N MET 102 34.312 21.836 6.489 1.00 0.00 ATOM 766 CA MET 102 35.579 21.599 7.197 1.00 0.00 ATOM 767 CB MET 102 36.719 21.698 6.186 1.00 0.00 ATOM 768 CG MET 102 37.808 20.662 6.335 1.00 0.00 ATOM 769 SD MET 102 37.335 18.961 7.181 1.00 0.00 ATOM 770 CE MET 102 35.847 18.412 6.054 1.00 0.00 ATOM 771 O MET 102 36.150 22.265 9.434 1.00 0.00 ATOM 772 C MET 102 35.774 22.609 8.308 1.00 0.00 ATOM 773 N CYS 103 35.481 23.865 7.978 1.00 0.00 ATOM 774 CA CYS 103 35.560 24.971 8.911 1.00 0.00 ATOM 775 CB CYS 103 35.206 26.270 8.177 1.00 0.00 ATOM 776 SG CYS 103 35.340 27.684 9.237 1.00 0.00 ATOM 777 O CYS 103 35.124 25.005 11.274 1.00 0.00 ATOM 778 C CYS 103 34.667 24.796 10.160 1.00 0.00 ATOM 779 N ASN 104 33.400 24.415 9.972 1.00 0.00 ATOM 780 CA ASN 104 32.509 24.158 11.092 1.00 0.00 ATOM 781 CB ASN 104 31.087 23.870 10.596 1.00 0.00 ATOM 782 CG ASN 104 30.433 25.071 9.984 1.00 0.00 ATOM 783 ND2 ASN 104 29.626 24.855 8.963 1.00 0.00 ATOM 784 OD1 ASN 104 30.643 26.180 10.422 1.00 0.00 ATOM 785 O ASN 104 33.053 23.075 13.185 1.00 0.00 ATOM 786 C ASN 104 33.014 22.993 11.949 1.00 0.00 ATOM 787 N LYS 105 33.447 21.932 11.283 1.00 0.00 ATOM 788 CA LYS 105 33.920 20.732 11.952 1.00 0.00 ATOM 789 CB LYS 105 34.199 19.630 10.929 1.00 0.00 ATOM 790 CG LYS 105 34.746 18.345 11.549 1.00 0.00 ATOM 791 CD LYS 105 35.195 17.356 10.472 1.00 0.00 ATOM 792 CE LYS 105 35.567 15.983 11.085 1.00 0.00 ATOM 793 NZ LYS 105 34.344 15.143 11.368 1.00 0.00 ATOM 794 O LYS 105 35.326 20.409 13.871 1.00 0.00 ATOM 795 C LYS 105 35.173 20.966 12.787 1.00 0.00 ATOM 796 N GLU 106 36.076 21.777 12.273 1.00 0.00 ATOM 797 CA GLU 106 37.425 21.849 12.836 1.00 0.00 ATOM 798 CB GLU 106 38.475 21.644 11.747 1.00 0.00 ATOM 799 CG GLU 106 38.401 20.312 11.016 1.00 0.00 ATOM 800 CD GLU 106 38.848 19.100 11.849 1.00 0.00 ATOM 801 OE1 GLU 106 39.309 19.265 13.001 1.00 0.00 ATOM 802 OE2 GLU 106 38.750 17.967 11.323 1.00 0.00 ATOM 803 O GLU 106 38.606 23.215 14.351 1.00 0.00 ATOM 804 C GLU 106 37.700 23.159 13.521 1.00 0.00 ATOM 805 N ILE 107 36.933 24.205 13.177 1.00 0.00 ATOM 806 CA ILE 107 37.196 25.540 13.688 1.00 0.00 ATOM 807 CB ILE 107 37.543 26.575 12.591 1.00 0.00 ATOM 808 CG1 ILE 107 38.770 26.135 11.751 1.00 0.00 ATOM 809 CG2 ILE 107 37.704 27.971 13.192 1.00 0.00 ATOM 810 CD1 ILE 107 40.102 25.974 12.536 1.00 0.00 ATOM 811 O ILE 107 36.241 26.131 15.747 1.00 0.00 ATOM 812 C ILE 107 36.073 26.027 14.542 1.00 0.00 ATOM 813 N LYS 108 34.911 26.300 13.961 1.00 0.00 ATOM 814 CA LYS 108 33.806 26.860 14.744 1.00 0.00 ATOM 815 CB LYS 108 32.631 27.252 13.867 1.00 0.00 ATOM 816 CG LYS 108 32.993 28.316 12.818 1.00 0.00 ATOM 817 CD LYS 108 31.744 28.938 12.186 1.00 0.00 ATOM 818 CE LYS 108 32.037 29.499 10.798 1.00 0.00 ATOM 819 NZ LYS 108 32.370 28.431 9.788 1.00 0.00 ATOM 820 O LYS 108 32.914 26.479 16.926 1.00 0.00 ATOM 821 C LYS 108 33.378 25.972 15.896 1.00 0.00 ATOM 822 N PHE 109 33.567 24.657 15.770 1.00 0.00 ATOM 823 CA PHE 109 33.064 23.750 16.812 1.00 0.00 ATOM 824 CB PHE 109 31.864 22.936 16.317 1.00 0.00 ATOM 825 CG PHE 109 30.690 23.785 15.934 1.00 0.00 ATOM 826 CD1 PHE 109 29.771 24.205 16.894 1.00 0.00 ATOM 827 CD2 PHE 109 30.516 24.205 14.626 1.00 0.00 ATOM 828 CE1 PHE 109 28.675 25.012 16.536 1.00 0.00 ATOM 829 CE2 PHE 109 29.440 25.014 14.272 1.00 0.00 ATOM 830 CZ PHE 109 28.521 25.415 15.233 1.00 0.00 ATOM 831 O PHE 109 33.813 21.875 18.070 1.00 0.00 ATOM 832 C PHE 109 34.120 22.852 17.393 1.00 0.00 ATOM 833 N LYS 110 35.370 23.196 17.149 1.00 0.00 ATOM 834 CA LYS 110 36.461 22.497 17.774 1.00 0.00 ATOM 835 CB LYS 110 37.187 21.615 16.758 1.00 0.00 ATOM 836 CG LYS 110 37.778 20.321 17.316 1.00 0.00 ATOM 837 CD LYS 110 37.984 19.334 16.158 1.00 0.00 ATOM 838 CE LYS 110 39.463 18.984 15.943 1.00 0.00 ATOM 839 NZ LYS 110 39.986 18.081 17.036 1.00 0.00 ATOM 840 O LYS 110 37.335 23.757 19.578 1.00 0.00 ATOM 841 C LYS 110 37.381 23.546 18.374 1.00 0.00 ATOM 842 N ALA 111 38.192 24.220 17.551 1.00 0.00 ATOM 843 CA ALA 111 39.078 25.278 18.050 1.00 0.00 ATOM 844 CB ALA 111 39.832 25.918 16.903 1.00 0.00 ATOM 845 O ALA 111 38.687 26.684 19.995 1.00 0.00 ATOM 846 C ALA 111 38.304 26.342 18.868 1.00 0.00 ATOM 847 N PHE 112 37.200 26.826 18.311 1.00 0.00 ATOM 848 CA PHE 112 36.439 27.894 18.934 1.00 0.00 ATOM 849 CB PHE 112 35.444 28.464 17.939 1.00 0.00 ATOM 850 CG PHE 112 34.624 29.606 18.477 1.00 0.00 ATOM 851 CD1 PHE 112 35.229 30.827 18.823 1.00 0.00 ATOM 852 CD2 PHE 112 33.246 29.482 18.617 1.00 0.00 ATOM 853 CE1 PHE 112 34.464 31.895 19.291 1.00 0.00 ATOM 854 CE2 PHE 112 32.471 30.559 19.093 1.00 0.00 ATOM 855 CZ PHE 112 33.091 31.759 19.431 1.00 0.00 ATOM 856 O PHE 112 35.656 28.148 21.191 1.00 0.00 ATOM 857 C PHE 112 35.725 27.424 20.194 1.00 0.00 ATOM 858 N LEU 113 35.189 26.209 20.138 1.00 0.00 ATOM 859 CA LEU 113 34.531 25.581 21.286 1.00 0.00 ATOM 860 CB LEU 113 33.830 24.286 20.845 1.00 0.00 ATOM 861 CG LEU 113 33.119 23.395 21.866 1.00 0.00 ATOM 862 CD1 LEU 113 32.187 24.210 22.737 1.00 0.00 ATOM 863 CD2 LEU 113 32.328 22.345 21.106 1.00 0.00 ATOM 864 O LEU 113 35.114 25.712 23.605 1.00 0.00 ATOM 865 C LEU 113 35.461 25.349 22.494 1.00 0.00 ATOM 866 N ASP 114 36.624 24.741 22.280 1.00 0.00 ATOM 867 CA ASP 114 37.635 24.606 23.331 1.00 0.00 ATOM 868 CB ASP 114 38.839 23.796 22.849 1.00 0.00 ATOM 869 CG ASP 114 38.453 22.402 22.381 1.00 0.00 ATOM 870 OD1 ASP 114 37.329 21.936 22.730 1.00 0.00 ATOM 871 OD2 ASP 114 39.273 21.783 21.653 1.00 0.00 ATOM 872 O ASP 114 38.409 26.089 25.023 1.00 0.00 ATOM 873 C ASP 114 38.122 25.946 23.839 1.00 0.00 ATOM 874 N TYR 115 38.228 26.921 22.947 1.00 0.00 ATOM 875 CA TYR 115 38.581 28.262 23.347 1.00 0.00 ATOM 876 CB TYR 115 38.739 29.184 22.130 1.00 0.00 ATOM 877 CG TYR 115 39.126 30.600 22.505 1.00 0.00 ATOM 878 CD1 TYR 115 40.404 30.887 22.996 1.00 0.00 ATOM 879 CD2 TYR 115 38.214 31.643 22.382 1.00 0.00 ATOM 880 CE1 TYR 115 40.757 32.176 23.341 1.00 0.00 ATOM 881 CE2 TYR 115 38.555 32.937 22.732 1.00 0.00 ATOM 882 CZ TYR 115 39.814 33.192 23.201 1.00 0.00 ATOM 883 OH TYR 115 40.143 34.476 23.533 1.00 0.00 ATOM 884 O TYR 115 37.842 29.303 25.369 1.00 0.00 ATOM 885 C TYR 115 37.517 28.816 24.298 1.00 0.00 ATOM 886 N ALA 116 36.259 28.737 23.889 1.00 0.00 ATOM 887 CA ALA 116 35.143 29.258 24.647 1.00 0.00 ATOM 888 CB ALA 116 33.862 29.047 23.884 1.00 0.00 ATOM 889 O ALA 116 34.715 29.245 26.996 1.00 0.00 ATOM 890 C ALA 116 35.054 28.596 26.005 1.00 0.00 ATOM 891 N ILE 117 35.378 27.306 26.061 1.00 0.00 ATOM 892 CA ILE 117 35.344 26.576 27.317 1.00 0.00 ATOM 893 CB ILE 117 35.466 25.039 27.072 1.00 0.00 ATOM 894 CG1 ILE 117 34.098 24.478 26.637 1.00 0.00 ATOM 895 CG2 ILE 117 36.011 24.294 28.316 1.00 0.00 ATOM 896 CD1 ILE 117 34.181 23.239 25.750 1.00 0.00 ATOM 897 O ILE 117 36.144 27.138 29.531 1.00 0.00 ATOM 898 C ILE 117 36.379 27.128 28.310 1.00 0.00 ATOM 899 N THR 118 37.505 27.616 27.791 1.00 0.00 ATOM 900 CA THR 118 38.498 28.254 28.654 1.00 0.00 ATOM 901 CB THR 118 39.891 28.404 27.988 1.00 0.00 ATOM 902 CG2 THR 118 40.349 27.105 27.328 1.00 0.00 ATOM 903 OG1 THR 118 39.830 29.432 27.003 1.00 0.00 ATOM 904 O THR 118 38.617 30.223 30.023 1.00 0.00 ATOM 905 C THR 118 38.002 29.614 29.150 1.00 0.00 ATOM 906 N LEU 119 36.902 30.095 28.590 1.00 0.00 ATOM 907 CA LEU 119 36.252 31.278 29.133 1.00 0.00 ATOM 908 CB LEU 119 35.807 32.218 28.010 1.00 0.00 ATOM 909 CG LEU 119 36.985 32.907 27.298 1.00 0.00 ATOM 910 CD1 LEU 119 36.543 33.432 25.947 1.00 0.00 ATOM 911 CD2 LEU 119 37.558 34.028 28.137 1.00 0.00 ATOM 912 O LEU 119 34.272 31.779 30.425 1.00 0.00 ATOM 913 C LEU 119 35.076 30.913 30.056 1.00 0.00 ATOM 914 N GLY 120 35.009 29.633 30.433 1.00 0.00 ATOM 915 CA GLY 120 33.964 29.109 31.296 1.00 0.00 ATOM 916 O GLY 120 31.577 29.137 31.298 1.00 0.00 ATOM 917 C GLY 120 32.612 29.067 30.623 1.00 0.00 ATOM 918 N ALA 121 32.621 28.984 29.295 1.00 0.00 ATOM 919 CA ALA 121 31.416 28.824 28.507 1.00 0.00 ATOM 920 CB ALA 121 31.753 28.868 27.029 1.00 0.00 ATOM 921 O ALA 121 31.358 26.467 28.939 1.00 0.00 ATOM 922 C ALA 121 30.722 27.515 28.816 1.00 0.00 ATOM 923 N ASP 122 29.405 27.597 28.918 1.00 0.00 ATOM 924 CA ASP 122 28.545 26.425 28.941 1.00 0.00 ATOM 925 CB ASP 122 27.301 26.746 29.754 1.00 0.00 ATOM 926 CG ASP 122 27.629 26.934 31.205 1.00 0.00 ATOM 927 OD1 ASP 122 28.258 26.001 31.753 1.00 0.00 ATOM 928 OD2 ASP 122 27.325 28.008 31.789 1.00 0.00 ATOM 929 O ASP 122 28.206 24.794 27.215 1.00 0.00 ATOM 930 C ASP 122 28.192 25.982 27.515 1.00 0.00 ATOM 931 N TYR 123 27.911 26.957 26.648 1.00 0.00 ATOM 932 CA TYR 123 27.560 26.754 25.261 1.00 0.00 ATOM 933 CB TYR 123 26.039 26.999 25.046 1.00 0.00 ATOM 934 CG TYR 123 25.171 26.041 25.820 1.00 0.00 ATOM 935 CD1 TYR 123 24.835 24.804 25.288 1.00 0.00 ATOM 936 CD2 TYR 123 24.732 26.343 27.108 1.00 0.00 ATOM 937 CE1 TYR 123 24.057 23.889 26.000 1.00 0.00 ATOM 938 CE2 TYR 123 23.950 25.431 27.853 1.00 0.00 ATOM 939 CZ TYR 123 23.611 24.204 27.275 1.00 0.00 ATOM 940 OH TYR 123 22.843 23.286 27.961 1.00 0.00 ATOM 941 O TYR 123 28.711 28.822 24.894 1.00 0.00 ATOM 942 C TYR 123 28.355 27.752 24.413 1.00 0.00 ATOM 943 N VAL 124 28.633 27.375 23.160 1.00 0.00 ATOM 944 CA VAL 124 28.877 28.329 22.079 1.00 0.00 ATOM 945 CB VAL 124 29.992 27.869 21.102 1.00 0.00 ATOM 946 CG1 VAL 124 31.286 27.560 21.836 1.00 0.00 ATOM 947 CG2 VAL 124 29.554 26.651 20.325 1.00 0.00 ATOM 948 O VAL 124 26.753 27.605 21.187 1.00 0.00 ATOM 949 C VAL 124 27.567 28.526 21.289 1.00 0.00 ATOM 950 N ALA 125 27.361 29.733 20.763 1.00 0.00 ATOM 951 CA ALA 125 26.282 29.982 19.858 1.00 0.00 ATOM 952 CB ALA 125 25.235 30.908 20.496 1.00 0.00 ATOM 953 O ALA 125 27.857 31.300 18.628 1.00 0.00 ATOM 954 C ALA 125 26.843 30.592 18.594 1.00 0.00 ATOM 955 N THR 126 26.190 30.293 17.471 1.00 0.00 ATOM 956 CA THR 126 26.484 30.937 16.203 1.00 0.00 ATOM 957 CB THR 126 27.139 29.984 15.208 1.00 0.00 ATOM 958 CG2 THR 126 28.467 29.403 15.730 1.00 0.00 ATOM 959 OG1 THR 126 26.216 28.935 14.931 1.00 0.00 ATOM 960 O THR 126 24.095 30.844 16.035 1.00 0.00 ATOM 961 C THR 126 25.162 31.317 15.589 1.00 0.00 ATOM 962 N GLY 127 25.238 32.151 14.541 1.00 0.00 ATOM 963 CA GLY 127 24.054 32.551 13.802 1.00 0.00 ATOM 964 O GLY 127 23.086 32.034 11.703 1.00 0.00 ATOM 965 C GLY 127 23.718 31.612 12.653 1.00 0.00 ATOM 966 N HIS 128 24.138 30.351 12.713 1.00 0.00 ATOM 967 CA HIS 128 23.708 29.353 11.768 1.00 0.00 ATOM 968 CB HIS 128 24.388 28.006 12.059 1.00 0.00 ATOM 969 CG HIS 128 25.800 27.915 11.563 1.00 0.00 ATOM 970 CD2 HIS 128 26.302 27.752 10.310 1.00 0.00 ATOM 971 ND1 HIS 128 26.894 28.023 12.404 1.00 0.00 ATOM 972 CE1 HIS 128 28.004 27.902 11.695 1.00 0.00 ATOM 973 NE2 HIS 128 27.670 27.748 10.425 1.00 0.00 ATOM 974 O HIS 128 21.610 29.132 12.964 1.00 0.00 ATOM 975 C HIS 128 22.180 29.161 11.856 1.00 0.00 ATOM 976 N TYR 129 21.547 29.016 10.692 1.00 0.00 ATOM 977 CA TYR 129 20.145 28.654 10.562 1.00 0.00 ATOM 978 CB TYR 129 19.602 29.187 9.239 1.00 0.00 ATOM 979 CG TYR 129 19.504 30.714 9.269 1.00 0.00 ATOM 980 CD1 TYR 129 20.613 31.510 8.988 1.00 0.00 ATOM 981 CD2 TYR 129 18.303 31.351 9.621 1.00 0.00 ATOM 982 CE1 TYR 129 20.543 32.911 9.030 1.00 0.00 ATOM 983 CE2 TYR 129 18.205 32.737 9.658 1.00 0.00 ATOM 984 CZ TYR 129 19.332 33.514 9.373 1.00 0.00 ATOM 985 OH TYR 129 19.251 34.890 9.416 1.00 0.00 ATOM 986 O TYR 129 19.987 26.431 9.693 1.00 0.00 ATOM 987 C TYR 129 19.977 27.150 10.686 1.00 0.00 ATOM 988 N ALA 130 19.875 26.680 11.931 1.00 0.00 ATOM 989 CA ALA 130 19.786 25.244 12.253 1.00 0.00 ATOM 990 CB ALA 130 21.179 24.578 12.251 1.00 0.00 ATOM 991 O ALA 130 19.112 26.114 14.340 1.00 0.00 ATOM 992 C ALA 130 19.161 25.144 13.612 1.00 0.00 ATOM 993 N ARG 131 18.685 23.973 13.970 1.00 0.00 ATOM 994 CA ARG 131 18.150 23.772 15.302 1.00 0.00 ATOM 995 CB ARG 131 16.631 23.565 15.246 1.00 0.00 ATOM 996 CG ARG 131 15.855 24.783 14.800 1.00 0.00 ATOM 997 CD ARG 131 14.400 24.428 14.636 1.00 0.00 ATOM 998 NE ARG 131 14.169 23.768 13.357 1.00 0.00 ATOM 999 CZ ARG 131 13.105 23.027 13.056 1.00 0.00 ATOM 1000 NH1 ARG 131 12.154 22.835 13.955 1.00 0.00 ATOM 1001 NH2 ARG 131 12.998 22.472 11.844 1.00 0.00 ATOM 1002 O ARG 131 19.234 21.635 15.251 1.00 0.00 ATOM 1003 C ARG 131 18.798 22.562 15.943 1.00 0.00 ATOM 1004 N VAL 132 18.854 22.592 17.270 1.00 0.00 ATOM 1005 CA VAL 132 19.171 21.424 18.090 1.00 0.00 ATOM 1006 CB VAL 132 20.480 21.623 18.890 1.00 0.00 ATOM 1007 CG1 VAL 132 21.670 21.522 17.930 1.00 0.00 ATOM 1008 CG2 VAL 132 20.515 22.991 19.520 1.00 0.00 ATOM 1009 O VAL 132 17.413 21.964 19.650 1.00 0.00 ATOM 1010 C VAL 132 17.980 21.085 18.993 1.00 0.00 ATOM 1011 N ALA 133 17.566 19.824 18.973 1.00 0.00 ATOM 1012 CA ALA 133 16.523 19.356 19.868 1.00 0.00 ATOM 1013 CB ALA 133 15.359 18.780 19.083 1.00 0.00 ATOM 1014 O ALA 133 17.862 17.439 20.334 1.00 0.00 ATOM 1015 C ALA 133 17.116 18.309 20.786 1.00 0.00 ATOM 1016 N ARG 134 16.810 18.417 22.080 1.00 0.00 ATOM 1017 CA ARG 134 17.253 17.430 23.077 1.00 0.00 ATOM 1018 CB ARG 134 17.633 18.096 24.406 1.00 0.00 ATOM 1019 CG ARG 134 18.988 18.818 24.403 1.00 0.00 ATOM 1020 CD ARG 134 18.861 20.363 24.296 1.00 0.00 ATOM 1021 NE ARG 134 19.970 20.993 23.564 1.00 0.00 ATOM 1022 CZ ARG 134 21.250 21.037 23.965 1.00 0.00 ATOM 1023 NH1 ARG 134 21.627 20.466 25.120 1.00 0.00 ATOM 1024 NH2 ARG 134 22.169 21.645 23.195 1.00 0.00 ATOM 1025 O ARG 134 15.000 16.669 23.393 1.00 0.00 ATOM 1026 C ARG 134 16.186 16.359 23.295 1.00 0.00 ATOM 1027 N ASP 135 16.616 15.099 23.352 1.00 0.00 ATOM 1028 CA ASP 135 15.717 13.962 23.618 1.00 0.00 ATOM 1029 CB ASP 135 16.394 12.636 23.248 1.00 0.00 ATOM 1030 CG ASP 135 15.759 11.965 22.049 1.00 0.00 ATOM 1031 OD1 ASP 135 16.418 11.090 21.437 1.00 0.00 ATOM 1032 OD2 ASP 135 14.602 12.312 21.718 1.00 0.00 ATOM 1033 O ASP 135 15.844 14.570 25.935 1.00 0.00 ATOM 1034 C ASP 135 15.298 13.871 25.073 1.00 0.00 ATOM 1035 N GLU 136 14.330 12.986 25.326 1.00 0.00 ATOM 1036 CA GLU 136 13.992 12.533 26.673 1.00 0.00 ATOM 1037 CB GLU 136 12.960 11.391 26.632 1.00 0.00 ATOM 1038 CG GLU 136 11.631 11.731 25.922 1.00 0.00 ATOM 1039 CD GLU 136 11.679 11.567 24.381 1.00 0.00 ATOM 1040 OE1 GLU 136 11.031 10.618 23.871 1.00 0.00 ATOM 1041 OE2 GLU 136 12.346 12.377 23.676 1.00 0.00 ATOM 1042 O GLU 136 15.655 12.574 28.413 1.00 0.00 ATOM 1043 C GLU 136 15.288 12.068 27.343 1.00 0.00 ATOM 1044 N ASP 137 15.993 11.147 26.670 1.00 0.00 ATOM 1045 CA ASP 137 17.284 10.602 27.134 1.00 0.00 ATOM 1046 CB ASP 137 17.761 9.451 26.229 1.00 0.00 ATOM 1047 CG ASP 137 17.012 9.393 24.908 1.00 0.00 ATOM 1048 OD1 ASP 137 17.572 9.825 23.860 1.00 0.00 ATOM 1049 OD2 ASP 137 15.846 8.926 24.929 1.00 0.00 ATOM 1050 O ASP 137 19.398 11.403 27.955 1.00 0.00 ATOM 1051 C ASP 137 18.395 11.645 27.276 1.00 0.00 ATOM 1052 N GLY 138 18.213 12.801 26.643 1.00 0.00 ATOM 1053 CA GLY 138 19.216 13.859 26.691 1.00 0.00 ATOM 1054 O GLY 138 21.082 14.588 25.392 1.00 0.00 ATOM 1055 C GLY 138 20.102 13.842 25.461 1.00 0.00 ATOM 1056 N THR 139 19.759 12.978 24.503 1.00 0.00 ATOM 1057 CA THR 139 20.445 12.908 23.217 1.00 0.00 ATOM 1058 CB THR 139 20.153 11.586 22.496 1.00 0.00 ATOM 1059 CG2 THR 139 20.665 11.602 21.047 1.00 0.00 ATOM 1060 OG1 THR 139 20.796 10.522 23.198 1.00 0.00 ATOM 1061 O THR 139 18.820 14.323 22.165 1.00 0.00 ATOM 1062 C THR 139 20.009 14.074 22.337 1.00 0.00 ATOM 1063 N VAL 140 20.982 14.790 21.792 1.00 0.00 ATOM 1064 CA VAL 140 20.702 15.933 20.944 1.00 0.00 ATOM 1065 CB VAL 140 21.757 17.037 21.161 1.00 0.00 ATOM 1066 CG1 VAL 140 21.433 18.270 20.357 1.00 0.00 ATOM 1067 CG2 VAL 140 21.799 17.409 22.594 1.00 0.00 ATOM 1068 O VAL 140 21.461 14.695 19.001 1.00 0.00 ATOM 1069 C VAL 140 20.644 15.498 19.471 1.00 0.00 ATOM 1070 N HIS 141 19.663 16.047 18.762 1.00 0.00 ATOM 1071 CA HIS 141 19.494 15.849 17.332 1.00 0.00 ATOM 1072 CB HIS 141 18.143 15.182 17.048 1.00 0.00 ATOM 1073 CG HIS 141 17.993 13.829 17.677 1.00 0.00 ATOM 1074 CD2 HIS 141 17.790 13.461 18.964 1.00 0.00 ATOM 1075 ND1 HIS 141 18.061 12.658 16.954 1.00 0.00 ATOM 1076 CE1 HIS 141 17.903 11.628 17.765 1.00 0.00 ATOM 1077 NE2 HIS 141 17.743 12.088 18.992 1.00 0.00 ATOM 1078 O HIS 141 19.207 18.225 17.253 1.00 0.00 ATOM 1079 C HIS 141 19.585 17.220 16.652 1.00 0.00 ATOM 1080 N MET 142 20.110 17.262 15.424 1.00 0.00 ATOM 1081 CA MET 142 20.135 18.503 14.649 1.00 0.00 ATOM 1082 CB MET 142 21.435 18.644 13.872 1.00 0.00 ATOM 1083 CG MET 142 21.571 19.988 13.239 1.00 0.00 ATOM 1084 SD MET 142 23.393 20.395 12.750 1.00 0.00 ATOM 1085 CE MET 142 23.674 18.981 11.478 1.00 0.00 ATOM 1086 O MET 142 18.747 17.644 12.936 1.00 0.00 ATOM 1087 C MET 142 18.972 18.573 13.686 1.00 0.00 ATOM 1088 N LEU 143 18.250 19.683 13.705 1.00 0.00 ATOM 1089 CA LEU 143 17.133 19.900 12.798 1.00 0.00 ATOM 1090 CB LEU 143 15.883 20.264 13.604 1.00 0.00 ATOM 1091 CG LEU 143 14.987 19.184 14.250 1.00 0.00 ATOM 1092 CD1 LEU 143 15.719 17.873 14.597 1.00 0.00 ATOM 1093 CD2 LEU 143 14.177 19.710 15.441 1.00 0.00 ATOM 1094 O LEU 143 18.160 21.979 12.128 1.00 0.00 ATOM 1095 C LEU 143 17.437 21.024 11.808 1.00 0.00 ATOM 1096 N ARG 144 16.875 20.917 10.604 1.00 0.00 ATOM 1097 CA ARG 144 16.957 21.991 9.629 1.00 0.00 ATOM 1098 CB ARG 144 16.063 21.679 8.443 1.00 0.00 ATOM 1099 CG ARG 144 16.447 20.467 7.583 1.00 0.00 ATOM 1100 CD ARG 144 15.293 20.215 6.682 1.00 0.00 ATOM 1101 NE ARG 144 15.097 18.817 6.307 1.00 0.00 ATOM 1102 CZ ARG 144 15.269 18.352 5.069 1.00 0.00 ATOM 1103 NH1 ARG 144 15.677 19.170 4.108 1.00 0.00 ATOM 1104 NH2 ARG 144 15.052 17.069 4.801 1.00 0.00 ATOM 1105 O ARG 144 15.495 23.261 11.022 1.00 0.00 ATOM 1106 C ARG 144 16.460 23.283 10.248 1.00 0.00 ATOM 1107 N GLY 145 17.096 24.407 9.908 1.00 0.00 ATOM 1108 CA GLY 145 16.469 25.709 10.171 1.00 0.00 ATOM 1109 O GLY 145 14.842 25.195 8.481 1.00 0.00 ATOM 1110 C GLY 145 15.080 25.774 9.534 1.00 0.00 ATOM 1111 N VAL 146 14.150 26.470 10.168 1.00 0.00 ATOM 1112 CA VAL 146 12.819 26.607 9.597 1.00 0.00 ATOM 1113 CB VAL 146 11.794 27.189 10.602 1.00 0.00 ATOM 1114 CG1 VAL 146 11.756 26.335 11.869 1.00 0.00 ATOM 1115 CG2 VAL 146 12.098 28.628 10.901 1.00 0.00 ATOM 1116 O VAL 146 11.907 27.348 7.513 1.00 0.00 ATOM 1117 C VAL 146 12.827 27.445 8.321 1.00 0.00 ATOM 1118 N ASP 147 13.836 28.301 8.174 1.00 0.00 ATOM 1119 CA ASP 147 14.066 29.034 6.934 1.00 0.00 ATOM 1120 CB ASP 147 15.070 30.182 7.170 1.00 0.00 ATOM 1121 CG ASP 147 15.184 31.130 5.971 1.00 0.00 ATOM 1122 OD1 ASP 147 15.199 30.640 4.824 1.00 0.00 ATOM 1123 OD2 ASP 147 15.237 32.373 6.164 1.00 0.00 ATOM 1124 O ASP 147 15.875 27.778 6.015 1.00 0.00 ATOM 1125 C ASP 147 14.668 28.028 5.968 1.00 0.00 ATOM 1126 N ASN 148 13.861 27.448 5.088 1.00 0.00 ATOM 1127 CA ASN 148 14.365 26.377 4.224 1.00 0.00 ATOM 1128 CB ASN 148 13.220 25.475 3.758 1.00 0.00 ATOM 1129 CG ASN 148 13.639 24.017 3.622 1.00 0.00 ATOM 1130 ND2 ASN 148 13.765 23.580 2.379 1.00 0.00 ATOM 1131 OD1 ASN 148 13.824 23.284 4.614 1.00 0.00 ATOM 1132 O ASN 148 15.828 26.037 2.336 1.00 0.00 ATOM 1133 C ASN 148 15.238 26.848 3.039 1.00 0.00 ATOM 1134 N GLY 149 15.329 28.155 2.820 1.00 0.00 ATOM 1135 CA GLY 149 16.335 28.674 1.919 1.00 0.00 ATOM 1136 O GLY 149 18.729 28.764 1.871 1.00 0.00 ATOM 1137 C GLY 149 17.700 28.915 2.546 1.00 0.00 ATOM 1138 N LYS 150 17.709 29.264 3.827 1.00 0.00 ATOM 1139 CA LYS 150 18.943 29.591 4.526 1.00 0.00 ATOM 1140 CB LYS 150 18.756 30.858 5.356 1.00 0.00 ATOM 1141 CG LYS 150 19.953 31.818 5.321 1.00 0.00 ATOM 1142 CD LYS 150 20.136 32.505 3.948 1.00 0.00 ATOM 1143 CE LYS 150 18.951 33.401 3.569 1.00 0.00 ATOM 1144 NZ LYS 150 19.128 34.045 2.237 1.00 0.00 ATOM 1145 O LYS 150 20.581 28.518 5.899 1.00 0.00 ATOM 1146 C LYS 150 19.452 28.448 5.401 1.00 0.00 ATOM 1147 N ASP 151 18.626 27.409 5.577 1.00 0.00 ATOM 1148 CA ASP 151 18.972 26.226 6.372 1.00 0.00 ATOM 1149 CB ASP 151 18.004 25.087 6.106 1.00 0.00 ATOM 1150 CG ASP 151 18.526 23.747 6.623 1.00 0.00 ATOM 1151 OD1 ASP 151 19.198 23.691 7.679 1.00 0.00 ATOM 1152 OD2 ASP 151 18.274 22.732 5.970 1.00 0.00 ATOM 1153 O ASP 151 20.780 25.232 5.114 1.00 0.00 ATOM 1154 C ASP 151 20.406 25.718 6.189 1.00 0.00 ATOM 1155 N GLN 152 21.195 25.782 7.253 1.00 0.00 ATOM 1156 CA GLN 152 22.608 25.467 7.138 1.00 0.00 ATOM 1157 CB GLN 152 23.420 26.580 7.764 1.00 0.00 ATOM 1158 CG GLN 152 23.702 27.710 6.769 1.00 0.00 ATOM 1159 CD GLN 152 23.716 29.080 7.412 1.00 0.00 ATOM 1160 OE1 GLN 152 23.219 29.286 8.501 1.00 0.00 ATOM 1161 NE2 GLN 152 24.301 30.028 6.728 1.00 0.00 ATOM 1162 O GLN 152 24.218 23.813 7.730 1.00 0.00 ATOM 1163 C GLN 152 23.033 24.087 7.649 1.00 0.00 ATOM 1164 N THR 153 22.086 23.207 7.963 1.00 0.00 ATOM 1165 CA THR 153 22.464 21.855 8.370 1.00 0.00 ATOM 1166 CB THR 153 21.238 20.933 8.663 1.00 0.00 ATOM 1167 CG2 THR 153 20.460 21.463 9.840 1.00 0.00 ATOM 1168 OG1 THR 153 20.399 20.851 7.502 1.00 0.00 ATOM 1169 O THR 153 24.292 20.375 7.779 1.00 0.00 ATOM 1170 C THR 153 23.425 21.166 7.375 1.00 0.00 ATOM 1171 N TYR 154 23.271 21.465 6.087 1.00 0.00 ATOM 1172 CA TYR 154 24.143 20.923 5.045 1.00 0.00 ATOM 1173 CB TYR 154 23.785 21.526 3.666 1.00 0.00 ATOM 1174 CG TYR 154 24.612 21.000 2.494 1.00 0.00 ATOM 1175 CD1 TYR 154 24.228 19.837 1.815 1.00 0.00 ATOM 1176 CD2 TYR 154 25.773 21.659 2.077 1.00 0.00 ATOM 1177 CE1 TYR 154 24.978 19.324 0.760 1.00 0.00 ATOM 1178 CE2 TYR 154 26.541 21.164 1.026 1.00 0.00 ATOM 1179 CZ TYR 154 26.133 19.987 0.367 1.00 0.00 ATOM 1180 OH TYR 154 26.880 19.476 -0.688 1.00 0.00 ATOM 1181 O TYR 154 26.447 20.269 5.307 1.00 0.00 ATOM 1182 C TYR 154 25.615 21.162 5.417 1.00 0.00 ATOM 1183 N PHE 155 25.933 22.358 5.893 1.00 0.00 ATOM 1184 CA PHE 155 27.310 22.698 6.186 1.00 0.00 ATOM 1185 CB PHE 155 27.482 24.207 6.075 1.00 0.00 ATOM 1186 CG PHE 155 27.251 24.741 4.694 1.00 0.00 ATOM 1187 CD1 PHE 155 28.193 24.546 3.698 1.00 0.00 ATOM 1188 CD2 PHE 155 26.084 25.458 4.392 1.00 0.00 ATOM 1189 CE1 PHE 155 27.970 25.041 2.408 1.00 0.00 ATOM 1190 CE2 PHE 155 25.854 25.980 3.124 1.00 0.00 ATOM 1191 CZ PHE 155 26.805 25.779 2.123 1.00 0.00 ATOM 1192 O PHE 155 28.945 22.241 7.909 1.00 0.00 ATOM 1193 C PHE 155 27.741 22.228 7.579 1.00 0.00 ATOM 1194 N LEU 156 26.761 21.822 8.383 1.00 0.00 ATOM 1195 CA LEU 156 26.991 21.392 9.752 1.00 0.00 ATOM 1196 CB LEU 156 25.951 22.045 10.682 1.00 0.00 ATOM 1197 CG LEU 156 25.939 23.589 10.730 1.00 0.00 ATOM 1198 CD1 LEU 156 24.629 24.110 11.248 1.00 0.00 ATOM 1199 CD2 LEU 156 27.097 24.135 11.553 1.00 0.00 ATOM 1200 O LEU 156 26.882 19.302 10.955 1.00 0.00 ATOM 1201 C LEU 156 26.924 19.874 9.856 1.00 0.00 ATOM 1202 N SER 157 26.917 19.210 8.707 1.00 0.00 ATOM 1203 CA SER 157 26.675 17.742 8.654 1.00 0.00 ATOM 1204 CB SER 157 26.616 17.256 7.205 1.00 0.00 ATOM 1205 OG SER 157 27.538 17.981 6.391 1.00 0.00 ATOM 1206 O SER 157 27.407 15.785 9.884 1.00 0.00 ATOM 1207 C SER 157 27.708 16.909 9.440 1.00 0.00 ATOM 1208 N GLN 158 28.908 17.476 9.620 1.00 0.00 ATOM 1209 CA GLN 158 29.997 16.756 10.279 1.00 0.00 ATOM 1210 CB GLN 158 31.357 17.202 9.718 1.00 0.00 ATOM 1211 CG GLN 158 31.603 16.824 8.254 1.00 0.00 ATOM 1212 CD GLN 158 31.875 15.335 8.093 1.00 0.00 ATOM 1213 OE1 GLN 158 32.658 14.746 8.849 1.00 0.00 ATOM 1214 NE2 GLN 158 31.223 14.719 7.119 1.00 0.00 ATOM 1215 O GLN 158 30.869 16.253 12.422 1.00 0.00 ATOM 1216 C GLN 158 30.013 16.858 11.808 1.00 0.00 ATOM 1217 N LEU 159 29.093 17.609 12.417 1.00 0.00 ATOM 1218 CA LEU 159 29.095 17.833 13.874 1.00 0.00 ATOM 1219 CB LEU 159 28.197 19.013 14.292 1.00 0.00 ATOM 1220 CG LEU 159 28.453 20.450 13.756 1.00 0.00 ATOM 1221 CD1 LEU 159 27.710 21.485 14.579 1.00 0.00 ATOM 1222 CD2 LEU 159 29.910 20.839 13.713 1.00 0.00 ATOM 1223 O LEU 159 27.764 15.892 14.273 1.00 0.00 ATOM 1224 C LEU 159 28.703 16.586 14.647 1.00 0.00 ATOM 1225 N SER 160 29.427 16.324 15.727 1.00 0.00 ATOM 1226 CA SER 160 29.244 15.156 16.559 1.00 0.00 ATOM 1227 CB SER 160 30.579 14.780 17.182 1.00 0.00 ATOM 1228 OG SER 160 30.976 15.813 18.070 1.00 0.00 ATOM 1229 O SER 160 27.951 16.627 17.941 1.00 0.00 ATOM 1230 C SER 160 28.262 15.463 17.677 1.00 0.00 ATOM 1231 N GLN 161 27.775 14.409 18.321 1.00 0.00 ATOM 1232 CA GLN 161 26.896 14.508 19.487 1.00 0.00 ATOM 1233 CB GLN 161 26.661 13.097 20.054 1.00 0.00 ATOM 1234 CG GLN 161 25.695 13.024 21.227 1.00 0.00 ATOM 1235 CD GLN 161 24.333 13.566 20.878 1.00 0.00 ATOM 1236 OE1 GLN 161 23.925 13.556 19.705 1.00 0.00 ATOM 1237 NE2 GLN 161 23.618 14.057 21.887 1.00 0.00 ATOM 1238 O GLN 161 26.845 16.234 21.169 1.00 0.00 ATOM 1239 C GLN 161 27.514 15.385 20.570 1.00 0.00 ATOM 1240 N GLU 162 28.809 15.184 20.775 1.00 0.00 ATOM 1241 CA GLU 162 29.576 15.884 21.785 1.00 0.00 ATOM 1242 CB GLU 162 30.936 15.192 21.941 1.00 0.00 ATOM 1243 CG GLU 162 30.871 13.761 22.548 1.00 0.00 ATOM 1244 CD GLU 162 30.223 12.682 21.642 1.00 0.00 ATOM 1245 OE1 GLU 162 30.362 12.727 20.379 1.00 0.00 ATOM 1246 OE2 GLU 162 29.584 11.767 22.232 1.00 0.00 ATOM 1247 O GLU 162 29.857 18.174 22.450 1.00 0.00 ATOM 1248 C GLU 162 29.732 17.393 21.506 1.00 0.00 ATOM 1249 N GLN 163 29.740 17.786 20.226 1.00 0.00 ATOM 1250 CA GLN 163 29.739 19.199 19.811 1.00 0.00 ATOM 1251 CB GLN 163 30.222 19.352 18.355 1.00 0.00 ATOM 1252 CG GLN 163 31.734 19.123 18.177 1.00 0.00 ATOM 1253 CD GLN 163 32.175 18.902 16.734 1.00 0.00 ATOM 1254 OE1 GLN 163 31.632 18.065 16.018 1.00 0.00 ATOM 1255 NE2 GLN 163 33.177 19.640 16.313 1.00 0.00 ATOM 1256 O GLN 163 28.219 20.936 20.452 1.00 0.00 ATOM 1257 C GLN 163 28.353 19.828 19.948 1.00 0.00 ATOM 1258 N LEU 164 27.329 19.113 19.496 1.00 0.00 ATOM 1259 CA LEU 164 25.940 19.561 19.606 1.00 0.00 ATOM 1260 CB LEU 164 25.004 18.612 18.835 1.00 0.00 ATOM 1261 CG LEU 164 25.177 18.584 17.322 1.00 0.00 ATOM 1262 CD1 LEU 164 24.389 17.459 16.679 1.00 0.00 ATOM 1263 CD2 LEU 164 24.840 19.938 16.662 1.00 0.00 ATOM 1264 O LEU 164 24.568 20.557 21.304 1.00 0.00 ATOM 1265 C LEU 164 25.455 19.737 21.041 1.00 0.00 ATOM 1266 N GLN 165 26.009 18.955 21.965 1.00 0.00 ATOM 1267 CA GLN 165 25.676 19.092 23.390 1.00 0.00 ATOM 1268 CB GLN 165 26.395 18.029 24.247 1.00 0.00 ATOM 1269 CG GLN 165 25.888 16.586 24.116 1.00 0.00 ATOM 1270 CD GLN 165 24.558 16.350 24.800 1.00 0.00 ATOM 1271 OE1 GLN 165 24.047 17.211 25.536 1.00 0.00 ATOM 1272 NE2 GLN 165 23.984 15.174 24.567 1.00 0.00 ATOM 1273 O GLN 165 25.473 20.907 24.923 1.00 0.00 ATOM 1274 C GLN 165 26.047 20.462 23.952 1.00 0.00 ATOM 1275 N LYS 166 27.041 21.100 23.364 1.00 0.00 ATOM 1276 CA LYS 166 27.512 22.376 23.852 1.00 0.00 ATOM 1277 CB LYS 166 29.016 22.313 24.130 1.00 0.00 ATOM 1278 CG LYS 166 29.366 21.446 25.341 1.00 0.00 ATOM 1279 CD LYS 166 30.377 22.141 26.221 1.00 0.00 ATOM 1280 CE LYS 166 30.853 21.267 27.364 1.00 0.00 ATOM 1281 NZ LYS 166 29.801 21.161 28.415 1.00 0.00 ATOM 1282 O LYS 166 27.733 24.615 23.029 1.00 0.00 ATOM 1283 C LYS 166 27.178 23.518 22.896 1.00 0.00 ATOM 1284 N THR 167 26.262 23.264 21.957 1.00 0.00 ATOM 1285 CA THR 167 25.902 24.228 20.944 1.00 0.00 ATOM 1286 CB THR 167 25.956 23.562 19.562 1.00 0.00 ATOM 1287 CG2 THR 167 25.483 24.484 18.490 1.00 0.00 ATOM 1288 OG1 THR 167 27.308 23.183 19.275 1.00 0.00 ATOM 1289 O THR 167 23.634 24.083 21.633 1.00 0.00 ATOM 1290 C THR 167 24.512 24.797 21.173 1.00 0.00 ATOM 1291 N MET 168 24.336 26.089 20.865 1.00 0.00 ATOM 1292 CA MET 168 23.018 26.726 20.704 1.00 0.00 ATOM 1293 CB MET 168 22.783 27.782 21.789 1.00 0.00 ATOM 1294 CG MET 168 22.505 27.235 23.125 1.00 0.00 ATOM 1295 SD MET 168 22.269 28.627 24.428 1.00 0.00 ATOM 1296 CE MET 168 20.499 29.277 23.755 1.00 0.00 ATOM 1297 O MET 168 23.915 27.979 18.893 1.00 0.00 ATOM 1298 C MET 168 22.925 27.415 19.359 1.00 0.00 ATOM 1299 N PHE 169 21.744 27.365 18.732 1.00 0.00 ATOM 1300 CA PHE 169 21.467 28.053 17.459 1.00 0.00 ATOM 1301 CB PHE 169 21.160 27.071 16.312 1.00 0.00 ATOM 1302 CG PHE 169 22.325 26.201 15.895 1.00 0.00 ATOM 1303 CD1 PHE 169 23.572 26.773 15.535 1.00 0.00 ATOM 1304 CD2 PHE 169 22.173 24.792 15.836 1.00 0.00 ATOM 1305 CE1 PHE 169 24.637 25.965 15.131 1.00 0.00 ATOM 1306 CE2 PHE 169 23.236 23.964 15.442 1.00 0.00 ATOM 1307 CZ PHE 169 24.476 24.548 15.077 1.00 0.00 ATOM 1308 O PHE 169 19.155 28.550 17.330 1.00 0.00 ATOM 1309 C PHE 169 20.266 28.946 17.639 1.00 0.00 ATOM 1310 N PRO 170 20.469 30.155 18.172 1.00 0.00 ATOM 1311 CA PRO 170 19.323 31.080 18.445 1.00 0.00 ATOM 1312 CB PRO 170 19.993 32.300 19.100 1.00 0.00 ATOM 1313 CG PRO 170 21.319 31.754 19.632 1.00 0.00 ATOM 1314 CD PRO 170 21.763 30.702 18.648 1.00 0.00 ATOM 1315 O PRO 170 17.353 31.964 17.389 1.00 0.00 ATOM 1316 C PRO 170 18.499 31.526 17.224 1.00 0.00 ATOM 1317 N LEU 171 19.059 31.446 16.018 1.00 0.00 ATOM 1318 CA LEU 171 18.288 31.837 14.825 1.00 0.00 ATOM 1319 CB LEU 171 19.186 32.470 13.776 1.00 0.00 ATOM 1320 CG LEU 171 20.045 33.642 14.271 1.00 0.00 ATOM 1321 CD1 LEU 171 20.725 34.221 13.043 1.00 0.00 ATOM 1322 CD2 LEU 171 19.202 34.713 15.047 1.00 0.00 ATOM 1323 O LEU 171 16.806 30.841 13.219 1.00 0.00 ATOM 1324 C LEU 171 17.524 30.667 14.196 1.00 0.00 ATOM 1325 N GLY 172 17.662 29.486 14.772 1.00 0.00 ATOM 1326 CA GLY 172 17.120 28.293 14.185 1.00 0.00 ATOM 1327 O GLY 172 15.208 27.618 13.015 1.00 0.00 ATOM 1328 C GLY 172 15.641 28.322 13.893 1.00 0.00 ATOM 1329 N HIS 173 14.862 29.124 14.621 1.00 0.00 ATOM 1330 CA HIS 173 13.412 29.155 14.408 1.00 0.00 ATOM 1331 CB HIS 173 12.648 29.081 15.726 1.00 0.00 ATOM 1332 CG HIS 173 12.563 27.712 16.309 1.00 0.00 ATOM 1333 CD2 HIS 173 11.587 26.771 16.239 1.00 0.00 ATOM 1334 ND1 HIS 173 13.563 27.174 17.089 1.00 0.00 ATOM 1335 CE1 HIS 173 13.206 25.963 17.479 1.00 0.00 ATOM 1336 NE2 HIS 173 12.014 25.690 16.973 1.00 0.00 ATOM 1337 O HIS 173 11.840 30.765 13.631 1.00 0.00 ATOM 1338 C HIS 173 13.013 30.417 13.669 1.00 0.00 ATOM 1339 N LEU 174 14.000 31.103 13.098 1.00 0.00 ATOM 1340 CA LEU 174 13.782 32.383 12.428 1.00 0.00 ATOM 1341 CB LEU 174 14.615 33.480 13.113 1.00 0.00 ATOM 1342 CG LEU 174 14.094 33.887 14.498 1.00 0.00 ATOM 1343 CD1 LEU 174 15.209 34.484 15.329 1.00 0.00 ATOM 1344 CD2 LEU 174 12.894 34.848 14.413 1.00 0.00 ATOM 1345 O LEU 174 14.936 31.558 10.474 1.00 0.00 ATOM 1346 C LEU 174 14.087 32.328 10.936 1.00 0.00 ATOM 1347 N GLU 175 13.377 33.150 10.190 1.00 0.00 ATOM 1348 CA GLU 175 13.673 33.357 8.786 1.00 0.00 ATOM 1349 CB GLU 175 12.378 33.462 7.976 1.00 0.00 ATOM 1350 CG GLU 175 11.611 32.134 7.815 1.00 0.00 ATOM 1351 CD GLU 175 10.161 32.327 7.314 1.00 0.00 ATOM 1352 OE1 GLU 175 9.658 33.471 7.301 1.00 0.00 ATOM 1353 OE2 GLU 175 9.524 31.334 6.913 1.00 0.00 ATOM 1354 O GLU 175 14.319 35.577 9.427 1.00 0.00 ATOM 1355 C GLU 175 14.486 34.640 8.658 1.00 0.00 ATOM 1356 N LYS 176 15.365 34.669 7.678 1.00 0.00 ATOM 1357 CA LYS 176 16.229 35.809 7.396 1.00 0.00 ATOM 1358 CB LYS 176 16.927 35.585 6.046 1.00 0.00 ATOM 1359 CG LYS 176 17.993 36.632 5.714 1.00 0.00 ATOM 1360 CD LYS 176 19.369 36.170 6.226 1.00 0.00 ATOM 1361 CE LYS 176 20.181 37.363 6.713 1.00 0.00 ATOM 1362 NZ LYS 176 21.620 36.996 6.699 1.00 0.00 ATOM 1363 O LYS 176 16.052 38.093 8.182 1.00 0.00 ATOM 1364 C LYS 176 15.565 37.205 7.468 1.00 0.00 ATOM 1365 N PRO 177 14.444 37.416 6.763 1.00 0.00 ATOM 1366 CA PRO 177 13.800 38.747 6.927 1.00 0.00 ATOM 1367 CB PRO 177 12.507 38.620 6.109 1.00 0.00 ATOM 1368 CG PRO 177 12.800 37.565 5.107 1.00 0.00 ATOM 1369 CD PRO 177 13.702 36.572 5.805 1.00 0.00 ATOM 1370 O PRO 177 13.464 40.309 8.684 1.00 0.00 ATOM 1371 C PRO 177 13.454 39.116 8.350 1.00 0.00 ATOM 1372 N GLU 178 13.127 38.129 9.192 1.00 0.00 ATOM 1373 CA GLU 178 12.813 38.421 10.603 1.00 0.00 ATOM 1374 CB GLU 178 12.277 37.189 11.325 1.00 0.00 ATOM 1375 CG GLU 178 10.795 37.049 11.394 1.00 0.00 ATOM 1376 CD GLU 178 10.260 36.737 12.852 1.00 0.00 ATOM 1377 OE1 GLU 178 10.418 37.554 13.825 1.00 0.00 ATOM 1378 OE2 GLU 178 9.622 35.656 12.976 1.00 0.00 ATOM 1379 O GLU 178 14.034 39.879 12.090 1.00 0.00 ATOM 1380 C GLU 178 14.068 38.890 11.345 1.00 0.00 ATOM 1381 N VAL 179 15.162 38.158 11.136 1.00 0.00 ATOM 1382 CA VAL 179 16.471 38.504 11.702 1.00 0.00 ATOM 1383 CB VAL 179 17.542 37.505 11.215 1.00 0.00 ATOM 1384 CG1 VAL 179 18.953 37.989 11.520 1.00 0.00 ATOM 1385 CG2 VAL 179 17.263 36.113 11.813 1.00 0.00 ATOM 1386 O VAL 179 17.176 40.721 12.275 1.00 0.00 ATOM 1387 C VAL 179 16.791 39.982 11.388 1.00 0.00 ATOM 1388 N ARG 180 16.552 40.412 10.147 1.00 0.00 ATOM 1389 CA ARG 180 16.713 41.817 9.772 1.00 0.00 ATOM 1390 CB ARG 180 16.638 41.986 8.259 1.00 0.00 ATOM 1391 CG ARG 180 17.608 41.095 7.538 1.00 0.00 ATOM 1392 CD ARG 180 18.186 41.778 6.329 1.00 0.00 ATOM 1393 NE ARG 180 19.364 42.577 6.666 1.00 0.00 ATOM 1394 CZ ARG 180 20.621 42.285 6.331 1.00 0.00 ATOM 1395 NH1 ARG 180 21.570 43.120 6.699 1.00 0.00 ATOM 1396 NH2 ARG 180 20.920 41.192 5.634 1.00 0.00 ATOM 1397 O ARG 180 16.088 43.872 10.808 1.00 0.00 ATOM 1398 C ARG 180 15.726 42.751 10.450 1.00 0.00 ATOM 1399 N ARG 181 14.483 42.309 10.632 1.00 0.00 ATOM 1400 CA ARG 181 13.508 43.130 11.368 1.00 0.00 ATOM 1401 CB ARG 181 12.094 42.568 11.247 1.00 0.00 ATOM 1402 CG ARG 181 11.038 43.536 11.813 1.00 0.00 ATOM 1403 CD ARG 181 9.708 42.890 12.247 1.00 0.00 ATOM 1404 NE ARG 181 9.849 41.551 12.846 1.00 0.00 ATOM 1405 CZ ARG 181 10.062 41.295 14.132 1.00 0.00 ATOM 1406 NH1 ARG 181 10.189 42.264 15.014 1.00 0.00 ATOM 1407 NH2 ARG 181 10.158 40.047 14.531 1.00 0.00 ATOM 1408 O ARG 181 13.855 44.329 13.424 1.00 0.00 ATOM 1409 C ARG 181 13.915 43.257 12.840 1.00 0.00 ATOM 1410 N LEU 182 14.340 42.154 13.442 1.00 0.00 ATOM 1411 CA LEU 182 14.813 42.192 14.833 1.00 0.00 ATOM 1412 CB LEU 182 15.161 40.790 15.362 1.00 0.00 ATOM 1413 CG LEU 182 13.941 39.876 15.517 1.00 0.00 ATOM 1414 CD1 LEU 182 14.382 38.411 15.558 1.00 0.00 ATOM 1415 CD2 LEU 182 13.177 40.279 16.758 1.00 0.00 ATOM 1416 O LEU 182 16.085 43.857 15.960 1.00 0.00 ATOM 1417 C LEU 182 16.001 43.132 14.986 1.00 0.00 ATOM 1418 N ALA 183 16.904 43.112 14.010 1.00 0.00 ATOM 1419 CA ALA 183 18.083 43.970 14.048 1.00 0.00 ATOM 1420 CB ALA 183 19.076 43.575 12.962 1.00 0.00 ATOM 1421 O ALA 183 18.204 46.298 14.694 1.00 0.00 ATOM 1422 C ALA 183 17.701 45.457 13.944 1.00 0.00 ATOM 1423 N GLU 184 16.804 45.762 13.016 1.00 0.00 ATOM 1424 CA GLU 184 16.401 47.129 12.772 1.00 0.00 ATOM 1425 CB GLU 184 15.537 47.224 11.506 1.00 0.00 ATOM 1426 CG GLU 184 14.840 48.591 11.300 1.00 0.00 ATOM 1427 CD GLU 184 14.108 48.673 9.960 1.00 0.00 ATOM 1428 OE1 GLU 184 12.944 49.123 9.926 1.00 0.00 ATOM 1429 OE2 GLU 184 14.694 48.270 8.939 1.00 0.00 ATOM 1430 O GLU 184 15.961 48.793 14.404 1.00 0.00 ATOM 1431 C GLU 184 15.685 47.665 13.973 1.00 0.00 ATOM 1432 N GLU 185 14.783 46.869 14.555 1.00 0.00 ATOM 1433 CA GLU 185 14.035 47.352 15.742 1.00 0.00 ATOM 1434 CB GLU 185 12.860 46.452 16.084 1.00 0.00 ATOM 1435 CG GLU 185 11.754 46.451 15.043 1.00 0.00 ATOM 1436 CD GLU 185 10.763 45.302 15.261 1.00 0.00 ATOM 1437 OE1 GLU 185 10.992 44.483 16.194 1.00 0.00 ATOM 1438 OE2 GLU 185 9.779 45.200 14.493 1.00 0.00 ATOM 1439 O GLU 185 14.653 48.348 17.816 1.00 0.00 ATOM 1440 C GLU 185 14.933 47.532 16.957 1.00 0.00 ATOM 1441 N ALA 186 16.015 46.771 17.032 1.00 0.00 ATOM 1442 CA ALA 186 16.979 46.942 18.110 1.00 0.00 ATOM 1443 CB ALA 186 17.743 45.659 18.352 1.00 0.00 ATOM 1444 O ALA 186 18.756 48.436 18.669 1.00 0.00 ATOM 1445 C ALA 186 17.939 48.089 17.817 1.00 0.00 ATOM 1446 N GLY 187 17.838 48.671 16.619 1.00 0.00 ATOM 1447 CA GLY 187 18.753 49.726 16.181 1.00 0.00 ATOM 1448 O GLY 187 21.130 50.069 16.292 1.00 0.00 ATOM 1449 C GLY 187 20.216 49.280 16.057 1.00 0.00 ATOM 1450 N LEU 188 20.435 48.024 15.682 1.00 0.00 ATOM 1451 CA LEU 188 21.784 47.509 15.569 1.00 0.00 ATOM 1452 CB LEU 188 21.791 45.986 15.490 1.00 0.00 ATOM 1453 CG LEU 188 21.219 45.137 16.618 1.00 0.00 ATOM 1454 CD1 LEU 188 21.516 43.697 16.327 1.00 0.00 ATOM 1455 CD2 LEU 188 21.794 45.523 17.958 1.00 0.00 ATOM 1456 O LEU 188 21.810 48.120 13.255 1.00 0.00 ATOM 1457 C LEU 188 22.434 48.081 14.324 1.00 0.00 ATOM 1458 N SER 189 23.695 48.502 14.440 1.00 0.00 ATOM 1459 CA SER 189 24.364 49.143 13.297 1.00 0.00 ATOM 1460 CB SER 189 25.661 49.837 13.713 1.00 0.00 ATOM 1461 OG SER 189 26.578 48.904 14.231 1.00 0.00 ATOM 1462 O SER 189 24.700 48.656 10.988 1.00 0.00 ATOM 1463 C SER 189 24.582 48.207 12.117 1.00 0.00 ATOM 1464 N THR 190 24.578 46.904 12.361 1.00 0.00 ATOM 1465 CA THR 190 24.664 45.950 11.280 1.00 0.00 ATOM 1466 CB THR 190 25.309 44.657 11.770 1.00 0.00 ATOM 1467 CG2 THR 190 26.803 44.905 12.135 1.00 0.00 ATOM 1468 OG1 THR 190 24.584 44.182 12.912 1.00 0.00 ATOM 1469 O THR 190 23.298 44.758 9.687 1.00 0.00 ATOM 1470 C THR 190 23.327 45.617 10.583 1.00 0.00 ATOM 1471 N ALA 191 22.240 46.284 10.976 1.00 0.00 ATOM 1472 CA ALA 191 20.880 45.942 10.500 1.00 0.00 ATOM 1473 CB ALA 191 19.836 46.895 11.084 1.00 0.00 ATOM 1474 O ALA 191 20.189 44.916 8.422 1.00 0.00 ATOM 1475 C ALA 191 20.760 45.876 8.989 1.00 0.00 ATOM 1476 N LYS 192 21.330 46.878 8.331 1.00 0.00 ATOM 1477 CA LYS 192 21.330 46.937 6.860 1.00 0.00 ATOM 1478 CB LYS 192 21.049 48.367 6.383 1.00 0.00 ATOM 1479 CG LYS 192 19.697 48.912 6.837 1.00 0.00 ATOM 1480 CD LYS 192 18.564 48.105 6.193 1.00 0.00 ATOM 1481 CE LYS 192 17.241 48.252 6.961 1.00 0.00 ATOM 1482 NZ LYS 192 16.056 48.101 6.026 1.00 0.00 ATOM 1483 O LYS 192 22.684 46.393 4.956 1.00 0.00 ATOM 1484 C LYS 192 22.582 46.351 6.173 1.00 0.00 ATOM 1485 N LYS 193 23.512 45.800 6.941 1.00 0.00 ATOM 1486 CA LYS 193 24.755 45.279 6.388 1.00 0.00 ATOM 1487 CB LYS 193 25.755 45.006 7.505 1.00 0.00 ATOM 1488 CG LYS 193 27.094 44.501 7.050 1.00 0.00 ATOM 1489 CD LYS 193 28.098 44.518 8.198 1.00 0.00 ATOM 1490 CE LYS 193 29.416 43.913 7.737 1.00 0.00 ATOM 1491 NZ LYS 193 30.349 43.678 8.859 1.00 0.00 ATOM 1492 O LYS 193 24.009 43.023 6.072 1.00 0.00 ATOM 1493 C LYS 193 24.527 44.019 5.568 1.00 0.00 ATOM 1494 N LYS 194 24.934 44.075 4.301 1.00 0.00 ATOM 1495 CA LYS 194 24.790 42.967 3.367 1.00 0.00 ATOM 1496 CB LYS 194 24.974 43.463 1.922 1.00 0.00 ATOM 1497 CG LYS 194 24.015 44.612 1.507 1.00 0.00 ATOM 1498 CD LYS 194 22.555 44.130 1.430 1.00 0.00 ATOM 1499 CE LYS 194 21.550 45.287 1.229 1.00 0.00 ATOM 1500 NZ LYS 194 21.261 46.140 2.458 1.00 0.00 ATOM 1501 O LYS 194 26.895 42.101 4.091 1.00 0.00 ATOM 1502 C LYS 194 25.769 41.856 3.684 1.00 0.00 ATOM 1503 N ASP 195 25.338 40.619 3.509 1.00 0.00 ATOM 1504 CA ASP 195 26.200 39.494 3.832 1.00 0.00 ATOM 1505 CB ASP 195 25.384 38.219 4.074 1.00 0.00 ATOM 1506 CG ASP 195 24.265 38.418 5.119 1.00 0.00 ATOM 1507 OD1 ASP 195 23.083 38.317 4.723 1.00 0.00 ATOM 1508 OD2 ASP 195 24.563 38.698 6.315 1.00 0.00 ATOM 1509 O ASP 195 26.952 39.475 1.550 1.00 0.00 ATOM 1510 C ASP 195 27.232 39.289 2.740 1.00 0.00 ATOM 1511 N SER 196 28.441 38.943 3.159 1.00 0.00 ATOM 1512 CA SER 196 29.528 38.692 2.227 1.00 0.00 ATOM 1513 CB SER 196 30.876 38.590 2.963 1.00 0.00 ATOM 1514 OG SER 196 30.707 38.087 4.289 1.00 0.00 ATOM 1515 O SER 196 28.709 36.449 2.091 1.00 0.00 ATOM 1516 C SER 196 29.206 37.409 1.490 1.00 0.00 ATOM 1517 N THR 197 29.445 37.420 0.181 1.00 0.00 ATOM 1518 CA THR 197 29.208 36.243 -0.650 1.00 0.00 ATOM 1519 CB THR 197 28.540 36.612 -1.989 1.00 0.00 ATOM 1520 CG2 THR 197 27.200 37.310 -1.739 1.00 0.00 ATOM 1521 OG1 THR 197 29.405 37.476 -2.742 1.00 0.00 ATOM 1522 O THR 197 31.622 35.989 -0.702 1.00 0.00 ATOM 1523 C THR 197 30.509 35.465 -0.892 1.00 0.00 ATOM 1524 N GLY 198 30.357 34.206 -1.292 1.00 0.00 ATOM 1525 CA GLY 198 31.501 33.350 -1.581 1.00 0.00 ATOM 1526 O GLY 198 31.763 33.248 0.799 1.00 0.00 ATOM 1527 C GLY 198 32.198 32.909 -0.309 1.00 0.00 ATOM 1528 N ILE 199 33.282 32.151 -0.475 1.00 0.00 ATOM 1529 CA ILE 199 34.077 31.698 0.662 1.00 0.00 ATOM 1530 CB ILE 199 35.240 30.719 0.257 1.00 0.00 ATOM 1531 CG1 ILE 199 34.901 29.866 -1.000 1.00 0.00 ATOM 1532 CG2 ILE 199 35.680 29.891 1.475 1.00 0.00 ATOM 1533 CD1 ILE 199 33.638 28.938 -0.899 1.00 0.00 ATOM 1534 O ILE 199 34.998 33.926 0.727 1.00 0.00 ATOM 1535 C ILE 199 34.662 32.917 1.371 1.00 0.00 ATOM 1536 N CYS 200 34.770 32.803 2.695 1.00 0.00 ATOM 1537 CA CYS 200 35.266 33.862 3.569 1.00 0.00 ATOM 1538 CB CYS 200 35.324 33.351 5.035 1.00 0.00 ATOM 1539 SG CYS 200 36.529 31.980 5.436 1.00 0.00 ATOM 1540 O CYS 200 36.691 35.704 2.899 1.00 0.00 ATOM 1541 C CYS 200 36.604 34.486 3.106 1.00 0.00 ATOM 1542 N PHE 201 37.616 33.637 2.904 1.00 0.00 ATOM 1543 CA PHE 201 38.980 34.071 2.583 1.00 0.00 ATOM 1544 CB PHE 201 39.991 32.952 2.878 1.00 0.00 ATOM 1545 CG PHE 201 39.688 31.645 2.204 1.00 0.00 ATOM 1546 CD1 PHE 201 39.316 30.544 2.949 1.00 0.00 ATOM 1547 CD2 PHE 201 39.791 31.502 0.830 1.00 0.00 ATOM 1548 CE1 PHE 201 39.030 29.317 2.333 1.00 0.00 ATOM 1549 CE2 PHE 201 39.499 30.288 0.205 1.00 0.00 ATOM 1550 CZ PHE 201 39.123 29.197 0.959 1.00 0.00 ATOM 1551 O PHE 201 40.160 35.396 0.950 1.00 0.00 ATOM 1552 C PHE 201 39.200 34.643 1.168 1.00 0.00 ATOM 1553 N ILE 202 38.342 34.281 0.208 1.00 0.00 ATOM 1554 CA ILE 202 38.397 34.898 -1.137 1.00 0.00 ATOM 1555 CB ILE 202 38.171 33.868 -2.365 1.00 0.00 ATOM 1556 CG1 ILE 202 37.424 34.500 -3.556 1.00 0.00 ATOM 1557 CG2 ILE 202 37.526 32.555 -1.926 1.00 0.00 ATOM 1558 CD1 ILE 202 35.895 34.328 -3.541 1.00 0.00 ATOM 1559 O ILE 202 37.971 37.166 -1.901 1.00 0.00 ATOM 1560 C ILE 202 37.591 36.226 -1.191 1.00 0.00 ATOM 1561 N GLY 203 36.504 36.294 -0.417 1.00 0.00 ATOM 1562 CA GLY 203 35.734 37.530 -0.256 1.00 0.00 ATOM 1563 O GLY 203 34.503 37.446 -2.308 1.00 0.00 ATOM 1564 C GLY 203 35.240 38.108 -1.570 1.00 0.00 ATOM 1565 N GLU 204 35.630 39.345 -1.859 1.00 0.00 ATOM 1566 CA GLU 204 35.211 40.011 -3.094 1.00 0.00 ATOM 1567 CB GLU 204 34.577 41.384 -2.792 1.00 0.00 ATOM 1568 CG GLU 204 33.030 41.407 -2.783 1.00 0.00 ATOM 1569 CD GLU 204 32.393 40.426 -1.799 1.00 0.00 ATOM 1570 OE1 GLU 204 32.452 40.670 -0.577 1.00 0.00 ATOM 1571 OE2 GLU 204 31.812 39.417 -2.253 1.00 0.00 ATOM 1572 O GLU 204 36.257 40.876 -5.094 1.00 0.00 ATOM 1573 C GLU 204 36.338 40.094 -4.140 1.00 0.00 ATOM 1574 N LYS 205 37.383 39.283 -3.955 1.00 0.00 ATOM 1575 CA LYS 205 38.436 39.125 -4.971 1.00 0.00 ATOM 1576 CB LYS 205 39.863 39.100 -4.373 1.00 0.00 ATOM 1577 CG LYS 205 40.099 38.147 -3.203 1.00 0.00 ATOM 1578 CD LYS 205 41.440 38.425 -2.486 1.00 0.00 ATOM 1579 CE LYS 205 41.623 37.473 -1.279 1.00 0.00 ATOM 1580 NZ LYS 205 43.058 37.290 -0.839 1.00 0.00 ATOM 1581 O LYS 205 37.480 37.033 -5.683 1.00 0.00 ATOM 1582 C LYS 205 38.165 38.010 -5.980 1.00 0.00 ATOM 1583 N ASN 206 38.675 38.224 -7.187 1.00 0.00 ATOM 1584 CA ASN 206 38.525 37.333 -8.317 1.00 0.00 ATOM 1585 CB ASN 206 39.286 37.948 -9.491 1.00 0.00 ATOM 1586 CG ASN 206 39.071 37.214 -10.789 1.00 0.00 ATOM 1587 ND2 ASN 206 38.211 37.761 -11.640 1.00 0.00 ATOM 1588 OD1 ASN 206 39.704 36.193 -11.050 1.00 0.00 ATOM 1589 O ASN 206 40.158 35.738 -7.558 1.00 0.00 ATOM 1590 C ASN 206 39.022 35.917 -7.993 1.00 0.00 ATOM 1591 N PHE 207 38.158 34.923 -8.195 1.00 0.00 ATOM 1592 CA PHE 207 38.454 33.555 -7.799 1.00 0.00 ATOM 1593 CB PHE 207 37.229 32.662 -7.953 1.00 0.00 ATOM 1594 CG PHE 207 37.489 31.240 -7.574 1.00 0.00 ATOM 1595 CD1 PHE 207 37.424 30.843 -6.239 1.00 0.00 ATOM 1596 CD2 PHE 207 37.851 30.299 -8.545 1.00 0.00 ATOM 1597 CE1 PHE 207 37.694 29.527 -5.876 1.00 0.00 ATOM 1598 CE2 PHE 207 38.118 28.970 -8.188 1.00 0.00 ATOM 1599 CZ PHE 207 38.042 28.589 -6.853 1.00 0.00 ATOM 1600 O PHE 207 40.467 32.237 -7.947 1.00 0.00 ATOM 1601 C PHE 207 39.635 32.926 -8.542 1.00 0.00 ATOM 1602 N LYS 208 39.693 33.153 -9.847 1.00 0.00 ATOM 1603 CA LYS 208 40.735 32.584 -10.650 1.00 0.00 ATOM 1604 CB LYS 208 40.492 32.897 -12.128 1.00 0.00 ATOM 1605 CG LYS 208 41.345 32.062 -13.082 1.00 0.00 ATOM 1606 CD LYS 208 41.710 32.823 -14.327 1.00 0.00 ATOM 1607 CE LYS 208 42.557 31.947 -15.230 1.00 0.00 ATOM 1608 NZ LYS 208 43.068 32.719 -16.402 1.00 0.00 ATOM 1609 O LYS 208 43.088 32.398 -10.121 1.00 0.00 ATOM 1610 C LYS 208 42.089 33.129 -10.189 1.00 0.00 ATOM 1611 N ASN 209 42.105 34.422 -9.879 1.00 0.00 ATOM 1612 CA ASN 209 43.310 35.108 -9.459 1.00 0.00 ATOM 1613 CB ASN 209 43.072 36.618 -9.408 1.00 0.00 ATOM 1614 CG ASN 209 43.007 37.256 -10.795 1.00 0.00 ATOM 1615 ND2 ASN 209 42.408 38.445 -10.859 1.00 0.00 ATOM 1616 OD1 ASN 209 43.490 36.697 -11.791 1.00 0.00 ATOM 1617 O ASN 209 44.925 34.317 -7.889 1.00 0.00 ATOM 1618 C ASN 209 43.748 34.599 -8.105 1.00 0.00 ATOM 1619 N PHE 210 42.785 34.458 -7.209 1.00 0.00 ATOM 1620 CA PHE 210 43.047 33.975 -5.868 1.00 0.00 ATOM 1621 CB PHE 210 41.748 33.872 -5.050 1.00 0.00 ATOM 1622 CG PHE 210 41.961 33.303 -3.682 1.00 0.00 ATOM 1623 CD1 PHE 210 42.488 34.096 -2.663 1.00 0.00 ATOM 1624 CD2 PHE 210 41.684 31.958 -3.420 1.00 0.00 ATOM 1625 CE1 PHE 210 42.731 33.571 -1.390 1.00 0.00 ATOM 1626 CE2 PHE 210 41.909 31.421 -2.164 1.00 0.00 ATOM 1627 CZ PHE 210 42.440 32.237 -1.134 1.00 0.00 ATOM 1628 O PHE 210 44.838 32.490 -5.266 1.00 0.00 ATOM 1629 C PHE 210 43.764 32.629 -5.858 1.00 0.00 ATOM 1630 N LEU 211 43.129 31.658 -6.507 1.00 0.00 ATOM 1631 CA LEU 211 43.557 30.267 -6.538 1.00 0.00 ATOM 1632 CB LEU 211 42.472 29.437 -7.221 1.00 0.00 ATOM 1633 CG LEU 211 42.511 27.938 -6.990 1.00 0.00 ATOM 1634 CD1 LEU 211 42.630 27.676 -5.504 1.00 0.00 ATOM 1635 CD2 LEU 211 41.232 27.347 -7.536 1.00 0.00 ATOM 1636 O LEU 211 45.727 29.288 -6.775 1.00 0.00 ATOM 1637 C LEU 211 44.894 30.063 -7.226 1.00 0.00 ATOM 1638 N SER 212 45.103 30.795 -8.308 1.00 0.00 ATOM 1639 CA SER 212 46.366 30.764 -9.023 1.00 0.00 ATOM 1640 CB SER 212 46.235 31.468 -10.381 1.00 0.00 ATOM 1641 OG SER 212 45.918 32.839 -10.198 1.00 0.00 ATOM 1642 O SER 212 48.700 31.139 -8.642 1.00 0.00 ATOM 1643 C SER 212 47.558 31.326 -8.232 1.00 0.00 ATOM 1644 N ASN 213 47.294 32.031 -7.133 1.00 0.00 ATOM 1645 CA ASN 213 48.355 32.444 -6.208 1.00 0.00 ATOM 1646 CB ASN 213 47.861 33.529 -5.237 1.00 0.00 ATOM 1647 CG ASN 213 47.490 34.833 -5.937 1.00 0.00 ATOM 1648 ND2 ASN 213 46.465 35.503 -5.422 1.00 0.00 ATOM 1649 OD1 ASN 213 48.118 35.234 -6.916 1.00 0.00 ATOM 1650 O ASN 213 50.016 31.305 -4.891 1.00 0.00 ATOM 1651 C ASN 213 48.907 31.249 -5.416 1.00 0.00 ATOM 1652 N TYR 214 48.128 30.171 -5.345 1.00 0.00 ATOM 1653 CA TYR 214 48.486 29.006 -4.533 1.00 0.00 ATOM 1654 CB TYR 214 47.414 28.734 -3.465 1.00 0.00 ATOM 1655 CG TYR 214 47.178 29.915 -2.566 1.00 0.00 ATOM 1656 CD1 TYR 214 48.053 30.202 -1.503 1.00 0.00 ATOM 1657 CD2 TYR 214 46.106 30.769 -2.793 1.00 0.00 ATOM 1658 CE1 TYR 214 47.846 31.308 -0.679 1.00 0.00 ATOM 1659 CE2 TYR 214 45.882 31.874 -1.970 1.00 0.00 ATOM 1660 CZ TYR 214 46.753 32.141 -0.918 1.00 0.00 ATOM 1661 OH TYR 214 46.516 33.240 -0.122 1.00 0.00 ATOM 1662 O TYR 214 49.524 26.924 -4.980 1.00 0.00 ATOM 1663 C TYR 214 48.706 27.758 -5.344 1.00 0.00 ATOM 1664 N LEU 215 47.964 27.611 -6.433 1.00 0.00 ATOM 1665 CA LEU 215 48.102 26.416 -7.239 1.00 0.00 ATOM 1666 CB LEU 215 46.800 25.628 -7.248 1.00 0.00 ATOM 1667 CG LEU 215 46.399 25.005 -5.915 1.00 0.00 ATOM 1668 CD1 LEU 215 44.982 24.450 -6.012 1.00 0.00 ATOM 1669 CD2 LEU 215 47.425 23.948 -5.453 1.00 0.00 ATOM 1670 O LEU 215 47.984 27.672 -9.253 1.00 0.00 ATOM 1671 C LEU 215 48.530 26.746 -8.647 1.00 0.00 ATOM 1672 N PRO 216 49.512 25.989 -9.180 1.00 0.00 ATOM 1673 CA PRO 216 49.877 26.244 -10.564 1.00 0.00 ATOM 1674 CB PRO 216 51.084 25.330 -10.796 1.00 0.00 ATOM 1675 CG PRO 216 50.960 24.258 -9.769 1.00 0.00 ATOM 1676 CD PRO 216 50.275 24.875 -8.592 1.00 0.00 ATOM 1677 O PRO 216 48.118 24.742 -11.265 1.00 0.00 ATOM 1678 C PRO 216 48.698 25.837 -11.440 1.00 0.00 ATOM 1679 N ALA 217 48.295 26.742 -12.324 1.00 0.00 ATOM 1680 CA ALA 217 47.293 26.386 -13.308 1.00 0.00 ATOM 1681 CB ALA 217 46.384 27.559 -13.667 1.00 0.00 ATOM 1682 O ALA 217 49.061 26.411 -14.990 1.00 0.00 ATOM 1683 C ALA 217 48.039 25.861 -14.523 1.00 0.00 ATOM 1684 N GLN 218 47.531 24.740 -14.988 1.00 0.00 ATOM 1685 CA GLN 218 48.086 24.064 -16.101 1.00 0.00 ATOM 1686 CB GLN 218 48.671 22.718 -15.651 1.00 0.00 ATOM 1687 CG GLN 218 48.058 22.159 -14.348 1.00 0.00 ATOM 1688 CD GLN 218 48.986 21.208 -13.565 1.00 0.00 ATOM 1689 OE1 GLN 218 50.109 20.906 -13.983 1.00 0.00 ATOM 1690 NE2 GLN 218 48.504 20.746 -12.415 1.00 0.00 ATOM 1691 O GLN 218 46.030 23.093 -16.842 1.00 0.00 ATOM 1692 C GLN 218 46.895 23.951 -17.034 1.00 0.00 ATOM 1693 N PRO 219 46.793 24.896 -17.995 1.00 0.00 ATOM 1694 CA PRO 219 45.795 24.786 -19.061 1.00 0.00 ATOM 1695 CB PRO 219 46.118 25.971 -19.994 1.00 0.00 ATOM 1696 CG PRO 219 47.443 26.483 -19.563 1.00 0.00 ATOM 1697 CD PRO 219 47.587 26.136 -18.119 1.00 0.00 ATOM 1698 O PRO 219 47.072 22.944 -19.898 1.00 0.00 ATOM 1699 C PRO 219 45.956 23.466 -19.792 1.00 0.00 ATOM 1700 N GLY 220 44.843 22.913 -20.252 1.00 0.00 ATOM 1701 CA GLY 220 44.875 21.674 -21.007 1.00 0.00 ATOM 1702 O GLY 220 43.304 22.749 -22.406 1.00 0.00 ATOM 1703 C GLY 220 43.799 21.689 -22.048 1.00 0.00 ATOM 1704 N ARG 221 43.416 20.509 -22.516 1.00 0.00 ATOM 1705 CA ARG 221 42.495 20.388 -23.641 1.00 0.00 ATOM 1706 CB ARG 221 42.925 19.297 -24.637 1.00 0.00 ATOM 1707 CG ARG 221 44.323 19.446 -25.265 1.00 0.00 ATOM 1708 CD ARG 221 44.694 20.873 -25.658 1.00 0.00 ATOM 1709 NE ARG 221 43.765 21.441 -26.631 1.00 0.00 ATOM 1710 CZ ARG 221 43.843 22.671 -27.143 1.00 0.00 ATOM 1711 NH1 ARG 221 44.815 23.497 -26.787 1.00 0.00 ATOM 1712 NH2 ARG 221 42.942 23.071 -28.028 1.00 0.00 ATOM 1713 O ARG 221 40.762 19.523 -22.230 1.00 0.00 ATOM 1714 C ARG 221 41.055 20.178 -23.210 1.00 0.00 ATOM 1715 N MET 222 40.160 20.731 -23.992 1.00 0.00 ATOM 1716 CA MET 222 38.756 20.650 -23.731 1.00 0.00 ATOM 1717 CB MET 222 38.214 22.054 -23.897 1.00 0.00 ATOM 1718 CG MET 222 36.969 22.372 -23.227 1.00 0.00 ATOM 1719 SD MET 222 36.713 24.326 -23.375 1.00 0.00 ATOM 1720 CE MET 222 37.386 24.954 -21.711 1.00 0.00 ATOM 1721 O MET 222 38.631 19.895 -25.982 1.00 0.00 ATOM 1722 C MET 222 38.251 19.730 -24.837 1.00 0.00 ATOM 1723 N MET 223 37.419 18.754 -24.501 1.00 0.00 ATOM 1724 CA MET 223 36.980 17.737 -25.463 1.00 0.00 ATOM 1725 CB MET 223 37.687 16.374 -25.250 1.00 0.00 ATOM 1726 CG MET 223 39.190 16.389 -25.198 1.00 0.00 ATOM 1727 SD MET 223 39.967 16.609 -26.924 1.00 0.00 ATOM 1728 CE MET 223 41.809 16.069 -26.494 1.00 0.00 ATOM 1729 O MET 223 34.973 17.618 -24.210 1.00 0.00 ATOM 1730 C MET 223 35.509 17.496 -25.294 1.00 0.00 ATOM 1731 N THR 224 34.850 17.138 -26.375 1.00 0.00 ATOM 1732 CA THR 224 33.515 16.606 -26.251 1.00 0.00 ATOM 1733 CB THR 224 32.681 16.742 -27.529 1.00 0.00 ATOM 1734 CG2 THR 224 32.651 18.187 -28.039 1.00 0.00 ATOM 1735 OG1 THR 224 33.212 15.858 -28.528 1.00 0.00 ATOM 1736 O THR 224 34.758 14.550 -26.086 1.00 0.00 ATOM 1737 C THR 224 33.665 15.139 -25.948 1.00 0.00 ATOM 1738 N VAL 225 32.547 14.552 -25.536 1.00 0.00 ATOM 1739 CA VAL 225 32.471 13.135 -25.179 1.00 0.00 ATOM 1740 CB VAL 225 31.098 12.832 -24.492 1.00 0.00 ATOM 1741 CG1 VAL 225 30.821 11.376 -24.399 1.00 0.00 ATOM 1742 CG2 VAL 225 31.108 13.403 -23.080 1.00 0.00 ATOM 1743 O VAL 225 33.224 11.058 -26.089 1.00 0.00 ATOM 1744 C VAL 225 32.834 12.191 -26.342 1.00 0.00 ATOM 1745 N ASP 226 32.740 12.659 -27.595 1.00 0.00 ATOM 1746 CA ASP 226 33.139 11.849 -28.778 1.00 0.00 ATOM 1747 CB ASP 226 32.246 12.063 -30.014 1.00 0.00 ATOM 1748 CG ASP 226 30.783 12.245 -29.678 1.00 0.00 ATOM 1749 OD1 ASP 226 30.197 11.397 -28.954 1.00 0.00 ATOM 1750 OD2 ASP 226 30.215 13.263 -30.146 1.00 0.00 ATOM 1751 O ASP 226 35.005 11.764 -30.285 1.00 0.00 ATOM 1752 C ASP 226 34.560 12.165 -29.196 1.00 0.00 ATOM 1753 N GLY 227 35.260 12.908 -28.353 1.00 0.00 ATOM 1754 CA GLY 227 36.682 13.122 -28.514 1.00 0.00 ATOM 1755 O GLY 227 38.287 14.451 -29.612 1.00 0.00 ATOM 1756 C GLY 227 37.109 14.321 -29.322 1.00 0.00 ATOM 1757 N ARG 228 36.176 15.200 -29.692 1.00 0.00 ATOM 1758 CA ARG 228 36.525 16.353 -30.534 1.00 0.00 ATOM 1759 CB ARG 228 35.325 16.829 -31.359 1.00 0.00 ATOM 1760 CG ARG 228 35.669 17.494 -32.696 1.00 0.00 ATOM 1761 CD ARG 228 35.977 19.006 -32.604 1.00 0.00 ATOM 1762 NE ARG 228 37.420 19.325 -32.600 1.00 0.00 ATOM 1763 CZ ARG 228 38.057 20.081 -33.502 1.00 0.00 ATOM 1764 NH1 ARG 228 37.393 20.657 -34.517 1.00 0.00 ATOM 1765 NH2 ARG 228 39.363 20.297 -33.367 1.00 0.00 ATOM 1766 O ARG 228 36.406 17.947 -28.725 1.00 0.00 ATOM 1767 C ARG 228 37.070 17.497 -29.678 1.00 0.00 ATOM 1768 N ASP 229 38.279 17.948 -30.031 1.00 0.00 ATOM 1769 CA ASP 229 38.964 19.024 -29.321 1.00 0.00 ATOM 1770 CB ASP 229 40.406 19.196 -29.809 1.00 0.00 ATOM 1771 CG ASP 229 41.221 20.134 -28.906 1.00 0.00 ATOM 1772 OD1 ASP 229 42.050 19.636 -28.119 1.00 0.00 ATOM 1773 OD2 ASP 229 41.019 21.370 -28.965 1.00 0.00 ATOM 1774 O ASP 229 37.926 20.774 -30.584 1.00 0.00 ATOM 1775 C ASP 229 38.204 20.344 -29.474 1.00 0.00 ATOM 1776 N MET 230 37.915 20.989 -28.354 1.00 0.00 ATOM 1777 CA MET 230 37.063 22.153 -28.340 1.00 0.00 ATOM 1778 CB MET 230 35.891 21.950 -27.375 1.00 0.00 ATOM 1779 CG MET 230 34.885 20.916 -27.833 1.00 0.00 ATOM 1780 SD MET 230 33.925 21.411 -29.484 1.00 0.00 ATOM 1781 CE MET 230 35.032 20.677 -30.807 1.00 0.00 ATOM 1782 O MET 230 37.214 24.455 -27.815 1.00 0.00 ATOM 1783 C MET 230 37.820 23.405 -27.965 1.00 0.00 ATOM 1784 N GLY 231 39.138 23.297 -27.812 1.00 0.00 ATOM 1785 CA GLY 231 39.947 24.423 -27.349 1.00 0.00 ATOM 1786 O GLY 231 40.684 23.002 -25.524 1.00 0.00 ATOM 1787 C GLY 231 40.656 24.142 -26.036 1.00 0.00 ATOM 1788 N GLU 232 41.245 25.195 -25.493 1.00 0.00 ATOM 1789 CA GLU 232 42.001 25.111 -24.256 1.00 0.00 ATOM 1790 CB GLU 232 43.219 26.012 -24.398 1.00 0.00 ATOM 1791 CG GLU 232 44.228 25.926 -23.296 1.00 0.00 ATOM 1792 CD GLU 232 45.428 26.800 -23.600 1.00 0.00 ATOM 1793 OE1 GLU 232 45.303 28.028 -23.454 1.00 0.00 ATOM 1794 OE2 GLU 232 46.491 26.268 -24.001 1.00 0.00 ATOM 1795 O GLU 232 40.487 26.579 -23.137 1.00 0.00 ATOM 1796 C GLU 232 41.155 25.549 -23.066 1.00 0.00 ATOM 1797 N HIS 233 41.165 24.771 -21.986 1.00 0.00 ATOM 1798 CA HIS 233 40.635 25.250 -20.705 1.00 0.00 ATOM 1799 CB HIS 233 39.954 24.145 -19.896 1.00 0.00 ATOM 1800 CG HIS 233 40.877 23.047 -19.474 1.00 0.00 ATOM 1801 CD2 HIS 233 41.149 21.846 -20.035 1.00 0.00 ATOM 1802 ND1 HIS 233 41.659 23.128 -18.345 1.00 0.00 ATOM 1803 CE1 HIS 233 42.381 22.026 -18.232 1.00 0.00 ATOM 1804 NE2 HIS 233 42.086 21.231 -19.242 1.00 0.00 ATOM 1805 O HIS 233 42.938 25.756 -20.252 1.00 0.00 ATOM 1806 C HIS 233 41.762 25.898 -19.898 1.00 0.00 ATOM 1807 N ALA 234 41.392 26.597 -18.822 1.00 0.00 ATOM 1808 CA ALA 234 42.335 27.432 -18.062 1.00 0.00 ATOM 1809 CB ALA 234 41.621 28.670 -17.534 1.00 0.00 ATOM 1810 O ALA 234 44.115 27.138 -16.429 1.00 0.00 ATOM 1811 C ALA 234 43.071 26.679 -16.927 1.00 0.00 ATOM 1812 N GLY 235 42.540 25.509 -16.579 1.00 0.00 ATOM 1813 CA GLY 235 43.054 24.634 -15.535 1.00 0.00 ATOM 1814 O GLY 235 40.795 24.710 -14.787 1.00 0.00 ATOM 1815 C GLY 235 41.801 24.020 -14.941 1.00 0.00 ATOM 1816 N LEU 236 41.841 22.739 -14.606 1.00 0.00 ATOM 1817 CA LEU 236 40.639 22.005 -14.199 1.00 0.00 ATOM 1818 CB LEU 236 40.934 20.491 -14.108 1.00 0.00 ATOM 1819 CG LEU 236 41.248 19.744 -15.424 1.00 0.00 ATOM 1820 CD1 LEU 236 41.408 18.257 -15.192 1.00 0.00 ATOM 1821 CD2 LEU 236 40.148 19.973 -16.424 1.00 0.00 ATOM 1822 O LEU 236 38.783 22.372 -12.676 1.00 0.00 ATOM 1823 C LEU 236 40.005 22.518 -12.901 1.00 0.00 ATOM 1824 N MET 237 40.827 23.108 -12.038 1.00 0.00 ATOM 1825 CA MET 237 40.318 23.640 -10.774 1.00 0.00 ATOM 1826 CB MET 237 41.451 24.035 -9.811 1.00 0.00 ATOM 1827 CG MET 237 42.353 25.173 -10.243 1.00 0.00 ATOM 1828 SD MET 237 43.619 25.034 -11.044 1.00 0.00 ATOM 1829 CE MET 237 44.735 26.849 -9.873 1.00 0.00 ATOM 1830 O MET 237 38.398 24.945 -10.157 1.00 0.00 ATOM 1831 C MET 237 39.281 24.751 -10.987 1.00 0.00 ATOM 1832 N TYR 238 39.338 25.410 -12.136 1.00 0.00 ATOM 1833 CA TYR 238 38.410 26.505 -12.442 1.00 0.00 ATOM 1834 CB TYR 238 39.051 27.472 -13.440 1.00 0.00 ATOM 1835 CG TYR 238 40.322 27.996 -12.870 1.00 0.00 ATOM 1836 CD1 TYR 238 40.322 28.588 -11.600 1.00 0.00 ATOM 1837 CD2 TYR 238 41.514 27.863 -13.541 1.00 0.00 ATOM 1838 CE1 TYR 238 41.472 29.051 -11.033 1.00 0.00 ATOM 1839 CE2 TYR 238 42.680 28.338 -12.992 1.00 0.00 ATOM 1840 CZ TYR 238 42.640 28.924 -11.724 1.00 0.00 ATOM 1841 OH TYR 238 43.774 29.402 -11.139 1.00 0.00 ATOM 1842 O TYR 238 36.229 26.993 -13.279 1.00 0.00 ATOM 1843 C TYR 238 37.022 26.106 -12.926 1.00 0.00 ATOM 1844 N TYR 239 36.718 24.807 -12.915 1.00 0.00 ATOM 1845 CA TYR 239 35.464 24.283 -13.471 1.00 0.00 ATOM 1846 CB TYR 239 35.712 23.580 -14.819 1.00 0.00 ATOM 1847 CG TYR 239 36.447 24.465 -15.807 1.00 0.00 ATOM 1848 CD1 TYR 239 35.750 25.370 -16.622 1.00 0.00 ATOM 1849 CD2 TYR 239 37.849 24.435 -15.883 1.00 0.00 ATOM 1850 CE1 TYR 239 36.433 26.192 -17.515 1.00 0.00 ATOM 1851 CE2 TYR 239 38.524 25.258 -16.749 1.00 0.00 ATOM 1852 CZ TYR 239 37.811 26.133 -17.559 1.00 0.00 ATOM 1853 OH TYR 239 38.511 26.933 -18.415 1.00 0.00 ATOM 1854 O TYR 239 35.733 22.611 -11.876 1.00 0.00 ATOM 1855 C TYR 239 34.932 23.273 -12.526 1.00 0.00 ATOM 1856 N THR 240 33.610 23.126 -12.462 1.00 0.00 ATOM 1857 CA THR 240 32.995 22.073 -11.661 1.00 0.00 ATOM 1858 CB THR 240 32.067 22.592 -10.486 1.00 0.00 ATOM 1859 CG2 THR 240 31.978 21.558 -9.388 1.00 0.00 ATOM 1860 OG1 THR 240 32.541 23.829 -9.951 1.00 0.00 ATOM 1861 O THR 240 31.410 21.820 -13.405 1.00 0.00 ATOM 1862 C THR 240 32.059 21.271 -12.522 1.00 0.00 ATOM 1863 N ILE 241 31.904 19.997 -12.185 1.00 0.00 ATOM 1864 CA ILE 241 30.948 19.155 -12.883 1.00 0.00 ATOM 1865 CB ILE 241 30.827 17.754 -12.212 1.00 0.00 ATOM 1866 CG1 ILE 241 32.199 17.020 -12.194 1.00 0.00 ATOM 1867 CG2 ILE 241 29.742 16.914 -12.900 1.00 0.00 ATOM 1868 CD1 ILE 241 32.909 16.926 -13.593 1.00 0.00 ATOM 1869 O ILE 241 29.028 20.277 -11.924 1.00 0.00 ATOM 1870 C ILE 241 29.589 19.870 -12.956 1.00 0.00 ATOM 1871 N GLY 242 29.104 20.063 -14.175 1.00 0.00 ATOM 1872 CA GLY 242 27.752 20.523 -14.418 1.00 0.00 ATOM 1873 O GLY 242 26.541 22.444 -15.121 1.00 0.00 ATOM 1874 C GLY 242 27.630 21.974 -14.756 1.00 0.00 ATOM 1875 N GLN 243 28.731 22.702 -14.613 1.00 0.00 ATOM 1876 CA GLN 243 28.673 24.134 -14.749 1.00 0.00 ATOM 1877 CB GLN 243 29.953 24.804 -14.225 1.00 0.00 ATOM 1878 CG GLN 243 31.018 25.134 -15.260 1.00 0.00 ATOM 1879 CD GLN 243 32.215 25.869 -14.676 1.00 0.00 ATOM 1880 OE1 GLN 243 32.604 25.631 -13.532 1.00 0.00 ATOM 1881 NE2 GLN 243 32.820 26.747 -15.467 1.00 0.00 ATOM 1882 O GLN 243 28.833 23.830 -17.079 1.00 0.00 ATOM 1883 C GLN 243 28.388 24.500 -16.186 1.00 0.00 ATOM 1884 N ARG 244 27.617 25.563 -16.381 1.00 0.00 ATOM 1885 CA ARG 244 27.323 26.111 -17.669 1.00 0.00 ATOM 1886 CB ARG 244 25.944 26.762 -17.657 1.00 0.00 ATOM 1887 CG ARG 244 25.569 27.239 -19.007 1.00 0.00 ATOM 1888 CD ARG 244 25.171 28.669 -19.060 1.00 0.00 ATOM 1889 NE ARG 244 23.733 28.695 -19.196 1.00 0.00 ATOM 1890 CZ ARG 244 23.050 29.296 -20.146 1.00 0.00 ATOM 1891 NH1 ARG 244 23.615 30.036 -21.078 1.00 0.00 ATOM 1892 NH2 ARG 244 21.753 29.181 -20.105 1.00 0.00 ATOM 1893 O ARG 244 28.597 28.111 -17.203 1.00 0.00 ATOM 1894 C ARG 244 28.344 27.193 -18.005 1.00 0.00 ATOM 1895 N GLY 245 28.882 27.120 -19.219 1.00 0.00 ATOM 1896 CA GLY 245 29.929 28.031 -19.650 1.00 0.00 ATOM 1897 O GLY 245 31.382 26.903 -18.088 1.00 0.00 ATOM 1898 C GLY 245 31.152 27.918 -18.763 1.00 0.00 ATOM 1899 N GLY 246 31.942 28.973 -18.752 1.00 0.00 ATOM 1900 CA GLY 246 33.166 28.955 -17.975 1.00 0.00 ATOM 1901 O GLY 246 34.079 29.888 -19.946 1.00 0.00 ATOM 1902 C GLY 246 34.287 29.518 -18.798 1.00 0.00 ATOM 1903 N LEU 247 35.475 29.570 -18.202 1.00 0.00 ATOM 1904 CA LEU 247 36.642 30.189 -18.843 1.00 0.00 ATOM 1905 CB LEU 247 37.840 30.204 -17.871 1.00 0.00 ATOM 1906 CG LEU 247 37.643 31.045 -16.603 1.00 0.00 ATOM 1907 CD1 LEU 247 38.608 30.672 -15.463 1.00 0.00 ATOM 1908 CD2 LEU 247 37.716 32.542 -16.957 1.00 0.00 ATOM 1909 O LEU 247 37.317 28.296 -20.167 1.00 0.00 ATOM 1910 C LEU 247 36.978 29.485 -20.162 1.00 0.00 ATOM 1911 N GLY 248 36.841 30.209 -21.273 1.00 0.00 ATOM 1912 CA GLY 248 37.078 29.647 -22.610 1.00 0.00 ATOM 1913 O GLY 248 36.209 27.977 -24.094 1.00 0.00 ATOM 1914 C GLY 248 36.005 28.697 -23.124 1.00 0.00 ATOM 1915 N ILE 249 34.861 28.670 -22.469 1.00 0.00 ATOM 1916 CA ILE 249 33.754 27.898 -22.985 1.00 0.00 ATOM 1917 CB ILE 249 33.024 27.075 -21.900 1.00 0.00 ATOM 1918 CG1 ILE 249 34.010 26.226 -21.104 1.00 0.00 ATOM 1919 CG2 ILE 249 31.993 26.151 -22.534 1.00 0.00 ATOM 1920 CD1 ILE 249 33.359 25.188 -20.265 1.00 0.00 ATOM 1921 O ILE 249 31.787 29.284 -23.246 1.00 0.00 ATOM 1922 C ILE 249 32.817 28.835 -23.753 1.00 0.00 ATOM 1923 N GLY 250 33.276 29.178 -24.957 1.00 0.00 ATOM 1924 CA GLY 250 32.459 29.690 -26.059 1.00 0.00 ATOM 1925 O GLY 250 31.788 28.820 -28.195 1.00 0.00 ATOM 1926 C GLY 250 32.424 28.618 -27.149 1.00 0.00 ATOM 1927 N GLY 251 33.121 27.489 -26.899 1.00 0.00 ATOM 1928 CA GLY 251 33.038 26.264 -27.719 1.00 0.00 ATOM 1929 O GLY 251 32.994 27.146 -29.994 1.00 0.00 ATOM 1930 C GLY 251 33.509 26.354 -29.179 1.00 0.00 ATOM 1931 N ASP 256 26.165 26.257 -33.704 1.00 0.00 ATOM 1932 CA ASP 256 25.092 26.199 -32.692 1.00 0.00 ATOM 1933 CB ASP 256 25.089 24.823 -31.979 1.00 0.00 ATOM 1934 CG ASP 256 23.781 24.534 -31.196 1.00 0.00 ATOM 1935 OD1 ASP 256 23.596 23.383 -30.749 1.00 0.00 ATOM 1936 OD2 ASP 256 22.933 25.426 -31.014 1.00 0.00 ATOM 1937 O ASP 256 26.247 27.785 -31.244 1.00 0.00 ATOM 1938 C ASP 256 25.159 27.348 -31.659 1.00 0.00 ATOM 1939 N ASN 257 23.975 27.814 -31.248 1.00 0.00 ATOM 1940 CA ASN 257 23.818 28.862 -30.239 1.00 0.00 ATOM 1941 CB ASN 257 22.613 29.723 -30.618 1.00 0.00 ATOM 1942 CG ASN 257 22.976 30.846 -31.596 1.00 0.00 ATOM 1943 ND2 ASN 257 22.069 31.156 -32.555 1.00 0.00 ATOM 1944 OD1 ASN 257 24.055 31.447 -31.472 1.00 0.00 ATOM 1945 O ASN 257 23.882 29.177 -27.823 1.00 0.00 ATOM 1946 C ASN 257 23.686 28.379 -28.768 1.00 0.00 ATOM 1947 N ALA 258 23.346 27.095 -28.586 1.00 0.00 ATOM 1948 CA ALA 258 22.991 26.545 -27.274 1.00 0.00 ATOM 1949 CB ALA 258 22.253 25.203 -27.415 1.00 0.00 ATOM 1950 O ALA 258 25.360 26.301 -26.797 1.00 0.00 ATOM 1951 C ALA 258 24.208 26.416 -26.327 1.00 0.00 ATOM 1952 N PRO 259 23.964 26.463 -24.989 1.00 0.00 ATOM 1953 CA PRO 259 25.129 26.515 -24.131 1.00 0.00 ATOM 1954 CB PRO 259 24.581 27.110 -22.829 1.00 0.00 ATOM 1955 CG PRO 259 23.166 26.734 -22.791 1.00 0.00 ATOM 1956 CD PRO 259 22.707 26.530 -24.214 1.00 0.00 ATOM 1957 O PRO 259 25.161 24.097 -24.052 1.00 0.00 ATOM 1958 C PRO 259 25.783 25.160 -23.906 1.00 0.00 ATOM 1959 N TRP 260 27.054 25.244 -23.552 1.00 0.00 ATOM 1960 CA TRP 260 27.871 24.107 -23.254 1.00 0.00 ATOM 1961 CB TRP 260 29.235 24.295 -23.885 1.00 0.00 ATOM 1962 CG TRP 260 29.168 24.183 -25.353 1.00 0.00 ATOM 1963 CD1 TRP 260 28.824 25.172 -26.237 1.00 0.00 ATOM 1964 CD2 TRP 260 29.441 23.004 -26.151 1.00 0.00 ATOM 1965 CE2 TRP 260 29.250 23.361 -27.495 1.00 0.00 ATOM 1966 CE3 TRP 260 29.820 21.694 -25.852 1.00 0.00 ATOM 1967 NE1 TRP 260 28.874 24.682 -27.519 1.00 0.00 ATOM 1968 CZ2 TRP 260 29.431 22.447 -28.550 1.00 0.00 ATOM 1969 CZ3 TRP 260 29.992 20.766 -26.909 1.00 0.00 ATOM 1970 CH2 TRP 260 29.804 21.153 -28.230 1.00 0.00 ATOM 1971 O TRP 260 27.807 24.979 -21.033 1.00 0.00 ATOM 1972 C TRP 260 27.959 23.984 -21.743 1.00 0.00 ATOM 1973 N PHE 261 28.135 22.748 -21.278 1.00 0.00 ATOM 1974 CA PHE 261 28.302 22.427 -19.866 1.00 0.00 ATOM 1975 CB PHE 261 27.105 21.637 -19.328 1.00 0.00 ATOM 1976 CG PHE 261 25.793 22.388 -19.422 1.00 0.00 ATOM 1977 CD1 PHE 261 25.265 23.036 -18.313 1.00 0.00 ATOM 1978 CD2 PHE 261 25.083 22.434 -20.620 1.00 0.00 ATOM 1979 CE1 PHE 261 24.054 23.734 -18.399 1.00 0.00 ATOM 1980 CE2 PHE 261 23.861 23.161 -20.721 1.00 0.00 ATOM 1981 CZ PHE 261 23.357 23.796 -19.604 1.00 0.00 ATOM 1982 O PHE 261 30.009 20.961 -20.692 1.00 0.00 ATOM 1983 C PHE 261 29.564 21.593 -19.723 1.00 0.00 ATOM 1984 N VAL 262 30.145 21.632 -18.525 1.00 0.00 ATOM 1985 CA VAL 262 31.218 20.752 -18.149 1.00 0.00 ATOM 1986 CB VAL 262 32.012 21.324 -16.942 1.00 0.00 ATOM 1987 CG1 VAL 262 33.012 20.297 -16.455 1.00 0.00 ATOM 1988 CG2 VAL 262 32.733 22.652 -17.318 1.00 0.00 ATOM 1989 O VAL 262 29.803 19.351 -16.811 1.00 0.00 ATOM 1990 C VAL 262 30.583 19.420 -17.766 1.00 0.00 ATOM 1991 N VAL 263 30.933 18.356 -18.475 1.00 0.00 ATOM 1992 CA VAL 263 30.258 17.070 -18.273 1.00 0.00 ATOM 1993 CB VAL 263 29.512 16.582 -19.565 1.00 0.00 ATOM 1994 CG1 VAL 263 28.457 17.610 -19.982 1.00 0.00 ATOM 1995 CG2 VAL 263 30.486 16.333 -20.695 1.00 0.00 ATOM 1996 O VAL 263 30.732 14.889 -17.445 1.00 0.00 ATOM 1997 C VAL 263 31.172 16.002 -17.735 1.00 0.00 ATOM 1998 N GLY 264 32.447 16.327 -17.557 1.00 0.00 ATOM 1999 CA GLY 264 33.379 15.371 -16.936 1.00 0.00 ATOM 2000 O GLY 264 34.993 17.058 -17.380 1.00 0.00 ATOM 2001 C GLY 264 34.753 15.990 -16.837 1.00 0.00 ATOM 2002 N LYS 265 35.663 15.316 -16.154 1.00 0.00 ATOM 2003 CA LYS 265 37.043 15.756 -16.060 1.00 0.00 ATOM 2004 CB LYS 265 37.288 16.482 -14.743 1.00 0.00 ATOM 2005 CG LYS 265 36.896 17.961 -14.717 1.00 0.00 ATOM 2006 CD LYS 265 36.603 18.352 -13.274 1.00 0.00 ATOM 2007 CE LYS 265 36.946 19.786 -12.923 1.00 0.00 ATOM 2008 NZ LYS 265 37.090 19.891 -11.429 1.00 0.00 ATOM 2009 O LYS 265 37.480 13.434 -15.722 1.00 0.00 ATOM 2010 C LYS 265 37.919 14.529 -16.100 1.00 0.00 ATOM 2011 N ASP 266 39.149 14.715 -16.574 1.00 0.00 ATOM 2012 CA ASP 266 40.171 13.698 -16.495 1.00 0.00 ATOM 2013 CB ASP 266 40.306 12.935 -17.796 1.00 0.00 ATOM 2014 CG ASP 266 41.084 11.632 -17.633 1.00 0.00 ATOM 2015 OD1 ASP 266 41.945 11.488 -16.720 1.00 0.00 ATOM 2016 OD2 ASP 266 40.828 10.735 -18.452 1.00 0.00 ATOM 2017 O ASP 266 42.278 14.706 -16.992 1.00 0.00 ATOM 2018 C ASP 266 41.488 14.331 -16.133 1.00 0.00 ATOM 2019 N LEU 267 41.711 14.415 -14.833 1.00 0.00 ATOM 2020 CA LEU 267 42.915 14.936 -14.237 1.00 0.00 ATOM 2021 CB LEU 267 42.868 14.735 -12.724 1.00 0.00 ATOM 2022 CG LEU 267 43.887 15.470 -11.845 1.00 0.00 ATOM 2023 CD1 LEU 267 43.481 16.933 -11.687 1.00 0.00 ATOM 2024 CD2 LEU 267 44.007 14.803 -10.471 1.00 0.00 ATOM 2025 O LEU 267 45.138 14.986 -15.026 1.00 0.00 ATOM 2026 C LEU 267 44.153 14.294 -14.797 1.00 0.00 ATOM 2027 N SER 268 44.110 12.988 -15.051 1.00 0.00 ATOM 2028 CA SER 268 45.309 12.299 -15.525 1.00 0.00 ATOM 2029 CB SER 268 45.155 10.784 -15.414 1.00 0.00 ATOM 2030 OG SER 268 44.400 10.286 -16.501 1.00 0.00 ATOM 2031 O SER 268 46.933 12.554 -17.280 1.00 0.00 ATOM 2032 C SER 268 45.768 12.710 -16.945 1.00 0.00 ATOM 2033 N LYS 269 44.864 13.243 -17.761 1.00 0.00 ATOM 2034 CA LYS 269 45.236 13.776 -19.071 1.00 0.00 ATOM 2035 CB LYS 269 44.351 13.198 -20.173 1.00 0.00 ATOM 2036 CG LYS 269 44.405 11.692 -20.421 1.00 0.00 ATOM 2037 CD LYS 269 43.012 11.319 -20.934 1.00 0.00 ATOM 2038 CE LYS 269 42.943 9.999 -21.607 1.00 0.00 ATOM 2039 NZ LYS 269 43.012 8.921 -20.608 1.00 0.00 ATOM 2040 O LYS 269 45.311 15.919 -20.142 1.00 0.00 ATOM 2041 C LYS 269 45.086 15.291 -19.103 1.00 0.00 ATOM 2042 N ASN 270 44.683 15.871 -17.972 1.00 0.00 ATOM 2043 CA ASN 270 44.417 17.308 -17.878 1.00 0.00 ATOM 2044 CB ASN 270 45.714 18.113 -18.101 1.00 0.00 ATOM 2045 CG ASN 270 45.607 19.573 -17.642 1.00 0.00 ATOM 2046 ND2 ASN 270 44.692 19.859 -16.729 1.00 0.00 ATOM 2047 OD1 ASN 270 46.361 20.425 -18.110 1.00 0.00 ATOM 2048 O ASN 270 43.277 18.846 -19.399 1.00 0.00 ATOM 2049 C ASN 270 43.265 17.743 -18.823 1.00 0.00 ATOM 2050 N ILE 271 42.268 16.865 -18.965 1.00 0.00 ATOM 2051 CA ILE 271 41.155 17.096 -19.905 1.00 0.00 ATOM 2052 CB ILE 271 40.837 15.852 -20.783 1.00 0.00 ATOM 2053 CG1 ILE 271 41.922 15.667 -21.820 1.00 0.00 ATOM 2054 CG2 ILE 271 39.485 16.017 -21.529 1.00 0.00 ATOM 2055 CD1 ILE 271 41.780 14.417 -22.619 1.00 0.00 ATOM 2056 O ILE 271 39.485 16.991 -18.203 1.00 0.00 ATOM 2057 C ILE 271 39.885 17.549 -19.231 1.00 0.00 ATOM 2058 N LEU 272 39.254 18.554 -19.830 1.00 0.00 ATOM 2059 CA LEU 272 37.914 19.006 -19.456 1.00 0.00 ATOM 2060 CB LEU 272 37.858 20.542 -19.451 1.00 0.00 ATOM 2061 CG LEU 272 36.542 21.110 -18.902 1.00 0.00 ATOM 2062 CD1 LEU 272 36.386 20.826 -17.401 1.00 0.00 ATOM 2063 CD2 LEU 272 36.395 22.585 -19.182 1.00 0.00 ATOM 2064 O LEU 272 37.052 18.773 -21.674 1.00 0.00 ATOM 2065 C LEU 272 36.921 18.488 -20.495 1.00 0.00 ATOM 2066 N TYR 273 35.907 17.749 -20.069 1.00 0.00 ATOM 2067 CA TYR 273 34.915 17.264 -21.033 1.00 0.00 ATOM 2068 CB TYR 273 34.447 15.846 -20.676 1.00 0.00 ATOM 2069 CG TYR 273 35.470 14.792 -20.999 1.00 0.00 ATOM 2070 CD1 TYR 273 35.747 14.458 -22.327 1.00 0.00 ATOM 2071 CD2 TYR 273 36.133 14.095 -19.990 1.00 0.00 ATOM 2072 CE1 TYR 273 36.698 13.480 -22.656 1.00 0.00 ATOM 2073 CE2 TYR 273 37.098 13.079 -20.305 1.00 0.00 ATOM 2074 CZ TYR 273 37.363 12.797 -21.656 1.00 0.00 ATOM 2075 OH TYR 273 38.270 11.833 -22.027 1.00 0.00 ATOM 2076 O TYR 273 33.273 18.595 -19.971 1.00 0.00 ATOM 2077 C TYR 273 33.745 18.220 -21.030 1.00 0.00 ATOM 2078 N VAL 274 33.272 18.596 -22.212 1.00 0.00 ATOM 2079 CA VAL 274 32.148 19.514 -22.333 1.00 0.00 ATOM 2080 CB VAL 274 32.575 20.933 -22.854 1.00 0.00 ATOM 2081 CG1 VAL 274 33.531 21.596 -21.861 1.00 0.00 ATOM 2082 CG2 VAL 274 33.199 20.859 -24.264 1.00 0.00 ATOM 2083 O VAL 274 31.432 18.107 -24.127 1.00 0.00 ATOM 2084 C VAL 274 31.109 18.933 -23.265 1.00 0.00 ATOM 2085 N GLY 275 29.869 19.389 -23.116 1.00 0.00 ATOM 2086 CA GLY 275 28.785 18.866 -23.914 1.00 0.00 ATOM 2087 O GLY 275 27.529 20.581 -22.896 1.00 0.00 ATOM 2088 C GLY 275 27.609 19.784 -23.816 1.00 0.00 ATOM 2089 N GLN 276 26.692 19.675 -24.770 1.00 0.00 ATOM 2090 CA GLN 276 25.506 20.512 -24.788 1.00 0.00 ATOM 2091 CB GLN 276 25.203 20.948 -26.218 1.00 0.00 ATOM 2092 CG GLN 276 26.189 21.970 -26.704 1.00 0.00 ATOM 2093 CD GLN 276 25.823 22.539 -28.018 1.00 0.00 ATOM 2094 OE1 GLN 276 25.670 21.815 -28.991 1.00 0.00 ATOM 2095 NE2 GLN 276 25.681 23.860 -28.074 1.00 0.00 ATOM 2096 O GLN 276 24.213 18.593 -24.174 1.00 0.00 ATOM 2097 C GLN 276 24.311 19.815 -24.153 1.00 0.00 ATOM 2098 N GLY 277 23.413 20.598 -23.565 1.00 0.00 ATOM 2099 CA GLY 277 22.231 20.050 -22.912 1.00 0.00 ATOM 2100 O GLY 277 23.347 19.328 -20.906 1.00 0.00 ATOM 2101 C GLY 277 22.407 19.971 -21.408 1.00 0.00 ATOM 2102 N PHE 278 21.489 20.608 -20.690 1.00 0.00 ATOM 2103 CA PHE 278 21.472 20.569 -19.228 1.00 0.00 ATOM 2104 CB PHE 278 20.263 21.369 -18.675 1.00 0.00 ATOM 2105 CG PHE 278 20.231 21.472 -17.188 1.00 0.00 ATOM 2106 CD1 PHE 278 20.993 22.441 -16.520 1.00 0.00 ATOM 2107 CD2 PHE 278 19.453 20.582 -16.429 1.00 0.00 ATOM 2108 CE1 PHE 278 20.985 22.518 -15.110 1.00 0.00 ATOM 2109 CE2 PHE 278 19.443 20.648 -15.001 1.00 0.00 ATOM 2110 CZ PHE 278 20.202 21.640 -14.343 1.00 0.00 ATOM 2111 O PHE 278 22.149 18.836 -17.746 1.00 0.00 ATOM 2112 C PHE 278 21.476 19.133 -18.721 1.00 0.00 ATOM 2113 N TYR 279 20.739 18.244 -19.378 1.00 0.00 ATOM 2114 CA TYR 279 20.674 16.820 -18.984 1.00 0.00 ATOM 2115 CB TYR 279 19.227 16.321 -19.002 1.00 0.00 ATOM 2116 CG TYR 279 18.312 17.118 -18.119 1.00 0.00 ATOM 2117 CD1 TYR 279 18.269 16.895 -16.745 1.00 0.00 ATOM 2118 CD2 TYR 279 17.494 18.105 -18.658 1.00 0.00 ATOM 2119 CE1 TYR 279 17.421 17.625 -15.931 1.00 0.00 ATOM 2120 CE2 TYR 279 16.640 18.865 -17.844 1.00 0.00 ATOM 2121 CZ TYR 279 16.603 18.607 -16.495 1.00 0.00 ATOM 2122 OH TYR 279 15.764 19.359 -15.688 1.00 0.00 ATOM 2123 O TYR 279 21.302 14.639 -19.870 1.00 0.00 ATOM 2124 C TYR 279 21.580 15.851 -19.783 1.00 0.00 ATOM 2125 N HIS 280 22.665 16.377 -20.339 1.00 0.00 ATOM 2126 CA HIS 280 23.677 15.555 -20.977 1.00 0.00 ATOM 2127 CB HIS 280 25.005 16.300 -20.984 1.00 0.00 ATOM 2128 CG HIS 280 26.000 15.744 -21.948 1.00 0.00 ATOM 2129 CD2 HIS 280 26.273 16.075 -23.228 1.00 0.00 ATOM 2130 ND1 HIS 280 26.851 14.704 -21.629 1.00 0.00 ATOM 2131 CE1 HIS 280 27.615 14.432 -22.666 1.00 0.00 ATOM 2132 NE2 HIS 280 27.282 15.245 -23.651 1.00 0.00 ATOM 2133 O HIS 280 24.016 14.166 -19.037 1.00 0.00 ATOM 2134 C HIS 280 23.838 14.212 -20.262 1.00 0.00 ATOM 2135 N ASP 281 23.797 13.120 -21.016 1.00 0.00 ATOM 2136 CA ASP 281 23.841 11.793 -20.412 1.00 0.00 ATOM 2137 CB ASP 281 23.779 10.686 -21.471 1.00 0.00 ATOM 2138 CG ASP 281 23.445 9.330 -20.873 1.00 0.00 ATOM 2139 OD1 ASP 281 24.124 8.332 -21.221 1.00 0.00 ATOM 2140 OD2 ASP 281 22.511 9.270 -20.035 1.00 0.00 ATOM 2141 O ASP 281 24.967 10.815 -18.530 1.00 0.00 ATOM 2142 C ASP 281 25.048 11.578 -19.502 1.00 0.00 ATOM 2143 N SER 282 26.165 12.233 -19.807 1.00 0.00 ATOM 2144 CA SER 282 27.336 12.127 -18.920 1.00 0.00 ATOM 2145 CB SER 282 28.585 12.687 -19.570 1.00 0.00 ATOM 2146 OG SER 282 29.010 11.863 -20.632 1.00 0.00 ATOM 2147 O SER 282 27.803 12.475 -16.584 1.00 0.00 ATOM 2148 C SER 282 27.118 12.799 -17.556 1.00 0.00 ATOM 2149 N LEU 283 26.165 13.722 -17.474 1.00 0.00 ATOM 2150 CA LEU 283 25.874 14.355 -16.202 1.00 0.00 ATOM 2151 CB LEU 283 25.270 15.752 -16.407 1.00 0.00 ATOM 2152 CG LEU 283 26.285 16.804 -16.854 1.00 0.00 ATOM 2153 CD1 LEU 283 25.632 18.141 -17.135 1.00 0.00 ATOM 2154 CD2 LEU 283 27.423 16.928 -15.829 1.00 0.00 ATOM 2155 O LEU 283 24.870 13.855 -14.112 1.00 0.00 ATOM 2156 C LEU 283 25.024 13.506 -15.263 1.00 0.00 ATOM 2157 N MET 284 24.507 12.376 -15.724 1.00 0.00 ATOM 2158 CA MET 284 23.617 11.580 -14.878 1.00 0.00 ATOM 2159 CB MET 284 22.343 11.194 -15.624 1.00 0.00 ATOM 2160 CG MET 284 21.721 12.308 -16.445 1.00 0.00 ATOM 2161 SD MET 284 21.182 13.870 -15.438 1.00 0.00 ATOM 2162 CE MET 284 19.875 13.088 -14.253 1.00 0.00 ATOM 2163 O MET 284 25.034 9.609 -14.875 1.00 0.00 ATOM 2164 C MET 284 24.267 10.349 -14.235 1.00 0.00 ATOM 2165 N SER 285 23.911 10.131 -12.969 1.00 0.00 ATOM 2166 CA SER 285 24.497 9.111 -12.087 1.00 0.00 ATOM 2167 CB SER 285 25.164 9.819 -10.915 1.00 0.00 ATOM 2168 OG SER 285 26.521 9.889 -11.127 1.00 0.00 ATOM 2169 O SER 285 22.280 8.821 -11.275 1.00 0.00 ATOM 2170 C SER 285 23.398 8.314 -11.440 1.00 0.00 ATOM 2171 N THR 286 23.733 7.125 -10.956 1.00 0.00 ATOM 2172 CA THR 286 22.759 6.304 -10.259 1.00 0.00 ATOM 2173 CB THR 286 22.441 5.030 -11.066 1.00 0.00 ATOM 2174 CG2 THR 286 21.733 5.372 -12.378 1.00 0.00 ATOM 2175 OG1 THR 286 23.654 4.332 -11.338 1.00 0.00 ATOM 2176 O THR 286 22.370 5.406 -8.044 1.00 0.00 ATOM 2177 C THR 286 23.180 5.921 -8.827 1.00 0.00 ATOM 2178 N SER 287 24.445 6.159 -8.493 1.00 0.00 ATOM 2179 CA SER 287 24.945 5.906 -7.146 1.00 0.00 ATOM 2180 CB SER 287 25.191 4.409 -6.907 1.00 0.00 ATOM 2181 OG SER 287 26.345 3.941 -7.595 1.00 0.00 ATOM 2182 O SER 287 26.809 7.202 -7.864 1.00 0.00 ATOM 2183 C SER 287 26.223 6.691 -6.910 1.00 0.00 ATOM 2184 N LEU 288 26.644 6.791 -5.645 1.00 0.00 ATOM 2185 CA LEU 288 27.954 7.336 -5.319 1.00 0.00 ATOM 2186 CB LEU 288 27.874 8.844 -5.010 1.00 0.00 ATOM 2187 CG LEU 288 27.036 9.351 -3.832 1.00 0.00 ATOM 2188 CD1 LEU 288 27.759 9.171 -2.475 1.00 0.00 ATOM 2189 CD2 LEU 288 26.565 10.823 -4.020 1.00 0.00 ATOM 2190 O LEU 288 27.966 5.835 -3.446 1.00 0.00 ATOM 2191 C LEU 288 28.615 6.587 -4.173 1.00 0.00 ATOM 2192 N GLU 289 29.919 6.802 -4.020 1.00 0.00 ATOM 2193 CA GLU 289 30.625 6.446 -2.793 1.00 0.00 ATOM 2194 CB GLU 289 31.819 5.553 -3.090 1.00 0.00 ATOM 2195 CG GLU 289 31.435 4.272 -3.791 1.00 0.00 ATOM 2196 CD GLU 289 32.424 3.162 -3.539 1.00 0.00 ATOM 2197 OE1 GLU 289 32.599 2.285 -4.430 1.00 0.00 ATOM 2198 OE2 GLU 289 33.028 3.172 -2.445 1.00 0.00 ATOM 2199 O GLU 289 31.421 8.714 -2.703 1.00 0.00 ATOM 2200 C GLU 289 31.092 7.701 -2.069 1.00 0.00 ATOM 2201 N ALA 290 31.122 7.623 -0.741 1.00 0.00 ATOM 2202 CA ALA 290 31.503 8.745 0.095 1.00 0.00 ATOM 2203 CB ALA 290 30.258 9.414 0.695 1.00 0.00 ATOM 2204 O ALA 290 32.463 7.223 1.690 1.00 0.00 ATOM 2205 C ALA 290 32.486 8.355 1.181 1.00 0.00 ATOM 2206 N SER 291 33.361 9.290 1.528 1.00 0.00 ATOM 2207 CA SER 291 34.264 9.105 2.651 1.00 0.00 ATOM 2208 CB SER 291 35.718 9.189 2.198 1.00 0.00 ATOM 2209 OG SER 291 36.111 7.959 1.621 1.00 0.00 ATOM 2210 O SER 291 33.162 11.052 3.500 1.00 0.00 ATOM 2211 C SER 291 33.964 10.139 3.726 1.00 0.00 ATOM 2212 N GLN 292 34.603 9.980 4.890 1.00 0.00 ATOM 2213 CA GLN 292 34.447 10.894 6.022 1.00 0.00 ATOM 2214 CB GLN 292 34.926 12.297 5.662 1.00 0.00 ATOM 2215 CG GLN 292 36.299 12.340 5.025 1.00 0.00 ATOM 2216 CD GLN 292 37.283 13.051 5.902 1.00 0.00 ATOM 2217 OE1 GLN 292 37.721 12.510 6.923 1.00 0.00 ATOM 2218 NE2 GLN 292 37.621 14.297 5.532 1.00 0.00 ATOM 2219 O GLN 292 32.492 12.043 6.804 1.00 0.00 ATOM 2220 C GLN 292 32.996 10.967 6.451 1.00 0.00 ATOM 2221 N VAL 293 32.312 9.834 6.384 1.00 0.00 ATOM 2222 CA VAL 293 30.917 9.811 6.758 1.00 0.00 ATOM 2223 CB VAL 293 30.176 8.624 6.149 1.00 0.00 ATOM 2224 CG1 VAL 293 28.736 8.598 6.634 1.00 0.00 ATOM 2225 CG2 VAL 293 30.205 8.724 4.628 1.00 0.00 ATOM 2226 O VAL 293 31.409 9.086 9.008 1.00 0.00 ATOM 2227 C VAL 293 30.808 9.878 8.273 1.00 0.00 ATOM 2228 N HIS 294 30.076 10.877 8.736 1.00 0.00 ATOM 2229 CA HIS 294 30.026 11.188 10.144 1.00 0.00 ATOM 2230 CB HIS 294 30.856 12.443 10.427 1.00 0.00 ATOM 2231 CG HIS 294 31.179 12.641 11.872 1.00 0.00 ATOM 2232 CD2 HIS 294 32.290 12.341 12.589 1.00 0.00 ATOM 2233 ND1 HIS 294 30.285 13.196 12.767 1.00 0.00 ATOM 2234 CE1 HIS 294 30.831 13.233 13.970 1.00 0.00 ATOM 2235 NE2 HIS 294 32.046 12.718 13.891 1.00 0.00 ATOM 2236 O HIS 294 27.808 11.977 9.741 1.00 0.00 ATOM 2237 C HIS 294 28.568 11.390 10.501 1.00 0.00 ATOM 2238 N PHE 295 28.169 10.861 11.643 1.00 0.00 ATOM 2239 CA PHE 295 26.803 11.035 12.105 1.00 0.00 ATOM 2240 CB PHE 295 26.110 9.677 12.238 1.00 0.00 ATOM 2241 CG PHE 295 25.713 9.092 10.926 1.00 0.00 ATOM 2242 CD1 PHE 295 24.461 9.358 10.383 1.00 0.00 ATOM 2243 CD2 PHE 295 26.598 8.303 10.208 1.00 0.00 ATOM 2244 CE1 PHE 295 24.091 8.841 9.148 1.00 0.00 ATOM 2245 CE2 PHE 295 26.238 7.774 8.965 1.00 0.00 ATOM 2246 CZ PHE 295 24.981 8.043 8.437 1.00 0.00 ATOM 2247 O PHE 295 27.727 11.881 14.167 1.00 0.00 ATOM 2248 C PHE 295 26.744 11.834 13.403 1.00 0.00 ATOM 2249 N THR 296 25.591 12.467 13.626 1.00 0.00 ATOM 2250 CA THR 296 25.341 13.264 14.834 1.00 0.00 ATOM 2251 CB THR 296 24.121 14.195 14.671 1.00 0.00 ATOM 2252 CG2 THR 296 24.329 15.143 13.505 1.00 0.00 ATOM 2253 OG1 THR 296 22.948 13.411 14.453 1.00 0.00 ATOM 2254 O THR 296 25.157 12.981 17.211 1.00 0.00 ATOM 2255 C THR 296 25.180 12.435 16.111 1.00 0.00 ATOM 2256 N ARG 297 25.072 11.120 15.964 1.00 0.00 ATOM 2257 CA ARG 297 25.039 10.224 17.102 1.00 0.00 ATOM 2258 CB ARG 297 23.598 9.956 17.571 1.00 0.00 ATOM 2259 CG ARG 297 22.734 9.157 16.613 1.00 0.00 ATOM 2260 CD ARG 297 21.272 9.160 17.051 1.00 0.00 ATOM 2261 NE ARG 297 20.487 8.188 16.292 1.00 0.00 ATOM 2262 CZ ARG 297 19.821 7.156 16.826 1.00 0.00 ATOM 2263 NH1 ARG 297 19.800 6.962 18.148 1.00 0.00 ATOM 2264 NH2 ARG 297 19.146 6.316 16.034 1.00 0.00 ATOM 2265 O ARG 297 26.070 8.616 15.638 1.00 0.00 ATOM 2266 C ARG 297 25.777 8.931 16.800 1.00 0.00 ATOM 2267 N GLU 298 26.096 8.201 17.863 1.00 0.00 ATOM 2268 CA GLU 298 26.670 6.867 17.763 1.00 0.00 ATOM 2269 CB GLU 298 26.792 6.265 19.178 1.00 0.00 ATOM 2270 CG GLU 298 26.867 4.746 19.256 1.00 0.00 ATOM 2271 CD GLU 298 28.154 4.227 19.889 1.00 0.00 ATOM 2272 OE1 GLU 298 29.164 4.062 19.160 1.00 0.00 ATOM 2273 OE2 GLU 298 28.142 3.958 21.112 1.00 0.00 ATOM 2274 O GLU 298 24.604 5.842 17.041 1.00 0.00 ATOM 2275 C GLU 298 25.813 5.992 16.828 1.00 0.00 ATOM 2276 N MET 299 26.448 5.457 15.781 1.00 0.00 ATOM 2277 CA MET 299 25.798 4.545 14.838 1.00 0.00 ATOM 2278 CB MET 299 25.801 5.138 13.416 1.00 0.00 ATOM 2279 CG MET 299 24.789 6.248 13.144 1.00 0.00 ATOM 2280 SD MET 299 22.957 5.939 13.751 1.00 0.00 ATOM 2281 CE MET 299 22.268 4.805 12.327 1.00 0.00 ATOM 2282 O MET 299 27.671 3.082 15.211 1.00 0.00 ATOM 2283 C MET 299 26.501 3.180 14.827 1.00 0.00 ATOM 2284 N PRO 300 25.794 2.115 14.395 1.00 0.00 ATOM 2285 CA PRO 300 26.456 0.808 14.222 1.00 0.00 ATOM 2286 CB PRO 300 25.320 -0.097 13.724 1.00 0.00 ATOM 2287 CG PRO 300 24.061 0.570 14.192 1.00 0.00 ATOM 2288 CD PRO 300 24.351 2.043 14.092 1.00 0.00 ATOM 2289 O PRO 300 27.712 1.722 12.378 1.00 0.00 ATOM 2290 C PRO 300 27.617 0.817 13.210 1.00 0.00 ATOM 2291 N GLU 301 28.495 -0.181 13.309 1.00 0.00 ATOM 2292 CA GLU 301 29.611 -0.408 12.372 1.00 0.00 ATOM 2293 CB GLU 301 30.367 -1.707 12.736 1.00 0.00 ATOM 2294 CG GLU 301 31.772 -1.522 13.331 1.00 0.00 ATOM 2295 CD GLU 301 32.650 -0.624 12.469 1.00 0.00 ATOM 2296 OE1 GLU 301 33.246 -1.119 11.479 1.00 0.00 ATOM 2297 OE2 GLU 301 32.724 0.584 12.789 1.00 0.00 ATOM 2298 O GLU 301 29.801 -0.014 10.013 1.00 0.00 ATOM 2299 C GLU 301 29.161 -0.531 10.925 1.00 0.00 ATOM 2300 N GLU 302 28.061 -1.241 10.732 1.00 0.00 ATOM 2301 CA GLU 302 27.555 -1.574 9.419 1.00 0.00 ATOM 2302 CB GLU 302 28.061 -2.963 9.003 1.00 0.00 ATOM 2303 CG GLU 302 27.485 -3.535 7.712 1.00 0.00 ATOM 2304 CD GLU 302 28.118 -4.873 7.335 1.00 0.00 ATOM 2305 OE1 GLU 302 27.927 -5.868 8.072 1.00 0.00 ATOM 2306 OE2 GLU 302 28.814 -4.932 6.296 1.00 0.00 ATOM 2307 O GLU 302 25.469 -2.146 10.466 1.00 0.00 ATOM 2308 C GLU 302 26.040 -1.541 9.544 1.00 0.00 ATOM 2309 N PHE 303 25.400 -0.800 8.641 1.00 0.00 ATOM 2310 CA PHE 303 23.952 -0.619 8.672 1.00 0.00 ATOM 2311 CB PHE 303 23.530 0.251 9.868 1.00 0.00 ATOM 2312 CG PHE 303 23.993 1.685 9.791 1.00 0.00 ATOM 2313 CD1 PHE 303 23.166 2.671 9.247 1.00 0.00 ATOM 2314 CD2 PHE 303 25.242 2.059 10.286 1.00 0.00 ATOM 2315 CE1 PHE 303 23.585 4.013 9.177 1.00 0.00 ATOM 2316 CE2 PHE 303 25.667 3.402 10.231 1.00 0.00 ATOM 2317 CZ PHE 303 24.831 4.379 9.676 1.00 0.00 ATOM 2318 O PHE 303 24.133 0.667 6.653 1.00 0.00 ATOM 2319 C PHE 303 23.418 -0.031 7.376 1.00 0.00 ATOM 2320 N THR 304 22.160 -0.341 7.085 1.00 0.00 ATOM 2321 CA THR 304 21.459 0.277 5.980 1.00 0.00 ATOM 2322 CB THR 304 20.775 -0.761 5.077 1.00 0.00 ATOM 2323 CG2 THR 304 19.903 -0.086 4.015 1.00 0.00 ATOM 2324 OG1 THR 304 21.787 -1.534 4.418 1.00 0.00 ATOM 2325 O THR 304 19.971 1.235 7.615 1.00 0.00 ATOM 2326 C THR 304 20.482 1.329 6.494 1.00 0.00 ATOM 2327 N LEU 305 20.255 2.336 5.659 1.00 0.00 ATOM 2328 CA LEU 305 19.447 3.493 5.994 1.00 0.00 ATOM 2329 CB LEU 305 20.387 4.667 6.278 1.00 0.00 ATOM 2330 CG LEU 305 20.103 5.776 7.279 1.00 0.00 ATOM 2331 CD1 LEU 305 19.895 5.224 8.679 1.00 0.00 ATOM 2332 CD2 LEU 305 21.289 6.736 7.259 1.00 0.00 ATOM 2333 O LEU 305 19.137 3.945 3.684 1.00 0.00 ATOM 2334 C LEU 305 18.610 3.821 4.775 1.00 0.00 ATOM 2335 N GLU 306 17.305 3.935 4.943 1.00 0.00 ATOM 2336 CA GLU 306 16.479 4.484 3.883 1.00 0.00 ATOM 2337 CB GLU 306 15.270 3.602 3.581 1.00 0.00 ATOM 2338 CG GLU 306 15.362 2.947 2.231 1.00 0.00 ATOM 2339 CD GLU 306 15.510 1.449 2.312 1.00 0.00 ATOM 2340 OE1 GLU 306 16.601 0.936 1.964 1.00 0.00 ATOM 2341 OE2 GLU 306 14.529 0.779 2.716 1.00 0.00 ATOM 2342 O GLU 306 15.292 6.049 5.243 1.00 0.00 ATOM 2343 C GLU 306 16.054 5.880 4.293 1.00 0.00 ATOM 2344 N CYS 307 16.573 6.881 3.589 1.00 0.00 ATOM 2345 CA CYS 307 16.369 8.262 3.977 1.00 0.00 ATOM 2346 CB CYS 307 17.436 8.690 5.018 1.00 0.00 ATOM 2347 SG CYS 307 19.206 8.536 4.515 1.00 0.00 ATOM 2348 O CYS 307 16.159 8.697 1.633 1.00 0.00 ATOM 2349 C CYS 307 16.354 9.167 2.747 1.00 0.00 ATOM 2350 N THR 308 16.521 10.471 2.951 1.00 0.00 ATOM 2351 CA THR 308 16.806 11.369 1.841 1.00 0.00 ATOM 2352 CB THR 308 15.801 12.508 1.740 1.00 0.00 ATOM 2353 CG2 THR 308 14.385 11.997 1.522 1.00 0.00 ATOM 2354 OG1 THR 308 15.850 13.268 2.939 1.00 0.00 ATOM 2355 O THR 308 18.843 11.821 3.044 1.00 0.00 ATOM 2356 C THR 308 18.223 11.938 1.985 1.00 0.00 ATOM 2357 N ALA 309 18.735 12.531 0.910 1.00 0.00 ATOM 2358 CA ALA 309 20.040 13.176 0.926 1.00 0.00 ATOM 2359 CB ALA 309 21.144 12.211 0.494 1.00 0.00 ATOM 2360 O ALA 309 19.264 14.547 -0.873 1.00 0.00 ATOM 2361 C ALA 309 20.061 14.407 0.045 1.00 0.00 ATOM 2362 N LYS 310 21.011 15.283 0.346 1.00 0.00 ATOM 2363 CA LYS 310 21.336 16.425 -0.469 1.00 0.00 ATOM 2364 CB LYS 310 21.301 17.683 0.368 1.00 0.00 ATOM 2365 CG LYS 310 20.013 18.477 0.287 1.00 0.00 ATOM 2366 CD LYS 310 19.963 19.511 1.431 1.00 0.00 ATOM 2367 CE LYS 310 19.333 20.835 1.024 1.00 0.00 ATOM 2368 NZ LYS 310 20.136 22.044 1.618 1.00 0.00 ATOM 2369 O LYS 310 23.598 15.752 -0.200 1.00 0.00 ATOM 2370 C LYS 310 22.748 16.212 -0.953 1.00 0.00 ATOM 2371 N PHE 311 22.985 16.541 -2.218 1.00 0.00 ATOM 2372 CA PHE 311 24.280 16.393 -2.859 1.00 0.00 ATOM 2373 CB PHE 311 24.121 15.579 -4.154 1.00 0.00 ATOM 2374 CG PHE 311 23.364 14.308 -3.952 1.00 0.00 ATOM 2375 CD1 PHE 311 23.925 13.270 -3.188 1.00 0.00 ATOM 2376 CD2 PHE 311 22.073 14.163 -4.459 1.00 0.00 ATOM 2377 CE1 PHE 311 23.226 12.093 -2.971 1.00 0.00 ATOM 2378 CE2 PHE 311 21.362 12.995 -4.246 1.00 0.00 ATOM 2379 CZ PHE 311 21.939 11.952 -3.512 1.00 0.00 ATOM 2380 O PHE 311 26.018 17.887 -3.510 1.00 0.00 ATOM 2381 C PHE 311 24.861 17.756 -3.146 1.00 0.00 ATOM 2382 N ARG 312 24.033 18.772 -2.997 1.00 0.00 ATOM 2383 CA ARG 312 24.481 20.141 -3.113 1.00 0.00 ATOM 2384 CB ARG 312 24.467 20.591 -4.574 1.00 0.00 ATOM 2385 CG ARG 312 23.148 20.295 -5.307 1.00 0.00 ATOM 2386 CD ARG 312 23.287 20.338 -6.817 1.00 0.00 ATOM 2387 NE ARG 312 24.026 21.509 -7.248 1.00 0.00 ATOM 2388 CZ ARG 312 25.134 21.466 -7.985 1.00 0.00 ATOM 2389 NH1 ARG 312 25.645 20.293 -8.411 1.00 0.00 ATOM 2390 NH2 ARG 312 25.719 22.612 -8.311 1.00 0.00 ATOM 2391 O ARG 312 22.486 20.606 -1.858 1.00 0.00 ATOM 2392 C ARG 312 23.602 21.000 -2.229 1.00 0.00 ATOM 2393 N TYR 313 24.129 22.152 -1.840 1.00 0.00 ATOM 2394 CA TYR 313 23.455 22.976 -0.878 1.00 0.00 ATOM 2395 CB TYR 313 24.342 24.148 -0.484 1.00 0.00 ATOM 2396 CG TYR 313 23.672 25.172 0.423 1.00 0.00 ATOM 2397 CD1 TYR 313 23.039 24.788 1.623 1.00 0.00 ATOM 2398 CD2 TYR 313 23.720 26.532 0.115 1.00 0.00 ATOM 2399 CE1 TYR 313 22.441 25.745 2.482 1.00 0.00 ATOM 2400 CE2 TYR 313 23.143 27.502 0.966 1.00 0.00 ATOM 2401 CZ TYR 313 22.487 27.098 2.134 1.00 0.00 ATOM 2402 OH TYR 313 21.916 28.062 2.959 1.00 0.00 ATOM 2403 O TYR 313 21.093 23.413 -0.615 1.00 0.00 ATOM 2404 C TYR 313 22.076 23.437 -1.375 1.00 0.00 ATOM 2405 N ARG 314 21.972 23.802 -2.651 1.00 0.00 ATOM 2406 CA ARG 314 20.788 24.535 -3.109 1.00 0.00 ATOM 2407 CB ARG 314 21.215 25.743 -3.959 1.00 0.00 ATOM 2408 CG ARG 314 22.304 26.562 -3.257 1.00 0.00 ATOM 2409 CD ARG 314 22.794 27.746 -4.054 1.00 0.00 ATOM 2410 NE ARG 314 21.795 28.800 -3.976 1.00 0.00 ATOM 2411 CZ ARG 314 21.713 29.691 -2.999 1.00 0.00 ATOM 2412 NH1 ARG 314 20.732 30.569 -3.018 1.00 0.00 ATOM 2413 NH2 ARG 314 22.597 29.704 -2.014 1.00 0.00 ATOM 2414 O ARG 314 18.801 24.181 -4.431 1.00 0.00 ATOM 2415 C ARG 314 19.694 23.669 -3.756 1.00 0.00 ATOM 2416 N GLN 315 19.735 22.365 -3.501 1.00 0.00 ATOM 2417 CA GLN 315 18.732 21.449 -4.064 1.00 0.00 ATOM 2418 CB GLN 315 19.388 20.302 -4.818 1.00 0.00 ATOM 2419 CG GLN 315 19.911 19.243 -3.850 1.00 0.00 ATOM 2420 CD GLN 315 20.606 18.103 -4.557 1.00 0.00 ATOM 2421 OE1 GLN 315 21.066 17.150 -3.910 1.00 0.00 ATOM 2422 NE2 GLN 315 20.683 18.187 -5.895 1.00 0.00 ATOM 2423 O GLN 315 18.301 20.728 -1.839 1.00 0.00 ATOM 2424 C GLN 315 17.848 20.865 -2.972 1.00 0.00 ATOM 2425 N PRO 316 16.596 20.481 -3.307 1.00 0.00 ATOM 2426 CA PRO 316 15.838 19.707 -2.304 1.00 0.00 ATOM 2427 CB PRO 316 14.444 19.594 -2.899 1.00 0.00 ATOM 2428 CG PRO 316 14.634 19.844 -4.392 1.00 0.00 ATOM 2429 CD PRO 316 15.847 20.694 -4.553 1.00 0.00 ATOM 2430 O PRO 316 17.225 17.862 -2.950 1.00 0.00 ATOM 2431 C PRO 316 16.461 18.320 -2.106 1.00 0.00 ATOM 2432 N ASP 317 16.165 17.676 -0.985 1.00 0.00 ATOM 2433 CA ASP 317 16.737 16.356 -0.723 1.00 0.00 ATOM 2434 CB ASP 317 16.790 16.018 0.777 1.00 0.00 ATOM 2435 CG ASP 317 15.567 16.480 1.520 1.00 0.00 ATOM 2436 OD1 ASP 317 15.298 17.716 1.463 1.00 0.00 ATOM 2437 OD2 ASP 317 14.902 15.634 2.174 1.00 0.00 ATOM 2438 O ASP 317 14.825 15.601 -1.906 1.00 0.00 ATOM 2439 C ASP 317 15.946 15.333 -1.486 1.00 0.00 ATOM 2440 N SER 318 16.538 14.173 -1.709 1.00 0.00 ATOM 2441 CA SER 318 15.864 13.156 -2.503 1.00 0.00 ATOM 2442 CB SER 318 16.259 13.263 -3.975 1.00 0.00 ATOM 2443 OG SER 318 17.655 13.298 -4.096 1.00 0.00 ATOM 2444 O SER 318 17.129 11.580 -1.236 1.00 0.00 ATOM 2445 C SER 318 16.142 11.779 -1.951 1.00 0.00 ATOM 2446 N LYS 319 15.252 10.847 -2.284 1.00 0.00 ATOM 2447 CA LYS 319 15.257 9.522 -1.702 1.00 0.00 ATOM 2448 CB LYS 319 13.990 8.756 -2.071 1.00 0.00 ATOM 2449 CG LYS 319 12.743 9.181 -1.297 1.00 0.00 ATOM 2450 CD LYS 319 11.645 8.113 -1.448 1.00 0.00 ATOM 2451 CE LYS 319 10.248 8.639 -1.089 1.00 0.00 ATOM 2452 NZ LYS 319 9.226 7.534 -1.120 1.00 0.00 ATOM 2453 O LYS 319 17.024 8.831 -3.189 1.00 0.00 ATOM 2454 C LYS 319 16.512 8.740 -2.073 1.00 0.00 ATOM 2455 N VAL 320 16.968 7.942 -1.120 1.00 0.00 ATOM 2456 CA VAL 320 18.302 7.408 -1.116 1.00 0.00 ATOM 2457 CB VAL 320 19.258 8.571 -0.685 1.00 0.00 ATOM 2458 CG1 VAL 320 20.219 8.208 0.390 1.00 0.00 ATOM 2459 CG2 VAL 320 19.943 9.224 -1.912 1.00 0.00 ATOM 2460 O VAL 320 17.696 6.107 0.852 1.00 0.00 ATOM 2461 C VAL 320 18.333 6.149 -0.204 1.00 0.00 ATOM 2462 N THR 321 19.018 5.107 -0.660 1.00 0.00 ATOM 2463 CA THR 321 19.433 4.021 0.206 1.00 0.00 ATOM 2464 CB THR 321 19.215 2.645 -0.448 1.00 0.00 ATOM 2465 CG2 THR 321 19.695 1.531 0.468 1.00 0.00 ATOM 2466 OG1 THR 321 17.823 2.470 -0.723 1.00 0.00 ATOM 2467 O THR 321 21.720 4.350 -0.435 1.00 0.00 ATOM 2468 C THR 321 20.917 4.196 0.488 1.00 0.00 ATOM 2469 N VAL 322 21.289 4.174 1.763 1.00 0.00 ATOM 2470 CA VAL 322 22.706 4.241 2.104 1.00 0.00 ATOM 2471 CB VAL 322 23.152 5.665 2.647 1.00 0.00 ATOM 2472 CG1 VAL 322 21.983 6.620 2.797 1.00 0.00 ATOM 2473 CG2 VAL 322 23.981 5.603 3.871 1.00 0.00 ATOM 2474 O VAL 322 22.633 2.629 3.896 1.00 0.00 ATOM 2475 C VAL 322 23.209 3.018 2.872 1.00 0.00 ATOM 2476 N HIS 323 24.255 2.399 2.326 1.00 0.00 ATOM 2477 CA HIS 323 24.927 1.264 2.963 1.00 0.00 ATOM 2478 CB HIS 323 25.132 0.122 1.964 1.00 0.00 ATOM 2479 CG HIS 323 23.869 -0.341 1.308 1.00 0.00 ATOM 2480 CD2 HIS 323 22.732 -0.862 1.829 1.00 0.00 ATOM 2481 ND1 HIS 323 23.669 -0.277 -0.056 1.00 0.00 ATOM 2482 CE1 HIS 323 22.467 -0.746 -0.347 1.00 0.00 ATOM 2483 NE2 HIS 323 21.876 -1.102 0.781 1.00 0.00 ATOM 2484 O HIS 323 27.200 2.017 2.809 1.00 0.00 ATOM 2485 C HIS 323 26.267 1.703 3.550 1.00 0.00 ATOM 2486 N VAL 324 26.351 1.730 4.880 1.00 0.00 ATOM 2487 CA VAL 324 27.532 2.229 5.594 1.00 0.00 ATOM 2488 CB VAL 324 27.122 3.079 6.821 1.00 0.00 ATOM 2489 CG1 VAL 324 28.339 3.677 7.523 1.00 0.00 ATOM 2490 CG2 VAL 324 26.165 4.172 6.419 1.00 0.00 ATOM 2491 O VAL 324 27.782 0.070 6.611 1.00 0.00 ATOM 2492 C VAL 324 28.349 1.041 6.076 1.00 0.00 ATOM 2493 N LYS 325 29.671 1.103 5.890 1.00 0.00 ATOM 2494 CA LYS 325 30.552 -0.003 6.329 1.00 0.00 ATOM 2495 CB LYS 325 30.816 -0.992 5.189 1.00 0.00 ATOM 2496 CG LYS 325 29.754 -2.072 5.023 1.00 0.00 ATOM 2497 CD LYS 325 30.285 -3.272 4.213 1.00 0.00 ATOM 2498 CE LYS 325 30.537 -2.933 2.725 1.00 0.00 ATOM 2499 NZ LYS 325 29.271 -2.789 1.955 1.00 0.00 ATOM 2500 O LYS 325 32.881 -0.308 6.887 1.00 0.00 ATOM 2501 C LYS 325 31.878 0.419 6.982 1.00 0.00 ATOM 2502 N GLY 326 31.868 1.573 7.657 1.00 0.00 ATOM 2503 CA GLY 326 33.042 2.079 8.379 1.00 0.00 ATOM 2504 O GLY 326 33.706 4.290 7.676 1.00 0.00 ATOM 2505 C GLY 326 33.857 3.057 7.546 1.00 0.00 ATOM 2506 N GLU 327 34.721 2.530 6.680 1.00 0.00 ATOM 2507 CA GLU 327 35.567 3.393 5.845 1.00 0.00 ATOM 2508 CB GLU 327 36.930 2.742 5.551 1.00 0.00 ATOM 2509 CG GLU 327 37.939 2.867 6.712 1.00 0.00 ATOM 2510 CD GLU 327 38.200 4.315 7.126 1.00 0.00 ATOM 2511 OE1 GLU 327 38.831 5.060 6.341 1.00 0.00 ATOM 2512 OE2 GLU 327 37.774 4.703 8.236 1.00 0.00 ATOM 2513 O GLU 327 35.135 5.082 4.159 1.00 0.00 ATOM 2514 C GLU 327 34.891 3.934 4.563 1.00 0.00 ATOM 2515 N LYS 328 34.046 3.118 3.932 1.00 0.00 ATOM 2516 CA LYS 328 33.298 3.601 2.775 1.00 0.00 ATOM 2517 CB LYS 328 33.779 2.932 1.475 1.00 0.00 ATOM 2518 CG LYS 328 34.489 3.882 0.471 1.00 0.00 ATOM 2519 CD LYS 328 35.734 3.191 -0.153 1.00 0.00 ATOM 2520 CE LYS 328 35.439 1.775 -0.699 1.00 0.00 ATOM 2521 NZ LYS 328 36.604 0.855 -0.507 1.00 0.00 ATOM 2522 O LYS 328 31.291 2.547 3.620 1.00 0.00 ATOM 2523 C LYS 328 31.788 3.463 2.934 1.00 0.00 ATOM 2524 N THR 329 31.083 4.370 2.262 1.00 0.00 ATOM 2525 CA THR 329 29.639 4.404 2.272 1.00 0.00 ATOM 2526 CB THR 329 29.183 5.623 3.070 1.00 0.00 ATOM 2527 CG2 THR 329 27.672 5.827 3.001 1.00 0.00 ATOM 2528 OG1 THR 329 29.593 5.416 4.433 1.00 0.00 ATOM 2529 O THR 329 29.658 5.091 0.005 1.00 0.00 ATOM 2530 C THR 329 29.124 4.401 0.846 1.00 0.00 ATOM 2531 N GLU 330 28.115 3.586 0.569 1.00 0.00 ATOM 2532 CA GLU 330 27.484 3.589 -0.738 1.00 0.00 ATOM 2533 CB GLU 330 27.370 2.177 -1.312 1.00 0.00 ATOM 2534 CG GLU 330 27.095 2.174 -2.815 1.00 0.00 ATOM 2535 CD GLU 330 26.680 0.816 -3.355 1.00 0.00 ATOM 2536 OE1 GLU 330 26.774 -0.204 -2.631 1.00 0.00 ATOM 2537 OE2 GLU 330 26.259 0.772 -4.532 1.00 0.00 ATOM 2538 O GLU 330 25.290 3.927 0.153 1.00 0.00 ATOM 2539 C GLU 330 26.110 4.249 -0.693 1.00 0.00 ATOM 2540 N VAL 331 25.865 5.169 -1.623 1.00 0.00 ATOM 2541 CA VAL 331 24.570 5.835 -1.714 1.00 0.00 ATOM 2542 CB VAL 331 24.696 7.362 -1.476 1.00 0.00 ATOM 2543 CG1 VAL 331 23.337 7.996 -1.479 1.00 0.00 ATOM 2544 CG2 VAL 331 25.377 7.631 -0.162 1.00 0.00 ATOM 2545 O VAL 331 24.446 5.826 -4.107 1.00 0.00 ATOM 2546 C VAL 331 23.897 5.523 -3.052 1.00 0.00 ATOM 2547 N ILE 332 22.718 4.907 -2.995 1.00 0.00 ATOM 2548 CA ILE 332 21.950 4.560 -4.196 1.00 0.00 ATOM 2549 CB ILE 332 21.507 3.063 -4.207 1.00 0.00 ATOM 2550 CG1 ILE 332 22.713 2.149 -4.415 1.00 0.00 ATOM 2551 CG2 ILE 332 20.488 2.776 -5.319 1.00 0.00 ATOM 2552 CD1 ILE 332 23.050 1.318 -3.232 1.00 0.00 ATOM 2553 O ILE 332 19.902 5.583 -3.455 1.00 0.00 ATOM 2554 C ILE 332 20.747 5.496 -4.341 1.00 0.00 ATOM 2555 N PHE 333 20.689 6.193 -5.464 1.00 0.00 ATOM 2556 CA PHE 333 19.650 7.186 -5.715 1.00 0.00 ATOM 2557 CB PHE 333 20.098 8.191 -6.810 1.00 0.00 ATOM 2558 CG PHE 333 21.539 8.652 -6.690 1.00 0.00 ATOM 2559 CD1 PHE 333 22.163 8.781 -5.447 1.00 0.00 ATOM 2560 CD2 PHE 333 22.263 8.992 -7.820 1.00 0.00 ATOM 2561 CE1 PHE 333 23.471 9.205 -5.356 1.00 0.00 ATOM 2562 CE2 PHE 333 23.580 9.431 -7.724 1.00 0.00 ATOM 2563 CZ PHE 333 24.177 9.522 -6.490 1.00 0.00 ATOM 2564 O PHE 333 18.422 5.502 -6.880 1.00 0.00 ATOM 2565 C PHE 333 18.368 6.476 -6.139 1.00 0.00 ATOM 2566 N ALA 334 17.218 6.958 -5.674 1.00 0.00 ATOM 2567 CA ALA 334 15.924 6.464 -6.163 1.00 0.00 ATOM 2568 CB ALA 334 14.790 7.110 -5.402 1.00 0.00 ATOM 2569 O ALA 334 15.211 5.981 -8.394 1.00 0.00 ATOM 2570 C ALA 334 15.775 6.766 -7.648 1.00 0.00 ATOM 2571 N GLU 335 16.342 7.899 -8.057 1.00 0.00 ATOM 2572 CA GLU 335 16.135 8.524 -9.359 1.00 0.00 ATOM 2573 CB GLU 335 15.154 9.699 -9.143 1.00 0.00 ATOM 2574 CG GLU 335 14.634 10.467 -10.368 1.00 0.00 ATOM 2575 CD GLU 335 14.136 11.907 -10.027 1.00 0.00 ATOM 2576 OE1 GLU 335 13.906 12.211 -8.824 1.00 0.00 ATOM 2577 OE2 GLU 335 13.979 12.737 -10.962 1.00 0.00 ATOM 2578 O GLU 335 18.305 9.477 -8.981 1.00 0.00 ATOM 2579 C GLU 335 17.528 9.022 -9.811 1.00 0.00 ATOM 2580 N PRO 336 17.882 8.875 -11.107 1.00 0.00 ATOM 2581 CA PRO 336 19.181 9.443 -11.558 1.00 0.00 ATOM 2582 CB PRO 336 19.119 9.302 -13.079 1.00 0.00 ATOM 2583 CG PRO 336 18.199 8.086 -13.301 1.00 0.00 ATOM 2584 CD PRO 336 17.171 8.175 -12.210 1.00 0.00 ATOM 2585 O PRO 336 18.522 11.735 -11.182 1.00 0.00 ATOM 2586 C PRO 336 19.440 10.899 -11.162 1.00 0.00 ATOM 2587 N GLN 337 20.697 11.186 -10.829 1.00 0.00 ATOM 2588 CA GLN 337 21.108 12.475 -10.272 1.00 0.00 ATOM 2589 CB GLN 337 21.742 12.284 -8.892 1.00 0.00 ATOM 2590 CG GLN 337 20.755 11.876 -7.789 1.00 0.00 ATOM 2591 CD GLN 337 19.668 12.921 -7.547 1.00 0.00 ATOM 2592 OE1 GLN 337 19.961 14.123 -7.428 1.00 0.00 ATOM 2593 NE2 GLN 337 18.408 12.473 -7.498 1.00 0.00 ATOM 2594 O GLN 337 23.041 12.578 -11.720 1.00 0.00 ATOM 2595 C GLN 337 22.101 13.191 -11.169 1.00 0.00 ATOM 2596 N ARG 338 21.895 14.496 -11.289 1.00 0.00 ATOM 2597 CA ARG 338 22.673 15.331 -12.159 1.00 0.00 ATOM 2598 CB ARG 338 21.828 16.512 -12.607 1.00 0.00 ATOM 2599 CG ARG 338 22.526 17.321 -13.640 1.00 0.00 ATOM 2600 CD ARG 338 21.776 18.544 -14.018 1.00 0.00 ATOM 2601 NE ARG 338 22.555 19.329 -14.971 1.00 0.00 ATOM 2602 CZ ARG 338 23.491 20.221 -14.637 1.00 0.00 ATOM 2603 NH1 ARG 338 23.775 20.449 -13.356 1.00 0.00 ATOM 2604 NH2 ARG 338 24.137 20.897 -15.596 1.00 0.00 ATOM 2605 O ARG 338 23.778 16.427 -10.346 1.00 0.00 ATOM 2606 C ARG 338 23.883 15.892 -11.464 1.00 0.00 ATOM 2607 N ALA 339 25.025 15.804 -12.140 1.00 0.00 ATOM 2608 CA ALA 339 26.263 16.484 -11.720 1.00 0.00 ATOM 2609 CB ALA 339 26.156 18.006 -11.987 1.00 0.00 ATOM 2610 O ALA 339 27.102 17.114 -9.564 1.00 0.00 ATOM 2611 C ALA 339 26.717 16.208 -10.277 1.00 0.00 ATOM 2612 N ILE 340 26.693 14.943 -9.882 1.00 0.00 ATOM 2613 CA ILE 340 27.198 14.498 -8.602 1.00 0.00 ATOM 2614 CB ILE 340 26.902 12.990 -8.430 1.00 0.00 ATOM 2615 CG1 ILE 340 25.396 12.750 -8.280 1.00 0.00 ATOM 2616 CG2 ILE 340 27.727 12.353 -7.311 1.00 0.00 ATOM 2617 CD1 ILE 340 24.780 13.156 -6.994 1.00 0.00 ATOM 2618 O ILE 340 29.456 14.215 -9.401 1.00 0.00 ATOM 2619 C ILE 340 28.710 14.771 -8.578 1.00 0.00 ATOM 2620 N THR 341 29.162 15.591 -7.623 1.00 0.00 ATOM 2621 CA THR 341 30.495 16.189 -7.689 1.00 0.00 ATOM 2622 CB THR 341 30.381 17.713 -7.620 1.00 0.00 ATOM 2623 CG2 THR 341 31.743 18.396 -7.699 1.00 0.00 ATOM 2624 OG1 THR 341 29.566 18.138 -8.710 1.00 0.00 ATOM 2625 O THR 341 31.273 15.921 -5.429 1.00 0.00 ATOM 2626 C THR 341 31.462 15.681 -6.636 1.00 0.00 ATOM 2627 N PRO 342 32.524 14.982 -7.084 1.00 0.00 ATOM 2628 CA PRO 342 33.550 14.565 -6.112 1.00 0.00 ATOM 2629 CB PRO 342 34.648 13.932 -6.985 1.00 0.00 ATOM 2630 CG PRO 342 33.888 13.454 -8.196 1.00 0.00 ATOM 2631 CD PRO 342 32.853 14.555 -8.459 1.00 0.00 ATOM 2632 O PRO 342 34.399 16.816 -5.871 1.00 0.00 ATOM 2633 C PRO 342 34.096 15.742 -5.306 1.00 0.00 ATOM 2634 N GLY 343 34.183 15.524 -3.989 1.00 0.00 ATOM 2635 CA GLY 343 34.603 16.551 -3.040 1.00 0.00 ATOM 2636 O GLY 343 33.614 17.742 -1.215 1.00 0.00 ATOM 2637 C GLY 343 33.454 17.239 -2.321 1.00 0.00 ATOM 2638 N GLN 344 32.281 17.267 -2.932 1.00 0.00 ATOM 2639 CA GLN 344 31.151 17.945 -2.300 1.00 0.00 ATOM 2640 CB GLN 344 30.098 18.310 -3.340 1.00 0.00 ATOM 2641 CG GLN 344 30.617 19.390 -4.298 1.00 0.00 ATOM 2642 CD GLN 344 30.756 20.711 -3.591 1.00 0.00 ATOM 2643 OE1 GLN 344 29.751 21.361 -3.300 1.00 0.00 ATOM 2644 NE2 GLN 344 31.999 21.094 -3.243 1.00 0.00 ATOM 2645 O GLN 344 30.906 15.928 -1.100 1.00 0.00 ATOM 2646 C GLN 344 30.585 17.094 -1.180 1.00 0.00 ATOM 2647 N ALA 345 29.769 17.700 -0.316 1.00 0.00 ATOM 2648 CA ALA 345 29.136 16.995 0.774 1.00 0.00 ATOM 2649 CB ALA 345 28.816 17.986 1.923 1.00 0.00 ATOM 2650 O ALA 345 27.065 16.856 -0.421 1.00 0.00 ATOM 2651 C ALA 345 27.856 16.280 0.321 1.00 0.00 ATOM 2652 N VAL 346 27.675 15.039 0.771 1.00 0.00 ATOM 2653 CA VAL 346 26.393 14.341 0.708 1.00 0.00 ATOM 2654 CB VAL 346 26.517 12.796 0.609 1.00 0.00 ATOM 2655 CG1 VAL 346 25.401 12.186 -0.210 1.00 0.00 ATOM 2656 CG2 VAL 346 27.897 12.358 0.234 1.00 0.00 ATOM 2657 O VAL 346 26.612 14.014 3.060 1.00 0.00 ATOM 2658 C VAL 346 25.897 14.412 2.133 1.00 0.00 ATOM 2659 N VAL 347 24.658 14.840 2.314 1.00 0.00 ATOM 2660 CA VAL 347 24.119 15.008 3.650 1.00 0.00 ATOM 2661 CB VAL 347 24.008 16.500 3.991 1.00 0.00 ATOM 2662 CG1 VAL 347 23.462 16.698 5.379 1.00 0.00 ATOM 2663 CG2 VAL 347 25.381 17.155 3.842 1.00 0.00 ATOM 2664 O VAL 347 21.964 14.434 2.771 1.00 0.00 ATOM 2665 C VAL 347 22.782 14.297 3.699 1.00 0.00 ATOM 2666 N PHE 348 22.584 13.537 4.782 1.00 0.00 ATOM 2667 CA PHE 348 21.442 12.670 4.954 1.00 0.00 ATOM 2668 CB PHE 348 21.901 11.284 5.446 1.00 0.00 ATOM 2669 CG PHE 348 23.060 10.711 4.653 1.00 0.00 ATOM 2670 CD1 PHE 348 22.920 10.413 3.294 1.00 0.00 ATOM 2671 CD2 PHE 348 24.286 10.472 5.262 1.00 0.00 ATOM 2672 CE1 PHE 348 23.986 9.881 2.559 1.00 0.00 ATOM 2673 CE2 PHE 348 25.360 9.935 4.540 1.00 0.00 ATOM 2674 CZ PHE 348 25.216 9.640 3.189 1.00 0.00 ATOM 2675 O PHE 348 20.754 13.864 6.910 1.00 0.00 ATOM 2676 C PHE 348 20.418 13.263 5.886 1.00 0.00 ATOM 2677 N TYR 349 19.156 13.076 5.531 1.00 0.00 ATOM 2678 CA TYR 349 18.036 13.622 6.304 1.00 0.00 ATOM 2679 CB TYR 349 17.356 14.770 5.568 1.00 0.00 ATOM 2680 CG TYR 349 18.237 15.970 5.434 1.00 0.00 ATOM 2681 CD1 TYR 349 18.169 17.013 6.360 1.00 0.00 ATOM 2682 CD2 TYR 349 19.146 16.074 4.380 1.00 0.00 ATOM 2683 CE1 TYR 349 19.000 18.142 6.250 1.00 0.00 ATOM 2684 CE2 TYR 349 19.982 17.168 4.265 1.00 0.00 ATOM 2685 CZ TYR 349 19.896 18.207 5.207 1.00 0.00 ATOM 2686 OH TYR 349 20.723 19.305 5.086 1.00 0.00 ATOM 2687 O TYR 349 16.840 11.590 5.865 1.00 0.00 ATOM 2688 C TYR 349 17.001 12.574 6.597 1.00 0.00 ATOM 2689 N ASP 350 16.306 12.799 7.693 1.00 0.00 ATOM 2690 CA ASP 350 15.157 12.023 8.051 1.00 0.00 ATOM 2691 CB ASP 350 15.467 11.196 9.293 1.00 0.00 ATOM 2692 CG ASP 350 14.318 10.298 9.704 1.00 0.00 ATOM 2693 OD1 ASP 350 13.305 10.220 8.966 1.00 0.00 ATOM 2694 OD2 ASP 350 14.435 9.672 10.783 1.00 0.00 ATOM 2695 O ASP 350 13.915 13.472 9.470 1.00 0.00 ATOM 2696 C ASP 350 14.065 13.039 8.342 1.00 0.00 ATOM 2697 N GLY 351 13.313 13.427 7.317 1.00 0.00 ATOM 2698 CA GLY 351 12.351 14.499 7.491 1.00 0.00 ATOM 2699 O GLY 351 14.043 16.173 7.222 1.00 0.00 ATOM 2700 C GLY 351 13.113 15.741 7.908 1.00 0.00 ATOM 2701 N GLU 352 12.748 16.311 9.046 1.00 0.00 ATOM 2702 CA GLU 352 13.418 17.529 9.452 1.00 0.00 ATOM 2703 CB GLU 352 12.476 18.493 10.176 1.00 0.00 ATOM 2704 CG GLU 352 11.924 18.056 11.506 1.00 0.00 ATOM 2705 CD GLU 352 10.844 19.038 12.038 1.00 0.00 ATOM 2706 OE1 GLU 352 10.454 20.004 11.290 1.00 0.00 ATOM 2707 OE2 GLU 352 10.390 18.827 13.201 1.00 0.00 ATOM 2708 O GLU 352 15.464 18.294 10.414 1.00 0.00 ATOM 2709 C GLU 352 14.757 17.331 10.163 1.00 0.00 ATOM 2710 N GLU 353 15.132 16.084 10.420 1.00 0.00 ATOM 2711 CA GLU 353 16.362 15.834 11.111 1.00 0.00 ATOM 2712 CB GLU 353 16.275 14.574 11.963 1.00 0.00 ATOM 2713 CG GLU 353 17.490 14.423 12.886 1.00 0.00 ATOM 2714 CD GLU 353 17.489 13.159 13.763 1.00 0.00 ATOM 2715 OE1 GLU 353 16.420 12.526 13.974 1.00 0.00 ATOM 2716 OE2 GLU 353 18.592 12.832 14.259 1.00 0.00 ATOM 2717 O GLU 353 17.398 14.963 9.165 1.00 0.00 ATOM 2718 C GLU 353 17.501 15.688 10.140 1.00 0.00 ATOM 2719 N CYS 354 18.600 16.366 10.424 1.00 0.00 ATOM 2720 CA CYS 354 19.826 16.159 9.680 1.00 0.00 ATOM 2721 CB CYS 354 20.600 17.456 9.570 1.00 0.00 ATOM 2722 SG CYS 354 22.093 17.278 8.569 1.00 0.00 ATOM 2723 O CYS 354 21.220 15.296 11.451 1.00 0.00 ATOM 2724 C CYS 354 20.678 15.077 10.359 1.00 0.00 ATOM 2725 N LEU 355 20.795 13.918 9.710 1.00 0.00 ATOM 2726 CA LEU 355 21.435 12.749 10.350 1.00 0.00 ATOM 2727 CB LEU 355 20.975 11.442 9.710 1.00 0.00 ATOM 2728 CG LEU 355 19.460 11.211 9.750 1.00 0.00 ATOM 2729 CD1 LEU 355 19.048 10.117 8.799 1.00 0.00 ATOM 2730 CD2 LEU 355 18.965 10.916 11.179 1.00 0.00 ATOM 2731 O LEU 355 23.586 12.327 11.307 1.00 0.00 ATOM 2732 C LEU 355 22.957 12.818 10.383 1.00 0.00 ATOM 2733 N GLY 356 23.559 13.444 9.387 1.00 0.00 ATOM 2734 CA GLY 356 25.007 13.475 9.290 1.00 0.00 ATOM 2735 O GLY 356 24.530 14.026 7.038 1.00 0.00 ATOM 2736 C GLY 356 25.358 13.576 7.831 1.00 0.00 ATOM 2737 N GLY 357 26.570 13.168 7.470 1.00 0.00 ATOM 2738 CA GLY 357 27.004 13.273 6.095 1.00 0.00 ATOM 2739 O GLY 357 29.196 12.688 6.825 1.00 0.00 ATOM 2740 C GLY 357 28.455 12.938 5.869 1.00 0.00 ATOM 2741 N GLY 358 28.843 12.916 4.596 1.00 0.00 ATOM 2742 CA GLY 358 30.214 12.689 4.168 1.00 0.00 ATOM 2743 O GLY 358 29.952 14.541 2.628 1.00 0.00 ATOM 2744 C GLY 358 30.626 13.562 2.983 1.00 0.00 ATOM 2745 N LEU 359 31.745 13.194 2.377 1.00 0.00 ATOM 2746 CA LEU 359 32.280 13.881 1.198 1.00 0.00 ATOM 2747 CB LEU 359 33.720 14.358 1.454 1.00 0.00 ATOM 2748 CG LEU 359 33.772 15.321 2.652 1.00 0.00 ATOM 2749 CD1 LEU 359 35.210 15.621 3.038 1.00 0.00 ATOM 2750 CD2 LEU 359 32.989 16.636 2.351 1.00 0.00 ATOM 2751 O LEU 359 32.598 11.748 0.181 1.00 0.00 ATOM 2752 C LEU 359 32.225 12.916 0.037 1.00 0.00 ATOM 2753 N ILE 360 31.708 13.373 -1.091 1.00 0.00 ATOM 2754 CA ILE 360 31.556 12.499 -2.243 1.00 0.00 ATOM 2755 CB ILE 360 30.684 13.156 -3.286 1.00 0.00 ATOM 2756 CG1 ILE 360 29.260 13.285 -2.733 1.00 0.00 ATOM 2757 CG2 ILE 360 30.714 12.385 -4.606 1.00 0.00 ATOM 2758 CD1 ILE 360 28.419 14.340 -3.424 1.00 0.00 ATOM 2759 O ILE 360 33.690 13.039 -3.206 1.00 0.00 ATOM 2760 C ILE 360 32.926 12.140 -2.829 1.00 0.00 ATOM 2761 N ASP 361 33.221 10.838 -2.895 1.00 0.00 ATOM 2762 CA ASP 361 34.436 10.337 -3.545 1.00 0.00 ATOM 2763 CB ASP 361 34.796 8.934 -3.050 1.00 0.00 ATOM 2764 CG ASP 361 35.287 8.925 -1.637 1.00 0.00 ATOM 2765 OD1 ASP 361 35.750 9.982 -1.158 1.00 0.00 ATOM 2766 OD2 ASP 361 35.215 7.857 -0.998 1.00 0.00 ATOM 2767 O ASP 361 35.308 10.609 -5.758 1.00 0.00 ATOM 2768 C ASP 361 34.353 10.259 -5.065 1.00 0.00 ATOM 2769 N ASN 362 33.218 9.763 -5.556 1.00 0.00 ATOM 2770 CA ASN 362 33.026 9.366 -6.946 1.00 0.00 ATOM 2771 CB ASN 362 33.837 8.104 -7.275 1.00 0.00 ATOM 2772 CG ASN 362 35.217 8.412 -7.833 1.00 0.00 ATOM 2773 ND2 ASN 362 36.238 7.752 -7.295 1.00 0.00 ATOM 2774 OD1 ASN 362 35.361 9.241 -8.724 1.00 0.00 ATOM 2775 O ASN 362 30.876 8.604 -6.260 1.00 0.00 ATOM 2776 C ASN 362 31.567 9.046 -7.182 1.00 0.00 ATOM 2777 N ALA 363 31.120 9.255 -8.423 1.00 0.00 ATOM 2778 CA ALA 363 29.786 8.864 -8.869 1.00 0.00 ATOM 2779 CB ALA 363 29.136 9.976 -9.649 1.00 0.00 ATOM 2780 O ALA 363 30.930 7.347 -10.331 1.00 0.00 ATOM 2781 C ALA 363 29.882 7.612 -9.723 1.00 0.00 ATOM 2782 N TYR 364 28.789 6.855 -9.778 1.00 0.00 ATOM 2783 CA TYR 364 28.717 5.655 -10.624 1.00 0.00 ATOM 2784 CB TYR 364 28.810 4.384 -9.777 1.00 0.00 ATOM 2785 CG TYR 364 30.093 4.297 -9.013 1.00 0.00 ATOM 2786 CD1 TYR 364 31.133 3.476 -9.456 1.00 0.00 ATOM 2787 CD2 TYR 364 30.286 5.057 -7.855 1.00 0.00 ATOM 2788 CE1 TYR 364 32.338 3.389 -8.744 1.00 0.00 ATOM 2789 CE2 TYR 364 31.477 5.012 -7.160 1.00 0.00 ATOM 2790 CZ TYR 364 32.499 4.165 -7.593 1.00 0.00 ATOM 2791 OH TYR 364 33.678 4.099 -6.883 1.00 0.00 ATOM 2792 O TYR 364 26.396 6.077 -11.069 1.00 0.00 ATOM 2793 C TYR 364 27.461 5.609 -11.479 1.00 0.00 ATOM 2794 N ARG 365 27.605 5.113 -12.703 1.00 0.00 ATOM 2795 CA ARG 365 26.454 4.766 -13.526 1.00 0.00 ATOM 2796 CB ARG 365 26.209 5.755 -14.672 1.00 0.00 ATOM 2797 CG ARG 365 24.914 5.428 -15.437 1.00 0.00 ATOM 2798 CD ARG 365 24.462 6.536 -16.346 1.00 0.00 ATOM 2799 NE ARG 365 23.054 6.867 -16.120 1.00 0.00 ATOM 2800 CZ ARG 365 22.381 7.806 -16.787 1.00 0.00 ATOM 2801 NH1 ARG 365 22.978 8.510 -17.751 1.00 0.00 ATOM 2802 NH2 ARG 365 21.102 8.039 -16.491 1.00 0.00 ATOM 2803 O ARG 365 27.678 3.093 -14.716 1.00 0.00 ATOM 2804 C ARG 365 26.660 3.372 -14.076 1.00 0.00 ATOM 2805 N ASP 366 25.685 2.508 -13.813 1.00 0.00 ATOM 2806 CA ASP 366 25.727 1.077 -14.228 1.00 0.00 ATOM 2807 CB ASP 366 25.376 0.880 -15.720 1.00 0.00 ATOM 2808 CG ASP 366 24.337 1.879 -16.232 1.00 0.00 ATOM 2809 OD1 ASP 366 23.533 2.440 -15.413 1.00 0.00 ATOM 2810 OD2 ASP 366 24.347 2.117 -17.464 1.00 0.00 ATOM 2811 O ASP 366 27.752 -0.129 -14.799 1.00 0.00 ATOM 2812 C ASP 366 27.071 0.408 -13.903 1.00 0.00 ATOM 2813 N GLY 367 27.458 0.480 -12.625 1.00 0.00 ATOM 2814 CA GLY 367 28.667 -0.201 -12.130 1.00 0.00 ATOM 2815 O GLY 367 30.848 -0.604 -13.053 1.00 0.00 ATOM 2816 C GLY 367 29.967 0.224 -12.798 1.00 0.00 ATOM 2817 N GLN 368 30.085 1.512 -13.100 1.00 0.00 ATOM 2818 CA GLN 368 31.304 2.038 -13.681 1.00 0.00 ATOM 2819 CB GLN 368 31.292 1.890 -15.212 1.00 0.00 ATOM 2820 CG GLN 368 32.520 2.473 -15.947 1.00 0.00 ATOM 2821 CD GLN 368 33.094 1.524 -17.013 1.00 0.00 ATOM 2822 OE1 GLN 368 33.485 0.387 -16.710 1.00 0.00 ATOM 2823 NE2 GLN 368 33.165 2.001 -18.258 1.00 0.00 ATOM 2824 O GLN 368 30.462 4.241 -13.385 1.00 0.00 ATOM 2825 C GLN 368 31.409 3.476 -13.239 1.00 0.00 ATOM 2826 N VAL 369 32.559 3.820 -12.675 1.00 0.00 ATOM 2827 CA VAL 369 32.842 5.168 -12.216 1.00 0.00 ATOM 2828 CB VAL 369 34.257 5.275 -11.573 1.00 0.00 ATOM 2829 CG1 VAL 369 35.371 5.048 -12.618 1.00 0.00 ATOM 2830 CG2 VAL 369 34.435 6.624 -10.865 1.00 0.00 ATOM 2831 O VAL 369 33.099 6.006 -14.467 1.00 0.00 ATOM 2832 C VAL 369 32.654 6.197 -13.329 1.00 0.00 ATOM 2833 N CYS 370 31.959 7.279 -12.996 1.00 0.00 ATOM 2834 CA CYS 370 31.795 8.377 -13.924 1.00 0.00 ATOM 2835 CB CYS 370 30.694 9.319 -13.442 1.00 0.00 ATOM 2836 SG CYS 370 29.091 8.525 -13.237 1.00 0.00 ATOM 2837 O CYS 370 33.785 9.367 -13.035 1.00 0.00 ATOM 2838 C CYS 370 33.108 9.137 -14.040 1.00 0.00 ATOM 2839 N GLN 371 33.461 9.518 -15.271 1.00 0.00 ATOM 2840 CA GLN 371 34.654 10.314 -15.553 1.00 0.00 ATOM 2841 CB GLN 371 34.956 10.257 -17.054 1.00 0.00 ATOM 2842 CG GLN 371 36.315 10.822 -17.445 1.00 0.00 ATOM 2843 CD GLN 371 37.445 10.116 -16.730 1.00 0.00 ATOM 2844 OE1 GLN 371 38.053 10.664 -15.811 1.00 0.00 ATOM 2845 NE2 GLN 371 37.694 8.881 -17.107 1.00 0.00 ATOM 2846 O GLN 371 34.444 12.726 -15.864 1.00 0.00 ATOM 2847 C GLN 371 34.499 11.778 -15.058 1.00 0.00 ATOM 2848 N TYR 372 34.433 11.938 -13.731 1.00 0.00 ATOM 2849 CA TYR 372 34.266 13.244 -13.077 1.00 0.00 ATOM 2850 CB TYR 372 33.171 13.186 -12.031 1.00 0.00 ATOM 2851 CG TYR 372 31.777 13.008 -12.575 1.00 0.00 ATOM 2852 CD1 TYR 372 31.517 13.153 -13.914 1.00 0.00 ATOM 2853 CD2 TYR 372 30.706 12.728 -11.719 1.00 0.00 ATOM 2854 CE1 TYR 372 30.235 13.004 -14.409 1.00 0.00 ATOM 2855 CE2 TYR 372 29.424 12.572 -12.202 1.00 0.00 ATOM 2856 CZ TYR 372 29.197 12.710 -13.552 1.00 0.00 ATOM 2857 OH TYR 372 27.937 12.557 -14.059 1.00 0.00 ATOM 2858 O TYR 372 35.740 14.878 -12.122 1.00 0.00 ATOM 2859 C TYR 372 35.543 13.687 -12.387 1.00 0.00 ATOM 2860 N ILE 373 36.303 12.681 -11.967 1.00 0.00 ATOM 2861 CA ILE 373 37.730 12.739 -11.645 1.00 0.00 ATOM 2862 CB ILE 373 38.420 13.860 -12.409 1.00 0.00 ATOM 2863 CG1 ILE 373 39.638 13.288 -13.079 1.00 0.00 ATOM 2864 CG2 ILE 373 38.709 15.024 -11.485 1.00 0.00 ATOM 2865 CD1 ILE 373 39.394 11.852 -13.484 1.00 0.00 ATOM 2866 O ILE 373 39.511 12.769 -10.073 1.00 0.00 ATOM 2867 C ILE 373 38.278 12.607 -10.204 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 T0316.undertaker-align.pdb looking for model 1 WARNING: atoms too close: (T0316)M38.C and (T0316)D45.C only 0.000 apart, marking (T0316)D45.C as missing WARNING: atoms too close: (T0316)K39.N and (T0316)E46.N only 0.000 apart, marking (T0316)K39.N as missing WARNING: atoms too close: (T0316)K39.CA and (T0316)E46.CA only 0.000 apart, marking (T0316)K39.CA as missing WARNING: atoms too close: (T0316)G48.C and (T0316)T51.C only 0.000 apart, marking (T0316)T51.C as missing WARNING: atoms too close: (T0316)V49.N and (T0316)A52.N only 0.000 apart, marking (T0316)V49.N as missing WARNING: atoms too close: (T0316)V49.CA and (T0316)A52.CA only 0.000 apart, marking (T0316)V49.CA as missing WARNING: atoms too close: (T0316)I107.C and (T0316)K108.C only 0.000 apart, marking (T0316)K108.C as missing WARNING: atoms too close: (T0316)K108.N and (T0316)F109.N only 0.000 apart, marking (T0316)K108.N as missing WARNING: atoms too close: (T0316)K108.CA and (T0316)F109.CA only 0.000 apart, marking (T0316)K108.CA as missing WARNING: atoms too close: (T0316)A130.C and (T0316)A133.C only 0.000 apart, marking (T0316)A133.C as missing WARNING: atoms too close: (T0316)R131.N and (T0316)R134.N only 0.000 apart, marking (T0316)R131.N as missing WARNING: atoms too close: (T0316)R131.CA and (T0316)R134.CA only 0.000 apart, marking (T0316)R131.CA as missing WARNING: atoms too close: (T0316)V146.C and (T0316)N148.C only 0.000 apart, marking (T0316)N148.C as missing WARNING: atoms too close: (T0316)D147.N and (T0316)G149.N only 0.000 apart, marking (T0316)D147.N as missing WARNING: atoms too close: (T0316)D147.CA and (T0316)G149.CA only 0.000 apart, marking (T0316)D147.CA as missing WARNING: atoms too close: (T0316)G250.C and (T0316)A258.C only 0.000 apart, marking (T0316)A258.C as missing WARNING: atoms too close: (T0316)G251.N and (T0316)P259.N only 0.000 apart, marking (T0316)G251.N as missing WARNING: atoms too close: (T0316)G251.CA and (T0316)P259.CA only 0.000 apart, marking (T0316)G251.CA as missing WARNING: atoms too close: (T0316)E298.C and (T0316)M299.C only 0.000 apart, marking (T0316)M299.C as missing WARNING: atoms too close: (T0316)M299.N and (T0316)P300.N only 0.000 apart, marking (T0316)M299.N as missing WARNING: atoms too close: (T0316)M299.CA and (T0316)P300.CA only 0.000 apart, marking (T0316)M299.CA as missing # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # command:# naming current conformation align1 # command:# fraction of real conformation used = 0.745 # GDT_score = -24.245 # GDT_score(maxd=8.000,maxw=2.900)= -24.704 # GDT_score(maxd=8.000,maxw=3.200)= -23.266 # GDT_score(maxd=8.000,maxw=3.500)= -21.935 # GDT_score(maxd=10.000,maxw=3.800)= -23.648 # GDT_score(maxd=10.000,maxw=4.000)= -22.805 # GDT_score(maxd=10.000,maxw=4.200)= -22.004 # GDT_score(maxd=12.000,maxw=4.300)= -24.058 # GDT_score(maxd=12.000,maxw=4.500)= -23.244 # GDT_score(maxd=12.000,maxw=4.700)= -22.452 # GDT_score(maxd=14.000,maxw=5.200)= -22.628 # GDT_score(maxd=14.000,maxw=5.500)= -21.587 # command:# ReadConformPDB reading from PDB file T0316.undertaker-align.pdb looking for model 2 WARNING: atoms too close: (T0316)M38.C and (T0316)D43.C only 0.000 apart, marking (T0316)D43.C as missing WARNING: atoms too close: (T0316)K39.N and (T0316)T44.N only 0.000 apart, marking (T0316)K39.N as missing WARNING: atoms too close: (T0316)K39.CA and (T0316)T44.CA only 0.000 apart, marking (T0316)K39.CA as missing WARNING: atoms too close: (T0316)C50.C and (T0316)T51.C only 0.000 apart, marking (T0316)T51.C as missing WARNING: atoms too close: (T0316)T51.N and (T0316)A52.N only 0.000 apart, marking (T0316)T51.N as missing WARNING: atoms too close: (T0316)T51.CA and (T0316)A52.CA only 0.000 apart, marking (T0316)T51.CA as missing WARNING: atoms too close: (T0316)E76.C and (T0316)F87.C only 0.000 apart, marking (T0316)F87.C as missing WARNING: atoms too close: (T0316)K77.N and (T0316)L88.N only 0.000 apart, marking (T0316)K77.N as missing WARNING: atoms too close: (T0316)K77.CA and (T0316)L88.CA only 0.000 apart, marking (T0316)K77.CA as missing WARNING: atoms too close: (T0316)E106.C and (T0316)I107.C only 0.000 apart, marking (T0316)I107.C as missing WARNING: atoms too close: (T0316)I107.N and (T0316)K108.N only 0.000 apart, marking (T0316)I107.N as missing WARNING: atoms too close: (T0316)I107.CA and (T0316)K108.CA only 0.000 apart, marking (T0316)I107.CA as missing WARNING: atoms too close: (T0316)D135.C and (T0316)Q152.C only 0.000 apart, marking (T0316)Q152.C as missing WARNING: atoms too close: (T0316)E136.N and (T0316)T153.N only 0.000 apart, marking (T0316)E136.N as missing WARNING: atoms too close: (T0316)E136.CA and (T0316)T153.CA only 0.000 apart, marking (T0316)E136.CA as missing WARNING: atoms too close: (T0316)M223.C and (T0316)T286.C only 0.000 apart, marking (T0316)T286.C as missing WARNING: atoms too close: (T0316)T224.N and (T0316)S287.N only 0.000 apart, marking (T0316)T224.N as missing WARNING: atoms too close: (T0316)T224.CA and (T0316)S287.CA only 0.000 apart, marking (T0316)T224.CA as missing WARNING: atoms too close: (T0316)F311.C and (T0316)V324.C only 0.000 apart, marking (T0316)V324.C as missing WARNING: atoms too close: (T0316)R312.N and (T0316)K325.N only 0.000 apart, marking (T0316)R312.N as missing WARNING: atoms too close: (T0316)R312.CA and (T0316)K325.CA only 0.000 apart, marking (T0316)R312.CA as missing # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # command:# naming current conformation align2 # command:# fraction of real conformation used = 0.574 # GDT_score = -25.000 # GDT_score(maxd=8.000,maxw=2.900)= -25.949 # GDT_score(maxd=8.000,maxw=3.200)= -24.563 # GDT_score(maxd=8.000,maxw=3.500)= -23.189 # GDT_score(maxd=10.000,maxw=3.800)= -24.446 # GDT_score(maxd=10.000,maxw=4.000)= -23.580 # GDT_score(maxd=10.000,maxw=4.200)= -22.758 # GDT_score(maxd=12.000,maxw=4.300)= -24.426 # GDT_score(maxd=12.000,maxw=4.500)= -23.615 # GDT_score(maxd=12.000,maxw=4.700)= -22.853 # GDT_score(maxd=14.000,maxw=5.200)= -22.755 # GDT_score(maxd=14.000,maxw=5.500)= -21.755 # command:# ReadConformPDB reading from PDB file T0316.undertaker-align.pdb looking for model 3 WARNING: atoms too close: (T0316)M38.C and (T0316)D45.C only 0.000 apart, marking (T0316)D45.C as missing WARNING: atoms too close: (T0316)K39.N and (T0316)E46.N only 0.000 apart, marking (T0316)K39.N as missing WARNING: atoms too close: (T0316)K39.CA and (T0316)E46.CA only 0.000 apart, marking (T0316)K39.CA as missing WARNING: atoms too close: (T0316)C50.C and (T0316)T51.C only 0.000 apart, marking (T0316)T51.C as missing WARNING: atoms too close: (T0316)T51.N and (T0316)A52.N only 0.000 apart, marking (T0316)T51.N as missing WARNING: atoms too close: (T0316)T51.CA and (T0316)A52.CA only 0.000 apart, marking (T0316)T51.CA as missing WARNING: atoms too close: (T0316)F87.C and (T0316)C103.C only 0.000 apart, marking (T0316)C103.C as missing WARNING: atoms too close: (T0316)L88.N and (T0316)N104.N only 0.000 apart, marking (T0316)L88.N as missing WARNING: atoms too close: (T0316)L88.CA and (T0316)N104.CA only 0.000 apart, marking (T0316)L88.CA as missing WARNING: atoms too close: (T0316)K108.C and (T0316)F109.C only 0.000 apart, marking (T0316)F109.C as missing WARNING: atoms too close: (T0316)F109.N and (T0316)K110.N only 0.000 apart, marking (T0316)F109.N as missing WARNING: atoms too close: (T0316)F109.CA and (T0316)K110.CA only 0.000 apart, marking (T0316)F109.CA as missing WARNING: atoms too close: (T0316)A130.C and (T0316)A133.C only 0.000 apart, marking (T0316)A133.C as missing WARNING: atoms too close: (T0316)R131.N and (T0316)R134.N only 0.000 apart, marking (T0316)R131.N as missing WARNING: atoms too close: (T0316)R131.CA and (T0316)R134.CA only 0.000 apart, marking (T0316)R131.CA as missing WARNING: atoms too close: (T0316)E162.C and (T0316)Q165.C only 0.000 apart, marking (T0316)Q165.C as missing WARNING: atoms too close: (T0316)Q163.N and (T0316)K166.N only 0.000 apart, marking (T0316)Q163.N as missing WARNING: atoms too close: (T0316)Q163.CA and (T0316)K166.CA only 0.000 apart, marking (T0316)Q163.CA as missing WARNING: atoms too close: (T0316)N206.C and (T0316)F207.C only 0.000 apart, marking (T0316)F207.C as missing WARNING: atoms too close: (T0316)F207.N and (T0316)K208.N only 0.000 apart, marking (T0316)F207.N as missing WARNING: atoms too close: (T0316)F207.CA and (T0316)K208.CA only 0.000 apart, marking (T0316)F207.CA as missing # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # command:# naming current conformation align3 # command:# ReadConformPDB reading from PDB file T0316.undertaker-align.pdb looking for model 4 WARNING: atoms too close: (T0316)M38.C and (T0316)D45.C only 0.000 apart, marking (T0316)D45.C as missing WARNING: atoms too close: (T0316)K39.N and (T0316)E46.N only 0.000 apart, marking (T0316)K39.N as missing WARNING: atoms too close: (T0316)K39.CA and (T0316)E46.CA only 0.000 apart, marking (T0316)K39.CA as missing WARNING: atoms too close: (T0316)C50.C and (T0316)T51.C only 0.000 apart, marking (T0316)T51.C as missing WARNING: atoms too close: (T0316)T51.N and (T0316)A52.N only 0.000 apart, marking (T0316)T51.N as missing WARNING: atoms too close: (T0316)T51.CA and (T0316)A52.CA only 0.000 apart, marking (T0316)T51.CA as missing WARNING: atoms too close: (T0316)Y86.C and (T0316)M102.C only 0.000 apart, marking (T0316)M102.C as missing WARNING: atoms too close: (T0316)F87.N and (T0316)C103.N only 0.000 apart, marking (T0316)F87.N as missing WARNING: atoms too close: (T0316)F87.CA and (T0316)C103.CA only 0.000 apart, marking (T0316)F87.CA as missing WARNING: atoms too close: (T0316)E106.C and (T0316)I107.C only 0.000 apart, marking (T0316)I107.C as missing WARNING: atoms too close: (T0316)I107.N and (T0316)K108.N only 0.000 apart, marking (T0316)I107.N as missing WARNING: atoms too close: (T0316)I107.CA and (T0316)K108.CA only 0.000 apart, marking (T0316)I107.CA as missing WARNING: atoms too close: (T0316)V124.C and (T0316)T126.C only 0.000 apart, marking (T0316)T126.C as missing WARNING: atoms too close: (T0316)A125.N and (T0316)G127.N only 0.000 apart, marking (T0316)A125.N as missing WARNING: atoms too close: (T0316)A125.CA and (T0316)G127.CA only 0.000 apart, marking (T0316)A125.CA as missing WARNING: atoms too close: (T0316)D135.C and (T0316)T139.C only 0.000 apart, marking (T0316)T139.C as missing WARNING: atoms too close: (T0316)E136.N and (T0316)V140.N only 0.000 apart, marking (T0316)E136.N as missing WARNING: atoms too close: (T0316)E136.CA and (T0316)V140.CA only 0.000 apart, marking (T0316)E136.CA as missing WARNING: atoms too close: (T0316)K150.C and (T0316)T167.C only 0.000 apart, marking (T0316)T167.C as missing WARNING: atoms too close: (T0316)D151.N and (T0316)M168.N only 0.000 apart, marking (T0316)D151.N as missing WARNING: atoms too close: (T0316)D151.CA and (T0316)M168.CA only 0.000 apart, marking (T0316)D151.CA as missing WARNING: atoms too close: (T0316)I199.C and (T0316)F201.C only 0.000 apart, marking (T0316)F201.C as missing WARNING: atoms too close: (T0316)C200.N and (T0316)I202.N only 0.000 apart, marking (T0316)C200.N as missing WARNING: atoms too close: (T0316)C200.CA and (T0316)I202.CA only 0.000 apart, marking (T0316)C200.CA as missing WARNING: atoms too close: (T0316)Y214.C and (T0316)S282.C only 0.000 apart, marking (T0316)S282.C as missing WARNING: atoms too close: (T0316)L215.N and (T0316)L283.N only 0.000 apart, marking (T0316)L215.N as missing WARNING: atoms too close: (T0316)L215.CA and (T0316)L283.CA only 0.000 apart, marking (T0316)L215.CA as missing # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # command:# naming current conformation align4 # command:# ReadConformPDB reading from PDB file T0316.undertaker-align.pdb looking for model 5 WARNING: atoms too close: (T0316)M38.C and (T0316)D43.C only 0.000 apart, marking (T0316)D43.C as missing WARNING: atoms too close: (T0316)K39.N and (T0316)T44.N only 0.000 apart, marking (T0316)K39.N as missing WARNING: atoms too close: (T0316)K39.CA and (T0316)T44.CA only 0.000 apart, marking (T0316)K39.CA as missing WARNING: atoms too close: (T0316)C50.C and (T0316)T51.C only 0.000 apart, marking (T0316)T51.C as missing WARNING: atoms too close: (T0316)T51.N and (T0316)A52.N only 0.000 apart, marking (T0316)T51.N as missing WARNING: atoms too close: (T0316)T51.CA and (T0316)A52.CA only 0.000 apart, marking (T0316)T51.CA as missing WARNING: atoms too close: (T0316)E76.C and (T0316)Y91.C only 0.000 apart, marking (T0316)Y91.C as missing WARNING: atoms too close: (T0316)K77.N and (T0316)R92.N only 0.000 apart, marking (T0316)K77.N as missing WARNING: atoms too close: (T0316)K77.CA and (T0316)R92.CA only 0.000 apart, marking (T0316)K77.CA as missing WARNING: atoms too close: (T0316)C103.C and (T0316)K108.C only 0.000 apart, marking (T0316)K108.C as missing WARNING: atoms too close: (T0316)N104.N and (T0316)F109.N only 0.000 apart, marking (T0316)N104.N as missing WARNING: atoms too close: (T0316)N104.CA and (T0316)F109.CA only 0.000 apart, marking (T0316)N104.CA as missing WARNING: atoms too close: (T0316)G120.C and (T0316)A121.C only 0.000 apart, marking (T0316)A121.C as missing WARNING: atoms too close: (T0316)A121.N and (T0316)D122.N only 0.000 apart, marking (T0316)A121.N as missing WARNING: atoms too close: (T0316)A121.CA and (T0316)D122.CA only 0.000 apart, marking (T0316)A121.CA as missing WARNING: atoms too close: (T0316)D135.C and (T0316)E136.C only 0.000 apart, marking (T0316)E136.C as missing WARNING: atoms too close: (T0316)E136.N and (T0316)D137.N only 0.000 apart, marking (T0316)E136.N as missing WARNING: atoms too close: (T0316)E136.CA and (T0316)D137.CA only 0.000 apart, marking (T0316)E136.CA as missing WARNING: atoms too close: (T0316)K150.C and (T0316)Q152.C only 0.000 apart, marking (T0316)Q152.C as missing WARNING: atoms too close: (T0316)D151.N and (T0316)T153.N only 0.000 apart, marking (T0316)D151.N as missing WARNING: atoms too close: (T0316)D151.CA and (T0316)T153.CA only 0.000 apart, marking (T0316)D151.CA as missing WARNING: atoms too close: (T0316)W260.C and (T0316)F311.C only 0.000 apart, marking (T0316)F311.C as missing WARNING: atoms too close: (T0316)F261.N and (T0316)R312.N only 0.000 apart, marking (T0316)F261.N as missing WARNING: atoms too close: (T0316)F261.CA and (T0316)R312.CA only 0.000 apart, marking (T0316)F261.CA as missing # WARNING: incomplete conformation T0316 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 371 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ../model2.ts-submitted looking for model 1 # Found a chain break before 371 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ../model3.ts-submitted looking for model 1 # Found a chain break before 368 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ../model4.ts-submitted looking for model 1 # Found a chain break before 355 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file ../model5.ts-submitted looking for model 1 # Found a chain break before 355 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.M1-A183-try2-opt2-D122-K269-try1-opt2-A130-I373-try4-opt2-proteinshop.pdb.gz looking for model 1 # Found a chain break before 359 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.M1-A183-try2-opt2-D122-K269-try1-opt2-A130-I373-try4-opt2.pdb.gz looking for model 1 # Found a chain break before 359 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try1-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 354 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try1-opt1.pdb.gz looking for model 1 # Found a chain break before 354 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try1-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 356 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try1-opt2.pdb.gz looking for model 1 # Found a chain break before 371 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try1-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 371 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try10-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 368 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try10-opt1.pdb.gz looking for model 1 # Found a chain break before 368 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try10-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 272 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try10-opt2.pdb.gz looking for model 1 # Found a chain break before 368 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try10-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 368 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try11-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 346 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try11-opt1.pdb.gz looking for model 1 # Found a chain break before 346 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try11-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 358 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try11-opt2.pdb.gz looking for model 1 # Found a chain break before 355 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try11-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 355 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try12-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 368 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try12-opt1.pdb.gz looking for model 1 # Found a chain break before 368 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try12-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 351 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try12-opt2.pdb.gz looking for model 1 # Found a chain break before 368 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try12-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 368 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try13-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 349 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try13-opt1.pdb.gz looking for model 1 # Found a chain break before 349 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try13-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 339 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try13-opt2.pdb.gz looking for model 1 # Found a chain break before 349 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try13-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 349 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try14-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 368 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try14-opt1.pdb.gz looking for model 1 # Found a chain break before 368 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try14-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 272 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try14-opt2.pdb.gz looking for model 1 # Found a chain break before 368 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try14-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 368 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try15-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 371 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try15-opt1.pdb.gz looking for model 1 # Found a chain break before 371 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try15-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 369 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try15-opt2.pdb.gz looking for model 1 # Found a chain break before 371 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try15-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 371 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try16-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 352 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try16-opt1.pdb.gz looking for model 1 # Found a chain break before 352 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try16-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 371 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try16-opt2.pdb.gz looking for model 1 # Found a chain break before 367 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try16-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 367 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try17-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 352 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try17-opt1.pdb.gz looking for model 1 # Found a chain break before 352 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try17-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 352 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try17-opt2.pdb.gz looking for model 1 # Found a chain break before 369 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try17-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 369 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try18-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 359 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try18-opt1.pdb.gz looking for model 1 # Found a chain break before 359 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try18-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 343 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try18-opt2.pdb.gz looking for model 1 # Found a chain break before 368 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try18-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 368 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try19-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 371 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try19-opt1.pdb.gz looking for model 1 # Found a chain break before 371 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try19-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 343 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try19-opt2.pdb.gz looking for model 1 # Found a chain break before 371 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try19-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 371 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try2-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 340 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try2-opt1.pdb.gz looking for model 1 # Found a chain break before 340 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try2-opt2-M1-A183-try6-opt2-A130-I373.pdb.gz looking for model 1 # Found a chain break before 368 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try2-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 341 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try2-opt2.pdb.gz looking for model 1 # Found a chain break before 368 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try2-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 368 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try20-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 368 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try20-opt1.pdb.gz looking for model 1 # Found a chain break before 368 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try20-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 299 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try20-opt2.pdb.gz looking for model 1 # Found a chain break before 368 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try20-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 368 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try21-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 371 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try21-opt1.pdb.gz looking for model 1 # Found a chain break before 371 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try21-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 281 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try21-opt2.pdb.gz looking for model 1 # Found a chain break before 371 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try21-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 371 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try3-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 359 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try3-opt1.pdb.gz looking for model 1 # Found a chain break before 359 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try3-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 362 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try3-opt2.pdb.gz looking for model 1 # Found a chain break before 369 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try3-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 369 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try4-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 352 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try4-opt1.pdb.gz looking for model 1 # Found a chain break before 352 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try4-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 338 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try4-opt2.pdb.gz looking for model 1 # Found a chain break before 367 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try4-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 367 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try5-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 363 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try5-opt1.pdb.gz looking for model 1 # Found a chain break before 363 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try5-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 349 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try5-opt2.pdb.gz looking for model 1 # Found a chain break before 363 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try5-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 363 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try6-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 364 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try6-opt1.pdb.gz looking for model 1 # Found a chain break before 364 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try6-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 343 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try6-opt2.pdb.gz looking for model 1 # Found a chain break before 368 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try6-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 368 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try7-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 345 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try7-opt1.pdb.gz looking for model 1 # Found a chain break before 345 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try7-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 345 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try7-opt2.pdb.gz looking for model 1 # Found a chain break before 359 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try7-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 359 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try8-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 359 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try8-opt1.pdb.gz looking for model 1 # Found a chain break before 359 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try8-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 345 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try8-opt2.pdb.gz looking for model 1 # Found a chain break before 371 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try8-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 371 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try9-opt1-scwrl.pdb.gz looking for model 1 # Found a chain break before 349 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try9-opt1.pdb.gz looking for model 1 # Found a chain break before 349 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try9-opt2.gromacs0.pdb.gz looking for model 1 # Found a chain break before 335 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try9-opt2.pdb.gz looking for model 1 # Found a chain break before 355 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file T0316.try9-opt2.repack-nonPC.pdb.gz looking for model 1 # Found a chain break before 355 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file chimera1.pdb.gz looking for model 1 # Found a chain break before 359 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file make-chimera.pdb.gz looking for model 1 # Found a chain break before 359 # copying to AlignedFragments data structure # ReadConformPDB reading from PDB file servers/3D-JIGSAW_POPULUS_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_POPULUS_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1745850986.pdb -s /var/tmp/to_scwrl_1745850986.seq -o /var/tmp/from_scwrl_1745850986.pdb > /var/tmp/scwrl_1745850986.log sh: /var/tmp/scwrl_1745850986.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1745850986.pdb or /var/tmp/from_scwrl_1745850986.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1745850986_b.pdb or decoys//var/tmp/from_scwrl_1745850986_b.pdb.gz for input Trying /var/tmp/from_scwrl_1745850986_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1745850986_b.pdb or /var/tmp/from_scwrl_1745850986_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1745850986_a.pdb or decoys//var/tmp/from_scwrl_1745850986_a.pdb.gz for input Trying /var/tmp/from_scwrl_1745850986_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1745850986_a.pdb or /var/tmp/from_scwrl_1745850986_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1745850986.pdb or /var/tmp/from_scwrl_1745850986_b.pdb or /var/tmp/from_scwrl_1745850986_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_POPULUS_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_908049048.pdb -s /var/tmp/to_scwrl_908049048.seq -o /var/tmp/from_scwrl_908049048.pdb > /var/tmp/scwrl_908049048.log sh: /var/tmp/scwrl_908049048.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_908049048.pdb or /var/tmp/from_scwrl_908049048.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_908049048_b.pdb or decoys//var/tmp/from_scwrl_908049048_b.pdb.gz for input Trying /var/tmp/from_scwrl_908049048_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_908049048_b.pdb or /var/tmp/from_scwrl_908049048_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_908049048_a.pdb or decoys//var/tmp/from_scwrl_908049048_a.pdb.gz for input Trying /var/tmp/from_scwrl_908049048_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_908049048_a.pdb or /var/tmp/from_scwrl_908049048_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_908049048.pdb or /var/tmp/from_scwrl_908049048_b.pdb or /var/tmp/from_scwrl_908049048_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_POPULUS_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1478597525.pdb -s /var/tmp/to_scwrl_1478597525.seq -o /var/tmp/from_scwrl_1478597525.pdb > /var/tmp/scwrl_1478597525.log sh: /var/tmp/scwrl_1478597525.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1478597525.pdb or /var/tmp/from_scwrl_1478597525.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1478597525_b.pdb or decoys//var/tmp/from_scwrl_1478597525_b.pdb.gz for input Trying /var/tmp/from_scwrl_1478597525_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1478597525_b.pdb or /var/tmp/from_scwrl_1478597525_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1478597525_a.pdb or decoys//var/tmp/from_scwrl_1478597525_a.pdb.gz for input Trying /var/tmp/from_scwrl_1478597525_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1478597525_a.pdb or /var/tmp/from_scwrl_1478597525_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1478597525.pdb or /var/tmp/from_scwrl_1478597525_b.pdb or /var/tmp/from_scwrl_1478597525_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_POPULUS_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1760802325.pdb -s /var/tmp/to_scwrl_1760802325.seq -o /var/tmp/from_scwrl_1760802325.pdb > /var/tmp/scwrl_1760802325.log sh: /var/tmp/scwrl_1760802325.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1760802325.pdb or /var/tmp/from_scwrl_1760802325.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1760802325_b.pdb or decoys//var/tmp/from_scwrl_1760802325_b.pdb.gz for input Trying /var/tmp/from_scwrl_1760802325_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1760802325_b.pdb or /var/tmp/from_scwrl_1760802325_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1760802325_a.pdb or decoys//var/tmp/from_scwrl_1760802325_a.pdb.gz for input Trying /var/tmp/from_scwrl_1760802325_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1760802325_a.pdb or /var/tmp/from_scwrl_1760802325_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1760802325.pdb or /var/tmp/from_scwrl_1760802325_b.pdb or /var/tmp/from_scwrl_1760802325_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_POPULUS_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_347257320.pdb -s /var/tmp/to_scwrl_347257320.seq -o /var/tmp/from_scwrl_347257320.pdb > /var/tmp/scwrl_347257320.log sh: /var/tmp/scwrl_347257320.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_347257320.pdb or /var/tmp/from_scwrl_347257320.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_347257320_b.pdb or decoys//var/tmp/from_scwrl_347257320_b.pdb.gz for input Trying /var/tmp/from_scwrl_347257320_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_347257320_b.pdb or /var/tmp/from_scwrl_347257320_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_347257320_a.pdb or decoys//var/tmp/from_scwrl_347257320_a.pdb.gz for input Trying /var/tmp/from_scwrl_347257320_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_347257320_a.pdb or /var/tmp/from_scwrl_347257320_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_347257320.pdb or /var/tmp/from_scwrl_347257320_b.pdb or /var/tmp/from_scwrl_347257320_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_RECOM_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_400925985.pdb -s /var/tmp/to_scwrl_400925985.seq -o /var/tmp/from_scwrl_400925985.pdb > /var/tmp/scwrl_400925985.log sh: /var/tmp/scwrl_400925985.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_400925985.pdb or /var/tmp/from_scwrl_400925985.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_400925985_b.pdb or decoys//var/tmp/from_scwrl_400925985_b.pdb.gz for input Trying /var/tmp/from_scwrl_400925985_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_400925985_b.pdb or /var/tmp/from_scwrl_400925985_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_400925985_a.pdb or decoys//var/tmp/from_scwrl_400925985_a.pdb.gz for input Trying /var/tmp/from_scwrl_400925985_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_400925985_a.pdb or /var/tmp/from_scwrl_400925985_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_400925985.pdb or /var/tmp/from_scwrl_400925985_b.pdb or /var/tmp/from_scwrl_400925985_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_RECOM_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1624969895.pdb -s /var/tmp/to_scwrl_1624969895.seq -o /var/tmp/from_scwrl_1624969895.pdb > /var/tmp/scwrl_1624969895.log sh: /var/tmp/scwrl_1624969895.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1624969895.pdb or /var/tmp/from_scwrl_1624969895.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1624969895_b.pdb or decoys//var/tmp/from_scwrl_1624969895_b.pdb.gz for input Trying /var/tmp/from_scwrl_1624969895_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1624969895_b.pdb or /var/tmp/from_scwrl_1624969895_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1624969895_a.pdb or decoys//var/tmp/from_scwrl_1624969895_a.pdb.gz for input Trying /var/tmp/from_scwrl_1624969895_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1624969895_a.pdb or /var/tmp/from_scwrl_1624969895_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1624969895.pdb or /var/tmp/from_scwrl_1624969895_b.pdb or /var/tmp/from_scwrl_1624969895_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_RECOM_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_201578933.pdb -s /var/tmp/to_scwrl_201578933.seq -o /var/tmp/from_scwrl_201578933.pdb > /var/tmp/scwrl_201578933.log sh: /var/tmp/scwrl_201578933.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_201578933.pdb or /var/tmp/from_scwrl_201578933.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_201578933_b.pdb or decoys//var/tmp/from_scwrl_201578933_b.pdb.gz for input Trying /var/tmp/from_scwrl_201578933_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_201578933_b.pdb or /var/tmp/from_scwrl_201578933_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_201578933_a.pdb or decoys//var/tmp/from_scwrl_201578933_a.pdb.gz for input Trying /var/tmp/from_scwrl_201578933_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_201578933_a.pdb or /var/tmp/from_scwrl_201578933_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_201578933.pdb or /var/tmp/from_scwrl_201578933_b.pdb or /var/tmp/from_scwrl_201578933_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_RECOM_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1955188253.pdb -s /var/tmp/to_scwrl_1955188253.seq -o /var/tmp/from_scwrl_1955188253.pdb > /var/tmp/scwrl_1955188253.log sh: /var/tmp/scwrl_1955188253.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1955188253.pdb or /var/tmp/from_scwrl_1955188253.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1955188253_b.pdb or decoys//var/tmp/from_scwrl_1955188253_b.pdb.gz for input Trying /var/tmp/from_scwrl_1955188253_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1955188253_b.pdb or /var/tmp/from_scwrl_1955188253_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1955188253_a.pdb or decoys//var/tmp/from_scwrl_1955188253_a.pdb.gz for input Trying /var/tmp/from_scwrl_1955188253_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1955188253_a.pdb or /var/tmp/from_scwrl_1955188253_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1955188253.pdb or /var/tmp/from_scwrl_1955188253_b.pdb or /var/tmp/from_scwrl_1955188253_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_RECOM_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_635957366.pdb -s /var/tmp/to_scwrl_635957366.seq -o /var/tmp/from_scwrl_635957366.pdb > /var/tmp/scwrl_635957366.log sh: /var/tmp/scwrl_635957366.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_635957366.pdb or /var/tmp/from_scwrl_635957366.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_635957366_b.pdb or decoys//var/tmp/from_scwrl_635957366_b.pdb.gz for input Trying /var/tmp/from_scwrl_635957366_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_635957366_b.pdb or /var/tmp/from_scwrl_635957366_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_635957366_a.pdb or decoys//var/tmp/from_scwrl_635957366_a.pdb.gz for input Trying /var/tmp/from_scwrl_635957366_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_635957366_a.pdb or /var/tmp/from_scwrl_635957366_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_635957366.pdb or /var/tmp/from_scwrl_635957366_b.pdb or /var/tmp/from_scwrl_635957366_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_239207387.pdb -s /var/tmp/to_scwrl_239207387.seq -o /var/tmp/from_scwrl_239207387.pdb > /var/tmp/scwrl_239207387.log sh: /var/tmp/scwrl_239207387.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_239207387.pdb or /var/tmp/from_scwrl_239207387.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_239207387_b.pdb or decoys//var/tmp/from_scwrl_239207387_b.pdb.gz for input Trying /var/tmp/from_scwrl_239207387_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_239207387_b.pdb or /var/tmp/from_scwrl_239207387_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_239207387_a.pdb or decoys//var/tmp/from_scwrl_239207387_a.pdb.gz for input Trying /var/tmp/from_scwrl_239207387_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_239207387_a.pdb or /var/tmp/from_scwrl_239207387_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_239207387.pdb or /var/tmp/from_scwrl_239207387_b.pdb or /var/tmp/from_scwrl_239207387_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_474242632.pdb -s /var/tmp/to_scwrl_474242632.seq -o /var/tmp/from_scwrl_474242632.pdb > /var/tmp/scwrl_474242632.log sh: /var/tmp/scwrl_474242632.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_474242632.pdb or /var/tmp/from_scwrl_474242632.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_474242632_b.pdb or decoys//var/tmp/from_scwrl_474242632_b.pdb.gz for input Trying /var/tmp/from_scwrl_474242632_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_474242632_b.pdb or /var/tmp/from_scwrl_474242632_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_474242632_a.pdb or decoys//var/tmp/from_scwrl_474242632_a.pdb.gz for input Trying /var/tmp/from_scwrl_474242632_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_474242632_a.pdb or /var/tmp/from_scwrl_474242632_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_474242632.pdb or /var/tmp/from_scwrl_474242632_b.pdb or /var/tmp/from_scwrl_474242632_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_210445846.pdb -s /var/tmp/to_scwrl_210445846.seq -o /var/tmp/from_scwrl_210445846.pdb > /var/tmp/scwrl_210445846.log sh: /var/tmp/scwrl_210445846.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_210445846.pdb or /var/tmp/from_scwrl_210445846.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_210445846_b.pdb or decoys//var/tmp/from_scwrl_210445846_b.pdb.gz for input Trying /var/tmp/from_scwrl_210445846_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_210445846_b.pdb or /var/tmp/from_scwrl_210445846_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_210445846_a.pdb or decoys//var/tmp/from_scwrl_210445846_a.pdb.gz for input Trying /var/tmp/from_scwrl_210445846_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_210445846_a.pdb or /var/tmp/from_scwrl_210445846_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_210445846.pdb or /var/tmp/from_scwrl_210445846_b.pdb or /var/tmp/from_scwrl_210445846_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1193872916.pdb -s /var/tmp/to_scwrl_1193872916.seq -o /var/tmp/from_scwrl_1193872916.pdb > /var/tmp/scwrl_1193872916.log sh: /var/tmp/scwrl_1193872916.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1193872916.pdb or /var/tmp/from_scwrl_1193872916.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1193872916_b.pdb or decoys//var/tmp/from_scwrl_1193872916_b.pdb.gz for input Trying /var/tmp/from_scwrl_1193872916_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1193872916_b.pdb or /var/tmp/from_scwrl_1193872916_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1193872916_a.pdb or decoys//var/tmp/from_scwrl_1193872916_a.pdb.gz for input Trying /var/tmp/from_scwrl_1193872916_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1193872916_a.pdb or /var/tmp/from_scwrl_1193872916_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1193872916.pdb or /var/tmp/from_scwrl_1193872916_b.pdb or /var/tmp/from_scwrl_1193872916_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation 3D-JIGSAW_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1120135888.pdb -s /var/tmp/to_scwrl_1120135888.seq -o /var/tmp/from_scwrl_1120135888.pdb > /var/tmp/scwrl_1120135888.log sh: /var/tmp/scwrl_1120135888.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1120135888.pdb or /var/tmp/from_scwrl_1120135888.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1120135888_b.pdb or decoys//var/tmp/from_scwrl_1120135888_b.pdb.gz for input Trying /var/tmp/from_scwrl_1120135888_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1120135888_b.pdb or /var/tmp/from_scwrl_1120135888_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1120135888_a.pdb or decoys//var/tmp/from_scwrl_1120135888_a.pdb.gz for input Trying /var/tmp/from_scwrl_1120135888_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1120135888_a.pdb or /var/tmp/from_scwrl_1120135888_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1120135888.pdb or /var/tmp/from_scwrl_1120135888_b.pdb or /var/tmp/from_scwrl_1120135888_a.pdb Error: no new SCWRL conformation added # 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 353 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_242476011.pdb -s /var/tmp/to_scwrl_242476011.seq -o /var/tmp/from_scwrl_242476011.pdb > /var/tmp/scwrl_242476011.log sh: /var/tmp/scwrl_242476011.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_242476011.pdb or /var/tmp/from_scwrl_242476011.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_242476011_b.pdb or decoys//var/tmp/from_scwrl_242476011_b.pdb.gz for input Trying /var/tmp/from_scwrl_242476011_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_242476011_b.pdb or /var/tmp/from_scwrl_242476011_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_242476011_a.pdb or decoys//var/tmp/from_scwrl_242476011_a.pdb.gz for input Trying /var/tmp/from_scwrl_242476011_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_242476011_a.pdb or /var/tmp/from_scwrl_242476011_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_242476011.pdb or /var/tmp/from_scwrl_242476011_b.pdb or /var/tmp/from_scwrl_242476011_a.pdb Error: no new SCWRL conformation added # 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 345 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_2084818722.pdb -s /var/tmp/to_scwrl_2084818722.seq -o /var/tmp/from_scwrl_2084818722.pdb > /var/tmp/scwrl_2084818722.log sh: /var/tmp/scwrl_2084818722.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_2084818722.pdb or /var/tmp/from_scwrl_2084818722.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2084818722_b.pdb or decoys//var/tmp/from_scwrl_2084818722_b.pdb.gz for input Trying /var/tmp/from_scwrl_2084818722_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_2084818722_b.pdb or /var/tmp/from_scwrl_2084818722_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2084818722_a.pdb or decoys//var/tmp/from_scwrl_2084818722_a.pdb.gz for input Trying /var/tmp/from_scwrl_2084818722_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_2084818722_a.pdb or /var/tmp/from_scwrl_2084818722_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_2084818722.pdb or /var/tmp/from_scwrl_2084818722_b.pdb or /var/tmp/from_scwrl_2084818722_a.pdb Error: no new SCWRL conformation added # 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 370 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_559655134.pdb -s /var/tmp/to_scwrl_559655134.seq -o /var/tmp/from_scwrl_559655134.pdb > /var/tmp/scwrl_559655134.log sh: /var/tmp/scwrl_559655134.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_559655134.pdb or /var/tmp/from_scwrl_559655134.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_559655134_b.pdb or decoys//var/tmp/from_scwrl_559655134_b.pdb.gz for input Trying /var/tmp/from_scwrl_559655134_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_559655134_b.pdb or /var/tmp/from_scwrl_559655134_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_559655134_a.pdb or decoys//var/tmp/from_scwrl_559655134_a.pdb.gz for input Trying /var/tmp/from_scwrl_559655134_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_559655134_a.pdb or /var/tmp/from_scwrl_559655134_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_559655134.pdb or /var/tmp/from_scwrl_559655134_b.pdb or /var/tmp/from_scwrl_559655134_a.pdb Error: no new SCWRL conformation added # 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 288 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1310739283.pdb -s /var/tmp/to_scwrl_1310739283.seq -o /var/tmp/from_scwrl_1310739283.pdb > /var/tmp/scwrl_1310739283.log sh: /var/tmp/scwrl_1310739283.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1310739283.pdb or /var/tmp/from_scwrl_1310739283.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1310739283_b.pdb or decoys//var/tmp/from_scwrl_1310739283_b.pdb.gz for input Trying /var/tmp/from_scwrl_1310739283_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1310739283_b.pdb or /var/tmp/from_scwrl_1310739283_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1310739283_a.pdb or decoys//var/tmp/from_scwrl_1310739283_a.pdb.gz for input Trying /var/tmp/from_scwrl_1310739283_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1310739283_a.pdb or /var/tmp/from_scwrl_1310739283_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1310739283.pdb or /var/tmp/from_scwrl_1310739283_b.pdb or /var/tmp/from_scwrl_1310739283_a.pdb Error: no new SCWRL conformation added # 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 328 # copying to AlignedFragments data structure # naming current conformation 3Dpro_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_232433674.pdb -s /var/tmp/to_scwrl_232433674.seq -o /var/tmp/from_scwrl_232433674.pdb > /var/tmp/scwrl_232433674.log sh: /var/tmp/scwrl_232433674.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_232433674.pdb or /var/tmp/from_scwrl_232433674.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_232433674_b.pdb or decoys//var/tmp/from_scwrl_232433674_b.pdb.gz for input Trying /var/tmp/from_scwrl_232433674_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_232433674_b.pdb or /var/tmp/from_scwrl_232433674_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_232433674_a.pdb or decoys//var/tmp/from_scwrl_232433674_a.pdb.gz for input Trying /var/tmp/from_scwrl_232433674_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_232433674_a.pdb or /var/tmp/from_scwrl_232433674_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_232433674.pdb or /var/tmp/from_scwrl_232433674_b.pdb or /var/tmp/from_scwrl_232433674_a.pdb Error: no new SCWRL conformation added # 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 369 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_506148930.pdb -s /var/tmp/to_scwrl_506148930.seq -o /var/tmp/from_scwrl_506148930.pdb > /var/tmp/scwrl_506148930.log sh: /var/tmp/scwrl_506148930.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_506148930.pdb or /var/tmp/from_scwrl_506148930.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_506148930_b.pdb or decoys//var/tmp/from_scwrl_506148930_b.pdb.gz for input Trying /var/tmp/from_scwrl_506148930_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_506148930_b.pdb or /var/tmp/from_scwrl_506148930_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_506148930_a.pdb or decoys//var/tmp/from_scwrl_506148930_a.pdb.gz for input Trying /var/tmp/from_scwrl_506148930_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_506148930_a.pdb or /var/tmp/from_scwrl_506148930_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_506148930.pdb or /var/tmp/from_scwrl_506148930_b.pdb or /var/tmp/from_scwrl_506148930_a.pdb Error: no new SCWRL conformation added # 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 359 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1789658560.pdb -s /var/tmp/to_scwrl_1789658560.seq -o /var/tmp/from_scwrl_1789658560.pdb > /var/tmp/scwrl_1789658560.log sh: /var/tmp/scwrl_1789658560.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1789658560.pdb or /var/tmp/from_scwrl_1789658560.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1789658560_b.pdb or decoys//var/tmp/from_scwrl_1789658560_b.pdb.gz for input Trying /var/tmp/from_scwrl_1789658560_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1789658560_b.pdb or /var/tmp/from_scwrl_1789658560_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1789658560_a.pdb or decoys//var/tmp/from_scwrl_1789658560_a.pdb.gz for input Trying /var/tmp/from_scwrl_1789658560_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1789658560_a.pdb or /var/tmp/from_scwrl_1789658560_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1789658560.pdb or /var/tmp/from_scwrl_1789658560_b.pdb or /var/tmp/from_scwrl_1789658560_a.pdb Error: no new SCWRL conformation added # 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 369 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1263980860.pdb -s /var/tmp/to_scwrl_1263980860.seq -o /var/tmp/from_scwrl_1263980860.pdb > /var/tmp/scwrl_1263980860.log sh: /var/tmp/scwrl_1263980860.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1263980860.pdb or /var/tmp/from_scwrl_1263980860.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1263980860_b.pdb or decoys//var/tmp/from_scwrl_1263980860_b.pdb.gz for input Trying /var/tmp/from_scwrl_1263980860_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1263980860_b.pdb or /var/tmp/from_scwrl_1263980860_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1263980860_a.pdb or decoys//var/tmp/from_scwrl_1263980860_a.pdb.gz for input Trying /var/tmp/from_scwrl_1263980860_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1263980860_a.pdb or /var/tmp/from_scwrl_1263980860_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1263980860.pdb or /var/tmp/from_scwrl_1263980860_b.pdb or /var/tmp/from_scwrl_1263980860_a.pdb Error: no new SCWRL conformation added # 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 369 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1229050746.pdb -s /var/tmp/to_scwrl_1229050746.seq -o /var/tmp/from_scwrl_1229050746.pdb > /var/tmp/scwrl_1229050746.log sh: /var/tmp/scwrl_1229050746.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1229050746.pdb or /var/tmp/from_scwrl_1229050746.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1229050746_b.pdb or decoys//var/tmp/from_scwrl_1229050746_b.pdb.gz for input Trying /var/tmp/from_scwrl_1229050746_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1229050746_b.pdb or /var/tmp/from_scwrl_1229050746_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1229050746_a.pdb or decoys//var/tmp/from_scwrl_1229050746_a.pdb.gz for input Trying /var/tmp/from_scwrl_1229050746_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1229050746_a.pdb or /var/tmp/from_scwrl_1229050746_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1229050746.pdb or /var/tmp/from_scwrl_1229050746_b.pdb or /var/tmp/from_scwrl_1229050746_a.pdb Error: no new SCWRL conformation added # 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 345 # copying to AlignedFragments data structure # naming current conformation ABIpro_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1461934278.pdb -s /var/tmp/to_scwrl_1461934278.seq -o /var/tmp/from_scwrl_1461934278.pdb > /var/tmp/scwrl_1461934278.log sh: /var/tmp/scwrl_1461934278.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1461934278.pdb or /var/tmp/from_scwrl_1461934278.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1461934278_b.pdb or decoys//var/tmp/from_scwrl_1461934278_b.pdb.gz for input Trying /var/tmp/from_scwrl_1461934278_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1461934278_b.pdb or /var/tmp/from_scwrl_1461934278_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1461934278_a.pdb or decoys//var/tmp/from_scwrl_1461934278_a.pdb.gz for input Trying /var/tmp/from_scwrl_1461934278_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1461934278_a.pdb or /var/tmp/from_scwrl_1461934278_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1461934278.pdb or /var/tmp/from_scwrl_1461934278_b.pdb or /var/tmp/from_scwrl_1461934278_a.pdb Error: no new SCWRL conformation added # 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 266 # copying to AlignedFragments data structure # naming current conformation BayesHH_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1839619972.pdb -s /var/tmp/to_scwrl_1839619972.seq -o /var/tmp/from_scwrl_1839619972.pdb > /var/tmp/scwrl_1839619972.log sh: /var/tmp/scwrl_1839619972.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1839619972.pdb or /var/tmp/from_scwrl_1839619972.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1839619972_b.pdb or decoys//var/tmp/from_scwrl_1839619972_b.pdb.gz for input Trying /var/tmp/from_scwrl_1839619972_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1839619972_b.pdb or /var/tmp/from_scwrl_1839619972_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1839619972_a.pdb or decoys//var/tmp/from_scwrl_1839619972_a.pdb.gz for input Trying /var/tmp/from_scwrl_1839619972_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1839619972_a.pdb or /var/tmp/from_scwrl_1839619972_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1839619972.pdb or /var/tmp/from_scwrl_1839619972_b.pdb or /var/tmp/from_scwrl_1839619972_a.pdb Error: no new SCWRL conformation added # 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 346 # copying to AlignedFragments data structure # naming current conformation Bilab-ENABLE_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_2044476672.pdb -s /var/tmp/to_scwrl_2044476672.seq -o /var/tmp/from_scwrl_2044476672.pdb > /var/tmp/scwrl_2044476672.log sh: /var/tmp/scwrl_2044476672.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_2044476672.pdb or /var/tmp/from_scwrl_2044476672.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2044476672_b.pdb or decoys//var/tmp/from_scwrl_2044476672_b.pdb.gz for input Trying /var/tmp/from_scwrl_2044476672_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_2044476672_b.pdb or /var/tmp/from_scwrl_2044476672_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2044476672_a.pdb or decoys//var/tmp/from_scwrl_2044476672_a.pdb.gz for input Trying /var/tmp/from_scwrl_2044476672_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_2044476672_a.pdb or /var/tmp/from_scwrl_2044476672_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_2044476672.pdb or /var/tmp/from_scwrl_2044476672_b.pdb or /var/tmp/from_scwrl_2044476672_a.pdb Error: no new SCWRL conformation added # 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 354 # copying to AlignedFragments data structure # naming current conformation Bilab-ENABLE_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1948631024.pdb -s /var/tmp/to_scwrl_1948631024.seq -o /var/tmp/from_scwrl_1948631024.pdb > /var/tmp/scwrl_1948631024.log sh: /var/tmp/scwrl_1948631024.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1948631024.pdb or /var/tmp/from_scwrl_1948631024.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1948631024_b.pdb or decoys//var/tmp/from_scwrl_1948631024_b.pdb.gz for input Trying /var/tmp/from_scwrl_1948631024_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1948631024_b.pdb or /var/tmp/from_scwrl_1948631024_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1948631024_a.pdb or decoys//var/tmp/from_scwrl_1948631024_a.pdb.gz for input Trying /var/tmp/from_scwrl_1948631024_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1948631024_a.pdb or /var/tmp/from_scwrl_1948631024_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1948631024.pdb or /var/tmp/from_scwrl_1948631024_b.pdb or /var/tmp/from_scwrl_1948631024_a.pdb Error: no new SCWRL conformation added # 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 317 # copying to AlignedFragments data structure # naming current conformation Bilab-ENABLE_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1689920274.pdb -s /var/tmp/to_scwrl_1689920274.seq -o /var/tmp/from_scwrl_1689920274.pdb > /var/tmp/scwrl_1689920274.log sh: /var/tmp/scwrl_1689920274.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1689920274.pdb or /var/tmp/from_scwrl_1689920274.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1689920274_b.pdb or decoys//var/tmp/from_scwrl_1689920274_b.pdb.gz for input Trying /var/tmp/from_scwrl_1689920274_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1689920274_b.pdb or /var/tmp/from_scwrl_1689920274_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1689920274_a.pdb or decoys//var/tmp/from_scwrl_1689920274_a.pdb.gz for input Trying /var/tmp/from_scwrl_1689920274_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1689920274_a.pdb or /var/tmp/from_scwrl_1689920274_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1689920274.pdb or /var/tmp/from_scwrl_1689920274_b.pdb or /var/tmp/from_scwrl_1689920274_a.pdb Error: no new SCWRL conformation added # naming current conformation Bilab-ENABLE_TS3-scwrl # ReadConformPDB reading from PDB file servers/CIRCLE_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation CIRCLE_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_729545479.pdb -s /var/tmp/to_scwrl_729545479.seq -o /var/tmp/from_scwrl_729545479.pdb > /var/tmp/scwrl_729545479.log sh: /var/tmp/scwrl_729545479.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_729545479.pdb or /var/tmp/from_scwrl_729545479.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_729545479_b.pdb or decoys//var/tmp/from_scwrl_729545479_b.pdb.gz for input Trying /var/tmp/from_scwrl_729545479_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_729545479_b.pdb or /var/tmp/from_scwrl_729545479_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_729545479_a.pdb or decoys//var/tmp/from_scwrl_729545479_a.pdb.gz for input Trying /var/tmp/from_scwrl_729545479_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_729545479_a.pdb or /var/tmp/from_scwrl_729545479_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_729545479.pdb or /var/tmp/from_scwrl_729545479_b.pdb or /var/tmp/from_scwrl_729545479_a.pdb Error: no new SCWRL conformation added # naming current conformation CIRCLE_TS1-scwrl # ReadConformPDB reading from PDB file servers/CIRCLE_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation CIRCLE_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_199313230.pdb -s /var/tmp/to_scwrl_199313230.seq -o /var/tmp/from_scwrl_199313230.pdb > /var/tmp/scwrl_199313230.log sh: /var/tmp/scwrl_199313230.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_199313230.pdb or /var/tmp/from_scwrl_199313230.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_199313230_b.pdb or decoys//var/tmp/from_scwrl_199313230_b.pdb.gz for input Trying /var/tmp/from_scwrl_199313230_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_199313230_b.pdb or /var/tmp/from_scwrl_199313230_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_199313230_a.pdb or decoys//var/tmp/from_scwrl_199313230_a.pdb.gz for input Trying /var/tmp/from_scwrl_199313230_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_199313230_a.pdb or /var/tmp/from_scwrl_199313230_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_199313230.pdb or /var/tmp/from_scwrl_199313230_b.pdb or /var/tmp/from_scwrl_199313230_a.pdb Error: no new SCWRL conformation added # naming current conformation CIRCLE_TS2-scwrl # ReadConformPDB reading from PDB file servers/CIRCLE_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation CIRCLE_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1288287613.pdb -s /var/tmp/to_scwrl_1288287613.seq -o /var/tmp/from_scwrl_1288287613.pdb > /var/tmp/scwrl_1288287613.log sh: /var/tmp/scwrl_1288287613.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1288287613.pdb or /var/tmp/from_scwrl_1288287613.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1288287613_b.pdb or decoys//var/tmp/from_scwrl_1288287613_b.pdb.gz for input Trying /var/tmp/from_scwrl_1288287613_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1288287613_b.pdb or /var/tmp/from_scwrl_1288287613_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1288287613_a.pdb or decoys//var/tmp/from_scwrl_1288287613_a.pdb.gz for input Trying /var/tmp/from_scwrl_1288287613_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1288287613_a.pdb or /var/tmp/from_scwrl_1288287613_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1288287613.pdb or /var/tmp/from_scwrl_1288287613_b.pdb or /var/tmp/from_scwrl_1288287613_a.pdb Error: no new SCWRL conformation added # naming current conformation CIRCLE_TS3-scwrl # ReadConformPDB reading from PDB file servers/CIRCLE_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation CIRCLE_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1637594526.pdb -s /var/tmp/to_scwrl_1637594526.seq -o /var/tmp/from_scwrl_1637594526.pdb > /var/tmp/scwrl_1637594526.log sh: /var/tmp/scwrl_1637594526.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1637594526.pdb or /var/tmp/from_scwrl_1637594526.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1637594526_b.pdb or decoys//var/tmp/from_scwrl_1637594526_b.pdb.gz for input Trying /var/tmp/from_scwrl_1637594526_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1637594526_b.pdb or /var/tmp/from_scwrl_1637594526_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1637594526_a.pdb or decoys//var/tmp/from_scwrl_1637594526_a.pdb.gz for input Trying /var/tmp/from_scwrl_1637594526_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1637594526_a.pdb or /var/tmp/from_scwrl_1637594526_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1637594526.pdb or /var/tmp/from_scwrl_1637594526_b.pdb or /var/tmp/from_scwrl_1637594526_a.pdb Error: no new SCWRL conformation added # naming current conformation CIRCLE_TS4-scwrl # ReadConformPDB reading from PDB file servers/CIRCLE_TS5.pdb.gz looking for model 1 # Found a chain break before 370 # copying to AlignedFragments data structure # naming current conformation CIRCLE_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1677910755.pdb -s /var/tmp/to_scwrl_1677910755.seq -o /var/tmp/from_scwrl_1677910755.pdb > /var/tmp/scwrl_1677910755.log sh: /var/tmp/scwrl_1677910755.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1677910755.pdb or /var/tmp/from_scwrl_1677910755.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1677910755_b.pdb or decoys//var/tmp/from_scwrl_1677910755_b.pdb.gz for input Trying /var/tmp/from_scwrl_1677910755_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1677910755_b.pdb or /var/tmp/from_scwrl_1677910755_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1677910755_a.pdb or decoys//var/tmp/from_scwrl_1677910755_a.pdb.gz for input Trying /var/tmp/from_scwrl_1677910755_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1677910755_a.pdb or /var/tmp/from_scwrl_1677910755_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1677910755.pdb or /var/tmp/from_scwrl_1677910755_b.pdb or /var/tmp/from_scwrl_1677910755_a.pdb Error: no new SCWRL conformation added # naming current conformation CIRCLE_TS5-scwrl # ReadConformPDB reading from PDB file servers/CPHmodels_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation CPHmodels_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_901606292.pdb -s /var/tmp/to_scwrl_901606292.seq -o /var/tmp/from_scwrl_901606292.pdb > /var/tmp/scwrl_901606292.log sh: /var/tmp/scwrl_901606292.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_901606292.pdb or /var/tmp/from_scwrl_901606292.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_901606292_b.pdb or decoys//var/tmp/from_scwrl_901606292_b.pdb.gz for input Trying /var/tmp/from_scwrl_901606292_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_901606292_b.pdb or /var/tmp/from_scwrl_901606292_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_901606292_a.pdb or decoys//var/tmp/from_scwrl_901606292_a.pdb.gz for input Trying /var/tmp/from_scwrl_901606292_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_901606292_a.pdb or /var/tmp/from_scwrl_901606292_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_901606292.pdb or /var/tmp/from_scwrl_901606292_b.pdb or /var/tmp/from_scwrl_901606292_a.pdb Error: no new SCWRL conformation added # naming current conformation CPHmodels_TS1-scwrl # ReadConformPDB reading from PDB file servers/CaspIta-FOX_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation CaspIta-FOX_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1984851846.pdb -s /var/tmp/to_scwrl_1984851846.seq -o /var/tmp/from_scwrl_1984851846.pdb > /var/tmp/scwrl_1984851846.log sh: /var/tmp/scwrl_1984851846.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1984851846.pdb or /var/tmp/from_scwrl_1984851846.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1984851846_b.pdb or decoys//var/tmp/from_scwrl_1984851846_b.pdb.gz for input Trying /var/tmp/from_scwrl_1984851846_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1984851846_b.pdb or /var/tmp/from_scwrl_1984851846_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1984851846_a.pdb or decoys//var/tmp/from_scwrl_1984851846_a.pdb.gz for input Trying /var/tmp/from_scwrl_1984851846_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1984851846_a.pdb or /var/tmp/from_scwrl_1984851846_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1984851846.pdb or /var/tmp/from_scwrl_1984851846_b.pdb or /var/tmp/from_scwrl_1984851846_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation CaspIta-FOX_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_2078836740.pdb -s /var/tmp/to_scwrl_2078836740.seq -o /var/tmp/from_scwrl_2078836740.pdb > /var/tmp/scwrl_2078836740.log sh: /var/tmp/scwrl_2078836740.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_2078836740.pdb or /var/tmp/from_scwrl_2078836740.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2078836740_b.pdb or decoys//var/tmp/from_scwrl_2078836740_b.pdb.gz for input Trying /var/tmp/from_scwrl_2078836740_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_2078836740_b.pdb or /var/tmp/from_scwrl_2078836740_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2078836740_a.pdb or decoys//var/tmp/from_scwrl_2078836740_a.pdb.gz for input Trying /var/tmp/from_scwrl_2078836740_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_2078836740_a.pdb or /var/tmp/from_scwrl_2078836740_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_2078836740.pdb or /var/tmp/from_scwrl_2078836740_b.pdb or /var/tmp/from_scwrl_2078836740_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation CaspIta-FOX_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_379092540.pdb -s /var/tmp/to_scwrl_379092540.seq -o /var/tmp/from_scwrl_379092540.pdb > /var/tmp/scwrl_379092540.log sh: /var/tmp/scwrl_379092540.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_379092540.pdb or /var/tmp/from_scwrl_379092540.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_379092540_b.pdb or decoys//var/tmp/from_scwrl_379092540_b.pdb.gz for input Trying /var/tmp/from_scwrl_379092540_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_379092540_b.pdb or /var/tmp/from_scwrl_379092540_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_379092540_a.pdb or decoys//var/tmp/from_scwrl_379092540_a.pdb.gz for input Trying /var/tmp/from_scwrl_379092540_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_379092540_a.pdb or /var/tmp/from_scwrl_379092540_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_379092540.pdb or /var/tmp/from_scwrl_379092540_b.pdb or /var/tmp/from_scwrl_379092540_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation CaspIta-FOX_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_38947132.pdb -s /var/tmp/to_scwrl_38947132.seq -o /var/tmp/from_scwrl_38947132.pdb > /var/tmp/scwrl_38947132.log sh: /var/tmp/scwrl_38947132.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_38947132.pdb or /var/tmp/from_scwrl_38947132.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_38947132_b.pdb or decoys//var/tmp/from_scwrl_38947132_b.pdb.gz for input Trying /var/tmp/from_scwrl_38947132_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_38947132_b.pdb or /var/tmp/from_scwrl_38947132_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_38947132_a.pdb or decoys//var/tmp/from_scwrl_38947132_a.pdb.gz for input Trying /var/tmp/from_scwrl_38947132_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_38947132_a.pdb or /var/tmp/from_scwrl_38947132_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_38947132.pdb or /var/tmp/from_scwrl_38947132_b.pdb or /var/tmp/from_scwrl_38947132_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation CaspIta-FOX_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1886541346.pdb -s /var/tmp/to_scwrl_1886541346.seq -o /var/tmp/from_scwrl_1886541346.pdb > /var/tmp/scwrl_1886541346.log sh: /var/tmp/scwrl_1886541346.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1886541346.pdb or /var/tmp/from_scwrl_1886541346.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1886541346_b.pdb or decoys//var/tmp/from_scwrl_1886541346_b.pdb.gz for input Trying /var/tmp/from_scwrl_1886541346_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1886541346_b.pdb or /var/tmp/from_scwrl_1886541346_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1886541346_a.pdb or decoys//var/tmp/from_scwrl_1886541346_a.pdb.gz for input Trying /var/tmp/from_scwrl_1886541346_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1886541346_a.pdb or /var/tmp/from_scwrl_1886541346_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1886541346.pdb or /var/tmp/from_scwrl_1886541346_b.pdb or /var/tmp/from_scwrl_1886541346_a.pdb Error: no new SCWRL conformation added # naming current conformation CaspIta-FOX_TS5-scwrl # ReadConformPDB reading from PDB file servers/Distill_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation Distill_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1015049907.pdb -s /var/tmp/to_scwrl_1015049907.seq -o /var/tmp/from_scwrl_1015049907.pdb > /var/tmp/scwrl_1015049907.log sh: /var/tmp/scwrl_1015049907.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1015049907.pdb or /var/tmp/from_scwrl_1015049907.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1015049907_b.pdb or decoys//var/tmp/from_scwrl_1015049907_b.pdb.gz for input Trying /var/tmp/from_scwrl_1015049907_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1015049907_b.pdb or /var/tmp/from_scwrl_1015049907_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1015049907_a.pdb or decoys//var/tmp/from_scwrl_1015049907_a.pdb.gz for input Trying /var/tmp/from_scwrl_1015049907_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1015049907_a.pdb or /var/tmp/from_scwrl_1015049907_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1015049907.pdb or /var/tmp/from_scwrl_1015049907_b.pdb or /var/tmp/from_scwrl_1015049907_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 T0316 can't currently be optimized by undertaker # naming current conformation Distill_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_278154519.pdb -s /var/tmp/to_scwrl_278154519.seq -o /var/tmp/from_scwrl_278154519.pdb > /var/tmp/scwrl_278154519.log sh: /var/tmp/scwrl_278154519.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_278154519.pdb or /var/tmp/from_scwrl_278154519.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_278154519_b.pdb or decoys//var/tmp/from_scwrl_278154519_b.pdb.gz for input Trying /var/tmp/from_scwrl_278154519_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_278154519_b.pdb or /var/tmp/from_scwrl_278154519_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_278154519_a.pdb or decoys//var/tmp/from_scwrl_278154519_a.pdb.gz for input Trying /var/tmp/from_scwrl_278154519_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_278154519_a.pdb or /var/tmp/from_scwrl_278154519_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_278154519.pdb or /var/tmp/from_scwrl_278154519_b.pdb or /var/tmp/from_scwrl_278154519_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 T0316 can't currently be optimized by undertaker # naming current conformation Distill_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_213300332.pdb -s /var/tmp/to_scwrl_213300332.seq -o /var/tmp/from_scwrl_213300332.pdb > /var/tmp/scwrl_213300332.log sh: /var/tmp/scwrl_213300332.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_213300332.pdb or /var/tmp/from_scwrl_213300332.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_213300332_b.pdb or decoys//var/tmp/from_scwrl_213300332_b.pdb.gz for input Trying /var/tmp/from_scwrl_213300332_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_213300332_b.pdb or /var/tmp/from_scwrl_213300332_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_213300332_a.pdb or decoys//var/tmp/from_scwrl_213300332_a.pdb.gz for input Trying /var/tmp/from_scwrl_213300332_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_213300332_a.pdb or /var/tmp/from_scwrl_213300332_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_213300332.pdb or /var/tmp/from_scwrl_213300332_b.pdb or /var/tmp/from_scwrl_213300332_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 T0316 can't currently be optimized by undertaker # naming current conformation Distill_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1225495752.pdb -s /var/tmp/to_scwrl_1225495752.seq -o /var/tmp/from_scwrl_1225495752.pdb > /var/tmp/scwrl_1225495752.log sh: /var/tmp/scwrl_1225495752.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1225495752.pdb or /var/tmp/from_scwrl_1225495752.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1225495752_b.pdb or decoys//var/tmp/from_scwrl_1225495752_b.pdb.gz for input Trying /var/tmp/from_scwrl_1225495752_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1225495752_b.pdb or /var/tmp/from_scwrl_1225495752_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1225495752_a.pdb or decoys//var/tmp/from_scwrl_1225495752_a.pdb.gz for input Trying /var/tmp/from_scwrl_1225495752_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1225495752_a.pdb or /var/tmp/from_scwrl_1225495752_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1225495752.pdb or /var/tmp/from_scwrl_1225495752_b.pdb or /var/tmp/from_scwrl_1225495752_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 T0316 can't currently be optimized by undertaker # naming current conformation Distill_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1472027435.pdb -s /var/tmp/to_scwrl_1472027435.seq -o /var/tmp/from_scwrl_1472027435.pdb > /var/tmp/scwrl_1472027435.log sh: /var/tmp/scwrl_1472027435.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1472027435.pdb or /var/tmp/from_scwrl_1472027435.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1472027435_b.pdb or decoys//var/tmp/from_scwrl_1472027435_b.pdb.gz for input Trying /var/tmp/from_scwrl_1472027435_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1472027435_b.pdb or /var/tmp/from_scwrl_1472027435_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1472027435_a.pdb or decoys//var/tmp/from_scwrl_1472027435_a.pdb.gz for input Trying /var/tmp/from_scwrl_1472027435_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1472027435_a.pdb or /var/tmp/from_scwrl_1472027435_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1472027435.pdb or /var/tmp/from_scwrl_1472027435_b.pdb or /var/tmp/from_scwrl_1472027435_a.pdb Error: no new SCWRL conformation added # naming current conformation Distill_TS5-scwrl # ReadConformPDB reading from PDB file servers/FAMSD_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation FAMSD_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1333436220.pdb -s /var/tmp/to_scwrl_1333436220.seq -o /var/tmp/from_scwrl_1333436220.pdb > /var/tmp/scwrl_1333436220.log sh: /var/tmp/scwrl_1333436220.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1333436220.pdb or /var/tmp/from_scwrl_1333436220.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1333436220_b.pdb or decoys//var/tmp/from_scwrl_1333436220_b.pdb.gz for input Trying /var/tmp/from_scwrl_1333436220_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1333436220_b.pdb or /var/tmp/from_scwrl_1333436220_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1333436220_a.pdb or decoys//var/tmp/from_scwrl_1333436220_a.pdb.gz for input Trying /var/tmp/from_scwrl_1333436220_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1333436220_a.pdb or /var/tmp/from_scwrl_1333436220_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1333436220.pdb or /var/tmp/from_scwrl_1333436220_b.pdb or /var/tmp/from_scwrl_1333436220_a.pdb Error: no new SCWRL conformation added # naming current conformation FAMSD_TS1-scwrl # ReadConformPDB reading from PDB file servers/FAMSD_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation FAMSD_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1467971763.pdb -s /var/tmp/to_scwrl_1467971763.seq -o /var/tmp/from_scwrl_1467971763.pdb > /var/tmp/scwrl_1467971763.log sh: /var/tmp/scwrl_1467971763.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1467971763.pdb or /var/tmp/from_scwrl_1467971763.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1467971763_b.pdb or decoys//var/tmp/from_scwrl_1467971763_b.pdb.gz for input Trying /var/tmp/from_scwrl_1467971763_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1467971763_b.pdb or /var/tmp/from_scwrl_1467971763_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1467971763_a.pdb or decoys//var/tmp/from_scwrl_1467971763_a.pdb.gz for input Trying /var/tmp/from_scwrl_1467971763_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1467971763_a.pdb or /var/tmp/from_scwrl_1467971763_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1467971763.pdb or /var/tmp/from_scwrl_1467971763_b.pdb or /var/tmp/from_scwrl_1467971763_a.pdb Error: no new SCWRL conformation added # naming current conformation FAMSD_TS2-scwrl # ReadConformPDB reading from PDB file servers/FAMSD_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation FAMSD_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1409362510.pdb -s /var/tmp/to_scwrl_1409362510.seq -o /var/tmp/from_scwrl_1409362510.pdb > /var/tmp/scwrl_1409362510.log sh: /var/tmp/scwrl_1409362510.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1409362510.pdb or /var/tmp/from_scwrl_1409362510.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1409362510_b.pdb or decoys//var/tmp/from_scwrl_1409362510_b.pdb.gz for input Trying /var/tmp/from_scwrl_1409362510_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1409362510_b.pdb or /var/tmp/from_scwrl_1409362510_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1409362510_a.pdb or decoys//var/tmp/from_scwrl_1409362510_a.pdb.gz for input Trying /var/tmp/from_scwrl_1409362510_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1409362510_a.pdb or /var/tmp/from_scwrl_1409362510_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1409362510.pdb or /var/tmp/from_scwrl_1409362510_b.pdb or /var/tmp/from_scwrl_1409362510_a.pdb Error: no new SCWRL conformation added # naming current conformation FAMSD_TS3-scwrl # ReadConformPDB reading from PDB file servers/FAMSD_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation FAMSD_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1893091354.pdb -s /var/tmp/to_scwrl_1893091354.seq -o /var/tmp/from_scwrl_1893091354.pdb > /var/tmp/scwrl_1893091354.log sh: /var/tmp/scwrl_1893091354.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1893091354.pdb or /var/tmp/from_scwrl_1893091354.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1893091354_b.pdb or decoys//var/tmp/from_scwrl_1893091354_b.pdb.gz for input Trying /var/tmp/from_scwrl_1893091354_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1893091354_b.pdb or /var/tmp/from_scwrl_1893091354_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1893091354_a.pdb or decoys//var/tmp/from_scwrl_1893091354_a.pdb.gz for input Trying /var/tmp/from_scwrl_1893091354_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1893091354_a.pdb or /var/tmp/from_scwrl_1893091354_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1893091354.pdb or /var/tmp/from_scwrl_1893091354_b.pdb or /var/tmp/from_scwrl_1893091354_a.pdb Error: no new SCWRL conformation added # naming current conformation FAMSD_TS4-scwrl # ReadConformPDB reading from PDB file servers/FAMSD_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation FAMSD_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_631227400.pdb -s /var/tmp/to_scwrl_631227400.seq -o /var/tmp/from_scwrl_631227400.pdb > /var/tmp/scwrl_631227400.log sh: /var/tmp/scwrl_631227400.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_631227400.pdb or /var/tmp/from_scwrl_631227400.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_631227400_b.pdb or decoys//var/tmp/from_scwrl_631227400_b.pdb.gz for input Trying /var/tmp/from_scwrl_631227400_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_631227400_b.pdb or /var/tmp/from_scwrl_631227400_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_631227400_a.pdb or decoys//var/tmp/from_scwrl_631227400_a.pdb.gz for input Trying /var/tmp/from_scwrl_631227400_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_631227400_a.pdb or /var/tmp/from_scwrl_631227400_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_631227400.pdb or /var/tmp/from_scwrl_631227400_b.pdb or /var/tmp/from_scwrl_631227400_a.pdb Error: no new SCWRL conformation added # naming current conformation FAMSD_TS5-scwrl # ReadConformPDB reading from PDB file servers/FAMS_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation FAMS_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1641796185.pdb -s /var/tmp/to_scwrl_1641796185.seq -o /var/tmp/from_scwrl_1641796185.pdb > /var/tmp/scwrl_1641796185.log sh: /var/tmp/scwrl_1641796185.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1641796185.pdb or /var/tmp/from_scwrl_1641796185.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1641796185_b.pdb or decoys//var/tmp/from_scwrl_1641796185_b.pdb.gz for input Trying /var/tmp/from_scwrl_1641796185_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1641796185_b.pdb or /var/tmp/from_scwrl_1641796185_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1641796185_a.pdb or decoys//var/tmp/from_scwrl_1641796185_a.pdb.gz for input Trying /var/tmp/from_scwrl_1641796185_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1641796185_a.pdb or /var/tmp/from_scwrl_1641796185_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1641796185.pdb or /var/tmp/from_scwrl_1641796185_b.pdb or /var/tmp/from_scwrl_1641796185_a.pdb Error: no new SCWRL conformation added # naming current conformation FAMS_TS1-scwrl # ReadConformPDB reading from PDB file servers/FAMS_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation FAMS_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_251756638.pdb -s /var/tmp/to_scwrl_251756638.seq -o /var/tmp/from_scwrl_251756638.pdb > /var/tmp/scwrl_251756638.log sh: /var/tmp/scwrl_251756638.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_251756638.pdb or /var/tmp/from_scwrl_251756638.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_251756638_b.pdb or decoys//var/tmp/from_scwrl_251756638_b.pdb.gz for input Trying /var/tmp/from_scwrl_251756638_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_251756638_b.pdb or /var/tmp/from_scwrl_251756638_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_251756638_a.pdb or decoys//var/tmp/from_scwrl_251756638_a.pdb.gz for input Trying /var/tmp/from_scwrl_251756638_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_251756638_a.pdb or /var/tmp/from_scwrl_251756638_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_251756638.pdb or /var/tmp/from_scwrl_251756638_b.pdb or /var/tmp/from_scwrl_251756638_a.pdb Error: no new SCWRL conformation added # naming current conformation FAMS_TS2-scwrl # ReadConformPDB reading from PDB file servers/FAMS_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation FAMS_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_273402313.pdb -s /var/tmp/to_scwrl_273402313.seq -o /var/tmp/from_scwrl_273402313.pdb > /var/tmp/scwrl_273402313.log sh: /var/tmp/scwrl_273402313.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_273402313.pdb or /var/tmp/from_scwrl_273402313.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_273402313_b.pdb or decoys//var/tmp/from_scwrl_273402313_b.pdb.gz for input Trying /var/tmp/from_scwrl_273402313_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_273402313_b.pdb or /var/tmp/from_scwrl_273402313_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_273402313_a.pdb or decoys//var/tmp/from_scwrl_273402313_a.pdb.gz for input Trying /var/tmp/from_scwrl_273402313_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_273402313_a.pdb or /var/tmp/from_scwrl_273402313_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_273402313.pdb or /var/tmp/from_scwrl_273402313_b.pdb or /var/tmp/from_scwrl_273402313_a.pdb Error: no new SCWRL conformation added # naming current conformation FAMS_TS3-scwrl # ReadConformPDB reading from PDB file servers/FAMS_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation FAMS_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_758293399.pdb -s /var/tmp/to_scwrl_758293399.seq -o /var/tmp/from_scwrl_758293399.pdb > /var/tmp/scwrl_758293399.log sh: /var/tmp/scwrl_758293399.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_758293399.pdb or /var/tmp/from_scwrl_758293399.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_758293399_b.pdb or decoys//var/tmp/from_scwrl_758293399_b.pdb.gz for input Trying /var/tmp/from_scwrl_758293399_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_758293399_b.pdb or /var/tmp/from_scwrl_758293399_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_758293399_a.pdb or decoys//var/tmp/from_scwrl_758293399_a.pdb.gz for input Trying /var/tmp/from_scwrl_758293399_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_758293399_a.pdb or /var/tmp/from_scwrl_758293399_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_758293399.pdb or /var/tmp/from_scwrl_758293399_b.pdb or /var/tmp/from_scwrl_758293399_a.pdb Error: no new SCWRL conformation added # naming current conformation FAMS_TS4-scwrl # ReadConformPDB reading from PDB file servers/FAMS_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation FAMS_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1480807384.pdb -s /var/tmp/to_scwrl_1480807384.seq -o /var/tmp/from_scwrl_1480807384.pdb > /var/tmp/scwrl_1480807384.log sh: /var/tmp/scwrl_1480807384.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1480807384.pdb or /var/tmp/from_scwrl_1480807384.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1480807384_b.pdb or decoys//var/tmp/from_scwrl_1480807384_b.pdb.gz for input Trying /var/tmp/from_scwrl_1480807384_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1480807384_b.pdb or /var/tmp/from_scwrl_1480807384_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1480807384_a.pdb or decoys//var/tmp/from_scwrl_1480807384_a.pdb.gz for input Trying /var/tmp/from_scwrl_1480807384_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1480807384_a.pdb or /var/tmp/from_scwrl_1480807384_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1480807384.pdb or /var/tmp/from_scwrl_1480807384_b.pdb or /var/tmp/from_scwrl_1480807384_a.pdb Error: no new SCWRL conformation added # 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 370 # copying to AlignedFragments data structure # naming current conformation FOLDpro_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1735336591.pdb -s /var/tmp/to_scwrl_1735336591.seq -o /var/tmp/from_scwrl_1735336591.pdb > /var/tmp/scwrl_1735336591.log sh: /var/tmp/scwrl_1735336591.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1735336591.pdb or /var/tmp/from_scwrl_1735336591.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1735336591_b.pdb or decoys//var/tmp/from_scwrl_1735336591_b.pdb.gz for input Trying /var/tmp/from_scwrl_1735336591_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1735336591_b.pdb or /var/tmp/from_scwrl_1735336591_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1735336591_a.pdb or decoys//var/tmp/from_scwrl_1735336591_a.pdb.gz for input Trying /var/tmp/from_scwrl_1735336591_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1735336591_a.pdb or /var/tmp/from_scwrl_1735336591_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1735336591.pdb or /var/tmp/from_scwrl_1735336591_b.pdb or /var/tmp/from_scwrl_1735336591_a.pdb Error: no new SCWRL conformation added # 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 334 # copying to AlignedFragments data structure # naming current conformation FOLDpro_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_450429724.pdb -s /var/tmp/to_scwrl_450429724.seq -o /var/tmp/from_scwrl_450429724.pdb > /var/tmp/scwrl_450429724.log sh: /var/tmp/scwrl_450429724.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_450429724.pdb or /var/tmp/from_scwrl_450429724.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_450429724_b.pdb or decoys//var/tmp/from_scwrl_450429724_b.pdb.gz for input Trying /var/tmp/from_scwrl_450429724_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_450429724_b.pdb or /var/tmp/from_scwrl_450429724_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_450429724_a.pdb or decoys//var/tmp/from_scwrl_450429724_a.pdb.gz for input Trying /var/tmp/from_scwrl_450429724_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_450429724_a.pdb or /var/tmp/from_scwrl_450429724_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_450429724.pdb or /var/tmp/from_scwrl_450429724_b.pdb or /var/tmp/from_scwrl_450429724_a.pdb Error: no new SCWRL conformation added # 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 353 # copying to AlignedFragments data structure # naming current conformation FOLDpro_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1377800409.pdb -s /var/tmp/to_scwrl_1377800409.seq -o /var/tmp/from_scwrl_1377800409.pdb > /var/tmp/scwrl_1377800409.log sh: /var/tmp/scwrl_1377800409.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1377800409.pdb or /var/tmp/from_scwrl_1377800409.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1377800409_b.pdb or decoys//var/tmp/from_scwrl_1377800409_b.pdb.gz for input Trying /var/tmp/from_scwrl_1377800409_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1377800409_b.pdb or /var/tmp/from_scwrl_1377800409_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1377800409_a.pdb or decoys//var/tmp/from_scwrl_1377800409_a.pdb.gz for input Trying /var/tmp/from_scwrl_1377800409_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1377800409_a.pdb or /var/tmp/from_scwrl_1377800409_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1377800409.pdb or /var/tmp/from_scwrl_1377800409_b.pdb or /var/tmp/from_scwrl_1377800409_a.pdb Error: no new SCWRL conformation added # 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 301 # copying to AlignedFragments data structure # naming current conformation FOLDpro_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1536483968.pdb -s /var/tmp/to_scwrl_1536483968.seq -o /var/tmp/from_scwrl_1536483968.pdb > /var/tmp/scwrl_1536483968.log sh: /var/tmp/scwrl_1536483968.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1536483968.pdb or /var/tmp/from_scwrl_1536483968.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1536483968_b.pdb or decoys//var/tmp/from_scwrl_1536483968_b.pdb.gz for input Trying /var/tmp/from_scwrl_1536483968_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1536483968_b.pdb or /var/tmp/from_scwrl_1536483968_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1536483968_a.pdb or decoys//var/tmp/from_scwrl_1536483968_a.pdb.gz for input Trying /var/tmp/from_scwrl_1536483968_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1536483968_a.pdb or /var/tmp/from_scwrl_1536483968_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1536483968.pdb or /var/tmp/from_scwrl_1536483968_b.pdb or /var/tmp/from_scwrl_1536483968_a.pdb Error: no new SCWRL conformation added # 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 259 # copying to AlignedFragments data structure # naming current conformation FOLDpro_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_2140349998.pdb -s /var/tmp/to_scwrl_2140349998.seq -o /var/tmp/from_scwrl_2140349998.pdb > /var/tmp/scwrl_2140349998.log sh: /var/tmp/scwrl_2140349998.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_2140349998.pdb or /var/tmp/from_scwrl_2140349998.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2140349998_b.pdb or decoys//var/tmp/from_scwrl_2140349998_b.pdb.gz for input Trying /var/tmp/from_scwrl_2140349998_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_2140349998_b.pdb or /var/tmp/from_scwrl_2140349998_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2140349998_a.pdb or decoys//var/tmp/from_scwrl_2140349998_a.pdb.gz for input Trying /var/tmp/from_scwrl_2140349998_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_2140349998_a.pdb or /var/tmp/from_scwrl_2140349998_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_2140349998.pdb or /var/tmp/from_scwrl_2140349998_b.pdb or /var/tmp/from_scwrl_2140349998_a.pdb Error: no new SCWRL conformation added # naming current conformation FOLDpro_TS5-scwrl # ReadConformPDB reading from PDB file servers/FORTE1_AL1.pdb.gz looking for model 1 Skipped atom 526, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 528, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 530, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 532, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 738, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 740, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 742, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 744, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 754, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 756, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 758, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 760, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 842, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 844, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 846, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 848, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 918, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 920, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 922, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 924, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 1154, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 1156, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 1158, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 1160, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 1230, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 1232, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 1234, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 1236, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 1242, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 1244, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 1246, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 1248, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 1254, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 1256, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 1258, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 1260, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 1342, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 1344, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 1346, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz Skipped atom 1348, because occupancy 1.000 <= existing 1.000 in servers/FORTE1_AL1.pdb.gz # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation FORTE1_AL1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_2107345888.pdb -s /var/tmp/to_scwrl_2107345888.seq -o /var/tmp/from_scwrl_2107345888.pdb > /var/tmp/scwrl_2107345888.log sh: /var/tmp/scwrl_2107345888.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_2107345888.pdb or /var/tmp/from_scwrl_2107345888.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2107345888_b.pdb or decoys//var/tmp/from_scwrl_2107345888_b.pdb.gz for input Trying /var/tmp/from_scwrl_2107345888_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_2107345888_b.pdb or /var/tmp/from_scwrl_2107345888_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2107345888_a.pdb or decoys//var/tmp/from_scwrl_2107345888_a.pdb.gz for input Trying /var/tmp/from_scwrl_2107345888_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_2107345888_a.pdb or /var/tmp/from_scwrl_2107345888_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_2107345888.pdb or /var/tmp/from_scwrl_2107345888_b.pdb or /var/tmp/from_scwrl_2107345888_a.pdb Error: no new SCWRL conformation added # naming current conformation FORTE1_AL1-scwrl # ReadConformPDB reading from PDB file servers/FORTE1_AL2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation FORTE1_AL2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1735797198.pdb -s /var/tmp/to_scwrl_1735797198.seq -o /var/tmp/from_scwrl_1735797198.pdb > /var/tmp/scwrl_1735797198.log sh: /var/tmp/scwrl_1735797198.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1735797198.pdb or /var/tmp/from_scwrl_1735797198.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1735797198_b.pdb or decoys//var/tmp/from_scwrl_1735797198_b.pdb.gz for input Trying /var/tmp/from_scwrl_1735797198_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1735797198_b.pdb or /var/tmp/from_scwrl_1735797198_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1735797198_a.pdb or decoys//var/tmp/from_scwrl_1735797198_a.pdb.gz for input Trying /var/tmp/from_scwrl_1735797198_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1735797198_a.pdb or /var/tmp/from_scwrl_1735797198_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1735797198.pdb or /var/tmp/from_scwrl_1735797198_b.pdb or /var/tmp/from_scwrl_1735797198_a.pdb Error: no new SCWRL conformation added # naming current conformation FORTE1_AL2-scwrl # ReadConformPDB reading from PDB file servers/FORTE1_AL3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation FORTE1_AL3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1281153964.pdb -s /var/tmp/to_scwrl_1281153964.seq -o /var/tmp/from_scwrl_1281153964.pdb > /var/tmp/scwrl_1281153964.log sh: /var/tmp/scwrl_1281153964.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1281153964.pdb or /var/tmp/from_scwrl_1281153964.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1281153964_b.pdb or decoys//var/tmp/from_scwrl_1281153964_b.pdb.gz for input Trying /var/tmp/from_scwrl_1281153964_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1281153964_b.pdb or /var/tmp/from_scwrl_1281153964_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1281153964_a.pdb or decoys//var/tmp/from_scwrl_1281153964_a.pdb.gz for input Trying /var/tmp/from_scwrl_1281153964_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1281153964_a.pdb or /var/tmp/from_scwrl_1281153964_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1281153964.pdb or /var/tmp/from_scwrl_1281153964_b.pdb or /var/tmp/from_scwrl_1281153964_a.pdb Error: no new SCWRL conformation added # naming current conformation FORTE1_AL3-scwrl # ReadConformPDB reading from PDB file servers/FORTE1_AL4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation FORTE1_AL4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1597456767.pdb -s /var/tmp/to_scwrl_1597456767.seq -o /var/tmp/from_scwrl_1597456767.pdb > /var/tmp/scwrl_1597456767.log sh: /var/tmp/scwrl_1597456767.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1597456767.pdb or /var/tmp/from_scwrl_1597456767.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1597456767_b.pdb or decoys//var/tmp/from_scwrl_1597456767_b.pdb.gz for input Trying /var/tmp/from_scwrl_1597456767_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1597456767_b.pdb or /var/tmp/from_scwrl_1597456767_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1597456767_a.pdb or decoys//var/tmp/from_scwrl_1597456767_a.pdb.gz for input Trying /var/tmp/from_scwrl_1597456767_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1597456767_a.pdb or /var/tmp/from_scwrl_1597456767_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1597456767.pdb or /var/tmp/from_scwrl_1597456767_b.pdb or /var/tmp/from_scwrl_1597456767_a.pdb Error: no new SCWRL conformation added # naming current conformation FORTE1_AL4-scwrl # ReadConformPDB reading from PDB file servers/FORTE1_AL5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation FORTE1_AL5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1266224307.pdb -s /var/tmp/to_scwrl_1266224307.seq -o /var/tmp/from_scwrl_1266224307.pdb > /var/tmp/scwrl_1266224307.log sh: /var/tmp/scwrl_1266224307.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1266224307.pdb or /var/tmp/from_scwrl_1266224307.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1266224307_b.pdb or decoys//var/tmp/from_scwrl_1266224307_b.pdb.gz for input Trying /var/tmp/from_scwrl_1266224307_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1266224307_b.pdb or /var/tmp/from_scwrl_1266224307_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1266224307_a.pdb or decoys//var/tmp/from_scwrl_1266224307_a.pdb.gz for input Trying /var/tmp/from_scwrl_1266224307_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1266224307_a.pdb or /var/tmp/from_scwrl_1266224307_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1266224307.pdb or /var/tmp/from_scwrl_1266224307_b.pdb or /var/tmp/from_scwrl_1266224307_a.pdb Error: no new SCWRL conformation added # naming current conformation FORTE1_AL5-scwrl # ReadConformPDB reading from PDB file servers/FORTE2_AL1.pdb.gz looking for model 1 Skipped atom 526, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 528, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 530, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 532, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 738, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 740, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 742, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 744, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 754, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 756, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 758, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 760, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 842, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 844, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 846, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 848, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 918, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 920, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 922, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 924, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 1154, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 1156, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 1158, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 1160, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 1230, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 1232, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 1234, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 1236, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 1242, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 1244, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 1246, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 1248, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 1254, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 1256, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 1258, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 1260, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 1342, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 1344, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 1346, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz Skipped atom 1348, because occupancy 1.000 <= existing 1.000 in servers/FORTE2_AL1.pdb.gz # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation FORTE2_AL1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_35276609.pdb -s /var/tmp/to_scwrl_35276609.seq -o /var/tmp/from_scwrl_35276609.pdb > /var/tmp/scwrl_35276609.log sh: /var/tmp/scwrl_35276609.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_35276609.pdb or /var/tmp/from_scwrl_35276609.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_35276609_b.pdb or decoys//var/tmp/from_scwrl_35276609_b.pdb.gz for input Trying /var/tmp/from_scwrl_35276609_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_35276609_b.pdb or /var/tmp/from_scwrl_35276609_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_35276609_a.pdb or decoys//var/tmp/from_scwrl_35276609_a.pdb.gz for input Trying /var/tmp/from_scwrl_35276609_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_35276609_a.pdb or /var/tmp/from_scwrl_35276609_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_35276609.pdb or /var/tmp/from_scwrl_35276609_b.pdb or /var/tmp/from_scwrl_35276609_a.pdb Error: no new SCWRL conformation added # naming current conformation FORTE2_AL1-scwrl # ReadConformPDB reading from PDB file servers/FORTE2_AL2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation FORTE2_AL2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1434824967.pdb -s /var/tmp/to_scwrl_1434824967.seq -o /var/tmp/from_scwrl_1434824967.pdb > /var/tmp/scwrl_1434824967.log sh: /var/tmp/scwrl_1434824967.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1434824967.pdb or /var/tmp/from_scwrl_1434824967.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1434824967_b.pdb or decoys//var/tmp/from_scwrl_1434824967_b.pdb.gz for input Trying /var/tmp/from_scwrl_1434824967_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1434824967_b.pdb or /var/tmp/from_scwrl_1434824967_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1434824967_a.pdb or decoys//var/tmp/from_scwrl_1434824967_a.pdb.gz for input Trying /var/tmp/from_scwrl_1434824967_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1434824967_a.pdb or /var/tmp/from_scwrl_1434824967_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1434824967.pdb or /var/tmp/from_scwrl_1434824967_b.pdb or /var/tmp/from_scwrl_1434824967_a.pdb Error: no new SCWRL conformation added # naming current conformation FORTE2_AL2-scwrl # ReadConformPDB reading from PDB file servers/FORTE2_AL3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation FORTE2_AL3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1197577400.pdb -s /var/tmp/to_scwrl_1197577400.seq -o /var/tmp/from_scwrl_1197577400.pdb > /var/tmp/scwrl_1197577400.log sh: /var/tmp/scwrl_1197577400.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1197577400.pdb or /var/tmp/from_scwrl_1197577400.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1197577400_b.pdb or decoys//var/tmp/from_scwrl_1197577400_b.pdb.gz for input Trying /var/tmp/from_scwrl_1197577400_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1197577400_b.pdb or /var/tmp/from_scwrl_1197577400_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1197577400_a.pdb or decoys//var/tmp/from_scwrl_1197577400_a.pdb.gz for input Trying /var/tmp/from_scwrl_1197577400_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1197577400_a.pdb or /var/tmp/from_scwrl_1197577400_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1197577400.pdb or /var/tmp/from_scwrl_1197577400_b.pdb or /var/tmp/from_scwrl_1197577400_a.pdb Error: no new SCWRL conformation added # naming current conformation FORTE2_AL3-scwrl # ReadConformPDB reading from PDB file servers/FORTE2_AL4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation FORTE2_AL4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_414369149.pdb -s /var/tmp/to_scwrl_414369149.seq -o /var/tmp/from_scwrl_414369149.pdb > /var/tmp/scwrl_414369149.log sh: /var/tmp/scwrl_414369149.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_414369149.pdb or /var/tmp/from_scwrl_414369149.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_414369149_b.pdb or decoys//var/tmp/from_scwrl_414369149_b.pdb.gz for input Trying /var/tmp/from_scwrl_414369149_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_414369149_b.pdb or /var/tmp/from_scwrl_414369149_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_414369149_a.pdb or decoys//var/tmp/from_scwrl_414369149_a.pdb.gz for input Trying /var/tmp/from_scwrl_414369149_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_414369149_a.pdb or /var/tmp/from_scwrl_414369149_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_414369149.pdb or /var/tmp/from_scwrl_414369149_b.pdb or /var/tmp/from_scwrl_414369149_a.pdb Error: no new SCWRL conformation added # naming current conformation FORTE2_AL4-scwrl # ReadConformPDB reading from PDB file servers/FORTE2_AL5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation FORTE2_AL5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1473772099.pdb -s /var/tmp/to_scwrl_1473772099.seq -o /var/tmp/from_scwrl_1473772099.pdb > /var/tmp/scwrl_1473772099.log sh: /var/tmp/scwrl_1473772099.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1473772099.pdb or /var/tmp/from_scwrl_1473772099.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1473772099_b.pdb or decoys//var/tmp/from_scwrl_1473772099_b.pdb.gz for input Trying /var/tmp/from_scwrl_1473772099_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1473772099_b.pdb or /var/tmp/from_scwrl_1473772099_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1473772099_a.pdb or decoys//var/tmp/from_scwrl_1473772099_a.pdb.gz for input Trying /var/tmp/from_scwrl_1473772099_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1473772099_a.pdb or /var/tmp/from_scwrl_1473772099_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1473772099.pdb or /var/tmp/from_scwrl_1473772099_b.pdb or /var/tmp/from_scwrl_1473772099_a.pdb Error: no new SCWRL conformation added # 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 357 # copying to AlignedFragments data structure # naming current conformation FPSOLVER-SERVER_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_936635101.pdb -s /var/tmp/to_scwrl_936635101.seq -o /var/tmp/from_scwrl_936635101.pdb > /var/tmp/scwrl_936635101.log sh: /var/tmp/scwrl_936635101.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_936635101.pdb or /var/tmp/from_scwrl_936635101.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_936635101_b.pdb or decoys//var/tmp/from_scwrl_936635101_b.pdb.gz for input Trying /var/tmp/from_scwrl_936635101_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_936635101_b.pdb or /var/tmp/from_scwrl_936635101_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_936635101_a.pdb or decoys//var/tmp/from_scwrl_936635101_a.pdb.gz for input Trying /var/tmp/from_scwrl_936635101_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_936635101_a.pdb or /var/tmp/from_scwrl_936635101_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_936635101.pdb or /var/tmp/from_scwrl_936635101_b.pdb or /var/tmp/from_scwrl_936635101_a.pdb Error: no new SCWRL conformation added # 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 340 # copying to AlignedFragments data structure # naming current conformation FPSOLVER-SERVER_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1429419055.pdb -s /var/tmp/to_scwrl_1429419055.seq -o /var/tmp/from_scwrl_1429419055.pdb > /var/tmp/scwrl_1429419055.log sh: /var/tmp/scwrl_1429419055.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1429419055.pdb or /var/tmp/from_scwrl_1429419055.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1429419055_b.pdb or decoys//var/tmp/from_scwrl_1429419055_b.pdb.gz for input Trying /var/tmp/from_scwrl_1429419055_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1429419055_b.pdb or /var/tmp/from_scwrl_1429419055_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1429419055_a.pdb or decoys//var/tmp/from_scwrl_1429419055_a.pdb.gz for input Trying /var/tmp/from_scwrl_1429419055_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1429419055_a.pdb or /var/tmp/from_scwrl_1429419055_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1429419055.pdb or /var/tmp/from_scwrl_1429419055_b.pdb or /var/tmp/from_scwrl_1429419055_a.pdb Error: no new SCWRL conformation added # 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 365 # copying to AlignedFragments data structure # naming current conformation FPSOLVER-SERVER_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1751926619.pdb -s /var/tmp/to_scwrl_1751926619.seq -o /var/tmp/from_scwrl_1751926619.pdb > /var/tmp/scwrl_1751926619.log sh: /var/tmp/scwrl_1751926619.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1751926619.pdb or /var/tmp/from_scwrl_1751926619.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1751926619_b.pdb or decoys//var/tmp/from_scwrl_1751926619_b.pdb.gz for input Trying /var/tmp/from_scwrl_1751926619_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1751926619_b.pdb or /var/tmp/from_scwrl_1751926619_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1751926619_a.pdb or decoys//var/tmp/from_scwrl_1751926619_a.pdb.gz for input Trying /var/tmp/from_scwrl_1751926619_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1751926619_a.pdb or /var/tmp/from_scwrl_1751926619_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1751926619.pdb or /var/tmp/from_scwrl_1751926619_b.pdb or /var/tmp/from_scwrl_1751926619_a.pdb Error: no new SCWRL conformation added # 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 343 # copying to AlignedFragments data structure # naming current conformation FPSOLVER-SERVER_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1149935432.pdb -s /var/tmp/to_scwrl_1149935432.seq -o /var/tmp/from_scwrl_1149935432.pdb > /var/tmp/scwrl_1149935432.log sh: /var/tmp/scwrl_1149935432.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1149935432.pdb or /var/tmp/from_scwrl_1149935432.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1149935432_b.pdb or decoys//var/tmp/from_scwrl_1149935432_b.pdb.gz for input Trying /var/tmp/from_scwrl_1149935432_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1149935432_b.pdb or /var/tmp/from_scwrl_1149935432_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1149935432_a.pdb or decoys//var/tmp/from_scwrl_1149935432_a.pdb.gz for input Trying /var/tmp/from_scwrl_1149935432_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1149935432_a.pdb or /var/tmp/from_scwrl_1149935432_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1149935432.pdb or /var/tmp/from_scwrl_1149935432_b.pdb or /var/tmp/from_scwrl_1149935432_a.pdb Error: no new SCWRL conformation added # 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 320 # copying to AlignedFragments data structure # naming current conformation FPSOLVER-SERVER_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_507431161.pdb -s /var/tmp/to_scwrl_507431161.seq -o /var/tmp/from_scwrl_507431161.pdb > /var/tmp/scwrl_507431161.log sh: /var/tmp/scwrl_507431161.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_507431161.pdb or /var/tmp/from_scwrl_507431161.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_507431161_b.pdb or decoys//var/tmp/from_scwrl_507431161_b.pdb.gz for input Trying /var/tmp/from_scwrl_507431161_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_507431161_b.pdb or /var/tmp/from_scwrl_507431161_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_507431161_a.pdb or decoys//var/tmp/from_scwrl_507431161_a.pdb.gz for input Trying /var/tmp/from_scwrl_507431161_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_507431161_a.pdb or /var/tmp/from_scwrl_507431161_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_507431161.pdb or /var/tmp/from_scwrl_507431161_b.pdb or /var/tmp/from_scwrl_507431161_a.pdb Error: no new SCWRL conformation added # naming current conformation FPSOLVER-SERVER_TS5-scwrl # ReadConformPDB reading from PDB file servers/FUGMOD_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation FUGMOD_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1076470407.pdb -s /var/tmp/to_scwrl_1076470407.seq -o /var/tmp/from_scwrl_1076470407.pdb > /var/tmp/scwrl_1076470407.log sh: /var/tmp/scwrl_1076470407.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1076470407.pdb or /var/tmp/from_scwrl_1076470407.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1076470407_b.pdb or decoys//var/tmp/from_scwrl_1076470407_b.pdb.gz for input Trying /var/tmp/from_scwrl_1076470407_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1076470407_b.pdb or /var/tmp/from_scwrl_1076470407_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1076470407_a.pdb or decoys//var/tmp/from_scwrl_1076470407_a.pdb.gz for input Trying /var/tmp/from_scwrl_1076470407_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1076470407_a.pdb or /var/tmp/from_scwrl_1076470407_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1076470407.pdb or /var/tmp/from_scwrl_1076470407_b.pdb or /var/tmp/from_scwrl_1076470407_a.pdb Error: no new SCWRL conformation added # naming current conformation FUGMOD_TS1-scwrl # ReadConformPDB reading from PDB file servers/FUGMOD_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation FUGMOD_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_335888006.pdb -s /var/tmp/to_scwrl_335888006.seq -o /var/tmp/from_scwrl_335888006.pdb > /var/tmp/scwrl_335888006.log sh: /var/tmp/scwrl_335888006.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_335888006.pdb or /var/tmp/from_scwrl_335888006.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_335888006_b.pdb or decoys//var/tmp/from_scwrl_335888006_b.pdb.gz for input Trying /var/tmp/from_scwrl_335888006_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_335888006_b.pdb or /var/tmp/from_scwrl_335888006_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_335888006_a.pdb or decoys//var/tmp/from_scwrl_335888006_a.pdb.gz for input Trying /var/tmp/from_scwrl_335888006_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_335888006_a.pdb or /var/tmp/from_scwrl_335888006_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_335888006.pdb or /var/tmp/from_scwrl_335888006_b.pdb or /var/tmp/from_scwrl_335888006_a.pdb Error: no new SCWRL conformation added # naming current conformation FUGMOD_TS2-scwrl # ReadConformPDB reading from PDB file servers/FUGMOD_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation FUGMOD_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1975402924.pdb -s /var/tmp/to_scwrl_1975402924.seq -o /var/tmp/from_scwrl_1975402924.pdb > /var/tmp/scwrl_1975402924.log sh: /var/tmp/scwrl_1975402924.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1975402924.pdb or /var/tmp/from_scwrl_1975402924.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1975402924_b.pdb or decoys//var/tmp/from_scwrl_1975402924_b.pdb.gz for input Trying /var/tmp/from_scwrl_1975402924_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1975402924_b.pdb or /var/tmp/from_scwrl_1975402924_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1975402924_a.pdb or decoys//var/tmp/from_scwrl_1975402924_a.pdb.gz for input Trying /var/tmp/from_scwrl_1975402924_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1975402924_a.pdb or /var/tmp/from_scwrl_1975402924_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1975402924.pdb or /var/tmp/from_scwrl_1975402924_b.pdb or /var/tmp/from_scwrl_1975402924_a.pdb Error: no new SCWRL conformation added # naming current conformation FUGMOD_TS3-scwrl # ReadConformPDB reading from PDB file servers/FUGMOD_TS4.pdb.gz looking for model 1 # Found a chain break before 170 # copying to AlignedFragments data structure # naming current conformation FUGMOD_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_338349272.pdb -s /var/tmp/to_scwrl_338349272.seq -o /var/tmp/from_scwrl_338349272.pdb > /var/tmp/scwrl_338349272.log sh: /var/tmp/scwrl_338349272.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_338349272.pdb or /var/tmp/from_scwrl_338349272.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_338349272_b.pdb or decoys//var/tmp/from_scwrl_338349272_b.pdb.gz for input Trying /var/tmp/from_scwrl_338349272_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_338349272_b.pdb or /var/tmp/from_scwrl_338349272_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_338349272_a.pdb or decoys//var/tmp/from_scwrl_338349272_a.pdb.gz for input Trying /var/tmp/from_scwrl_338349272_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_338349272_a.pdb or /var/tmp/from_scwrl_338349272_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_338349272.pdb or /var/tmp/from_scwrl_338349272_b.pdb or /var/tmp/from_scwrl_338349272_a.pdb Error: no new SCWRL conformation added # naming current conformation FUGMOD_TS4-scwrl # ReadConformPDB reading from PDB file servers/FUGMOD_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation FUGMOD_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_81495713.pdb -s /var/tmp/to_scwrl_81495713.seq -o /var/tmp/from_scwrl_81495713.pdb > /var/tmp/scwrl_81495713.log sh: /var/tmp/scwrl_81495713.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_81495713.pdb or /var/tmp/from_scwrl_81495713.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_81495713_b.pdb or decoys//var/tmp/from_scwrl_81495713_b.pdb.gz for input Trying /var/tmp/from_scwrl_81495713_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_81495713_b.pdb or /var/tmp/from_scwrl_81495713_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_81495713_a.pdb or decoys//var/tmp/from_scwrl_81495713_a.pdb.gz for input Trying /var/tmp/from_scwrl_81495713_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_81495713_a.pdb or /var/tmp/from_scwrl_81495713_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_81495713.pdb or /var/tmp/from_scwrl_81495713_b.pdb or /var/tmp/from_scwrl_81495713_a.pdb Error: no new SCWRL conformation added # naming current conformation FUGMOD_TS5-scwrl # ReadConformPDB reading from PDB file servers/FUGUE_AL1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation FUGUE_AL1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_459146678.pdb -s /var/tmp/to_scwrl_459146678.seq -o /var/tmp/from_scwrl_459146678.pdb > /var/tmp/scwrl_459146678.log sh: /var/tmp/scwrl_459146678.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_459146678.pdb or /var/tmp/from_scwrl_459146678.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_459146678_b.pdb or decoys//var/tmp/from_scwrl_459146678_b.pdb.gz for input Trying /var/tmp/from_scwrl_459146678_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_459146678_b.pdb or /var/tmp/from_scwrl_459146678_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_459146678_a.pdb or decoys//var/tmp/from_scwrl_459146678_a.pdb.gz for input Trying /var/tmp/from_scwrl_459146678_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_459146678_a.pdb or /var/tmp/from_scwrl_459146678_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_459146678.pdb or /var/tmp/from_scwrl_459146678_b.pdb or /var/tmp/from_scwrl_459146678_a.pdb Error: no new SCWRL conformation added # naming current conformation FUGUE_AL1-scwrl # ReadConformPDB reading from PDB file servers/FUGUE_AL2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation FUGUE_AL2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1980145457.pdb -s /var/tmp/to_scwrl_1980145457.seq -o /var/tmp/from_scwrl_1980145457.pdb > /var/tmp/scwrl_1980145457.log sh: /var/tmp/scwrl_1980145457.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1980145457.pdb or /var/tmp/from_scwrl_1980145457.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1980145457_b.pdb or decoys//var/tmp/from_scwrl_1980145457_b.pdb.gz for input Trying /var/tmp/from_scwrl_1980145457_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1980145457_b.pdb or /var/tmp/from_scwrl_1980145457_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1980145457_a.pdb or decoys//var/tmp/from_scwrl_1980145457_a.pdb.gz for input Trying /var/tmp/from_scwrl_1980145457_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1980145457_a.pdb or /var/tmp/from_scwrl_1980145457_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1980145457.pdb or /var/tmp/from_scwrl_1980145457_b.pdb or /var/tmp/from_scwrl_1980145457_a.pdb Error: no new SCWRL conformation added # naming current conformation FUGUE_AL2-scwrl # ReadConformPDB reading from PDB file servers/FUGUE_AL3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation FUGUE_AL3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_333252351.pdb -s /var/tmp/to_scwrl_333252351.seq -o /var/tmp/from_scwrl_333252351.pdb > /var/tmp/scwrl_333252351.log sh: /var/tmp/scwrl_333252351.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_333252351.pdb or /var/tmp/from_scwrl_333252351.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_333252351_b.pdb or decoys//var/tmp/from_scwrl_333252351_b.pdb.gz for input Trying /var/tmp/from_scwrl_333252351_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_333252351_b.pdb or /var/tmp/from_scwrl_333252351_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_333252351_a.pdb or decoys//var/tmp/from_scwrl_333252351_a.pdb.gz for input Trying /var/tmp/from_scwrl_333252351_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_333252351_a.pdb or /var/tmp/from_scwrl_333252351_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_333252351.pdb or /var/tmp/from_scwrl_333252351_b.pdb or /var/tmp/from_scwrl_333252351_a.pdb Error: no new SCWRL conformation added # naming current conformation FUGUE_AL3-scwrl # ReadConformPDB reading from PDB file servers/FUGUE_AL4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation FUGUE_AL4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_732548991.pdb -s /var/tmp/to_scwrl_732548991.seq -o /var/tmp/from_scwrl_732548991.pdb > /var/tmp/scwrl_732548991.log sh: /var/tmp/scwrl_732548991.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_732548991.pdb or /var/tmp/from_scwrl_732548991.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_732548991_b.pdb or decoys//var/tmp/from_scwrl_732548991_b.pdb.gz for input Trying /var/tmp/from_scwrl_732548991_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_732548991_b.pdb or /var/tmp/from_scwrl_732548991_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_732548991_a.pdb or decoys//var/tmp/from_scwrl_732548991_a.pdb.gz for input Trying /var/tmp/from_scwrl_732548991_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_732548991_a.pdb or /var/tmp/from_scwrl_732548991_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_732548991.pdb or /var/tmp/from_scwrl_732548991_b.pdb or /var/tmp/from_scwrl_732548991_a.pdb Error: no new SCWRL conformation added # naming current conformation FUGUE_AL4-scwrl # ReadConformPDB reading from PDB file servers/FUGUE_AL5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation FUGUE_AL5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_590955209.pdb -s /var/tmp/to_scwrl_590955209.seq -o /var/tmp/from_scwrl_590955209.pdb > /var/tmp/scwrl_590955209.log sh: /var/tmp/scwrl_590955209.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_590955209.pdb or /var/tmp/from_scwrl_590955209.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_590955209_b.pdb or decoys//var/tmp/from_scwrl_590955209_b.pdb.gz for input Trying /var/tmp/from_scwrl_590955209_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_590955209_b.pdb or /var/tmp/from_scwrl_590955209_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_590955209_a.pdb or decoys//var/tmp/from_scwrl_590955209_a.pdb.gz for input Trying /var/tmp/from_scwrl_590955209_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_590955209_a.pdb or /var/tmp/from_scwrl_590955209_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_590955209.pdb or /var/tmp/from_scwrl_590955209_b.pdb or /var/tmp/from_scwrl_590955209_a.pdb Error: no new SCWRL conformation added # naming current conformation FUGUE_AL5-scwrl # ReadConformPDB reading from PDB file servers/FUNCTION_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation FUNCTION_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1814059735.pdb -s /var/tmp/to_scwrl_1814059735.seq -o /var/tmp/from_scwrl_1814059735.pdb > /var/tmp/scwrl_1814059735.log sh: /var/tmp/scwrl_1814059735.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1814059735.pdb or /var/tmp/from_scwrl_1814059735.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1814059735_b.pdb or decoys//var/tmp/from_scwrl_1814059735_b.pdb.gz for input Trying /var/tmp/from_scwrl_1814059735_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1814059735_b.pdb or /var/tmp/from_scwrl_1814059735_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1814059735_a.pdb or decoys//var/tmp/from_scwrl_1814059735_a.pdb.gz for input Trying /var/tmp/from_scwrl_1814059735_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1814059735_a.pdb or /var/tmp/from_scwrl_1814059735_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1814059735.pdb or /var/tmp/from_scwrl_1814059735_b.pdb or /var/tmp/from_scwrl_1814059735_a.pdb Error: no new SCWRL conformation added # 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 357 # copying to AlignedFragments data structure # naming current conformation FUNCTION_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_320401936.pdb -s /var/tmp/to_scwrl_320401936.seq -o /var/tmp/from_scwrl_320401936.pdb > /var/tmp/scwrl_320401936.log sh: /var/tmp/scwrl_320401936.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_320401936.pdb or /var/tmp/from_scwrl_320401936.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_320401936_b.pdb or decoys//var/tmp/from_scwrl_320401936_b.pdb.gz for input Trying /var/tmp/from_scwrl_320401936_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_320401936_b.pdb or /var/tmp/from_scwrl_320401936_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_320401936_a.pdb or decoys//var/tmp/from_scwrl_320401936_a.pdb.gz for input Trying /var/tmp/from_scwrl_320401936_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_320401936_a.pdb or /var/tmp/from_scwrl_320401936_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_320401936.pdb or /var/tmp/from_scwrl_320401936_b.pdb or /var/tmp/from_scwrl_320401936_a.pdb Error: no new SCWRL conformation added # 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 365 # copying to AlignedFragments data structure # naming current conformation FUNCTION_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1041384933.pdb -s /var/tmp/to_scwrl_1041384933.seq -o /var/tmp/from_scwrl_1041384933.pdb > /var/tmp/scwrl_1041384933.log sh: /var/tmp/scwrl_1041384933.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1041384933.pdb or /var/tmp/from_scwrl_1041384933.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1041384933_b.pdb or decoys//var/tmp/from_scwrl_1041384933_b.pdb.gz for input Trying /var/tmp/from_scwrl_1041384933_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1041384933_b.pdb or /var/tmp/from_scwrl_1041384933_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1041384933_a.pdb or decoys//var/tmp/from_scwrl_1041384933_a.pdb.gz for input Trying /var/tmp/from_scwrl_1041384933_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1041384933_a.pdb or /var/tmp/from_scwrl_1041384933_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1041384933.pdb or /var/tmp/from_scwrl_1041384933_b.pdb or /var/tmp/from_scwrl_1041384933_a.pdb Error: no new SCWRL conformation added # 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 365 # copying to AlignedFragments data structure # naming current conformation FUNCTION_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1044376499.pdb -s /var/tmp/to_scwrl_1044376499.seq -o /var/tmp/from_scwrl_1044376499.pdb > /var/tmp/scwrl_1044376499.log sh: /var/tmp/scwrl_1044376499.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1044376499.pdb or /var/tmp/from_scwrl_1044376499.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1044376499_b.pdb or decoys//var/tmp/from_scwrl_1044376499_b.pdb.gz for input Trying /var/tmp/from_scwrl_1044376499_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1044376499_b.pdb or /var/tmp/from_scwrl_1044376499_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1044376499_a.pdb or decoys//var/tmp/from_scwrl_1044376499_a.pdb.gz for input Trying /var/tmp/from_scwrl_1044376499_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1044376499_a.pdb or /var/tmp/from_scwrl_1044376499_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1044376499.pdb or /var/tmp/from_scwrl_1044376499_b.pdb or /var/tmp/from_scwrl_1044376499_a.pdb Error: no new SCWRL conformation added # 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 370 # copying to AlignedFragments data structure # naming current conformation FUNCTION_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1856885904.pdb -s /var/tmp/to_scwrl_1856885904.seq -o /var/tmp/from_scwrl_1856885904.pdb > /var/tmp/scwrl_1856885904.log sh: /var/tmp/scwrl_1856885904.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1856885904.pdb or /var/tmp/from_scwrl_1856885904.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1856885904_b.pdb or decoys//var/tmp/from_scwrl_1856885904_b.pdb.gz for input Trying /var/tmp/from_scwrl_1856885904_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1856885904_b.pdb or /var/tmp/from_scwrl_1856885904_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1856885904_a.pdb or decoys//var/tmp/from_scwrl_1856885904_a.pdb.gz for input Trying /var/tmp/from_scwrl_1856885904_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1856885904_a.pdb or /var/tmp/from_scwrl_1856885904_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1856885904.pdb or /var/tmp/from_scwrl_1856885904_b.pdb or /var/tmp/from_scwrl_1856885904_a.pdb Error: no new SCWRL conformation added # naming current conformation FUNCTION_TS5-scwrl # ReadConformPDB reading from PDB file servers/GeneSilicoMetaServer_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation GeneSilicoMetaServer_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1034251284.pdb -s /var/tmp/to_scwrl_1034251284.seq -o /var/tmp/from_scwrl_1034251284.pdb > /var/tmp/scwrl_1034251284.log sh: /var/tmp/scwrl_1034251284.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1034251284.pdb or /var/tmp/from_scwrl_1034251284.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1034251284_b.pdb or decoys//var/tmp/from_scwrl_1034251284_b.pdb.gz for input Trying /var/tmp/from_scwrl_1034251284_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1034251284_b.pdb or /var/tmp/from_scwrl_1034251284_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1034251284_a.pdb or decoys//var/tmp/from_scwrl_1034251284_a.pdb.gz for input Trying /var/tmp/from_scwrl_1034251284_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1034251284_a.pdb or /var/tmp/from_scwrl_1034251284_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1034251284.pdb or /var/tmp/from_scwrl_1034251284_b.pdb or /var/tmp/from_scwrl_1034251284_a.pdb Error: no new SCWRL conformation added # naming current conformation GeneSilicoMetaServer_TS1-scwrl # ReadConformPDB reading from PDB file servers/GeneSilicoMetaServer_TS2.pdb.gz looking for model 1 # Found a chain break before 360 # copying to AlignedFragments data structure # naming current conformation GeneSilicoMetaServer_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1004238740.pdb -s /var/tmp/to_scwrl_1004238740.seq -o /var/tmp/from_scwrl_1004238740.pdb > /var/tmp/scwrl_1004238740.log sh: /var/tmp/scwrl_1004238740.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1004238740.pdb or /var/tmp/from_scwrl_1004238740.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1004238740_b.pdb or decoys//var/tmp/from_scwrl_1004238740_b.pdb.gz for input Trying /var/tmp/from_scwrl_1004238740_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1004238740_b.pdb or /var/tmp/from_scwrl_1004238740_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1004238740_a.pdb or decoys//var/tmp/from_scwrl_1004238740_a.pdb.gz for input Trying /var/tmp/from_scwrl_1004238740_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1004238740_a.pdb or /var/tmp/from_scwrl_1004238740_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1004238740.pdb or /var/tmp/from_scwrl_1004238740_b.pdb or /var/tmp/from_scwrl_1004238740_a.pdb Error: no new SCWRL conformation added # naming current conformation GeneSilicoMetaServer_TS2-scwrl # ReadConformPDB reading from PDB file servers/GeneSilicoMetaServer_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation GeneSilicoMetaServer_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1445199456.pdb -s /var/tmp/to_scwrl_1445199456.seq -o /var/tmp/from_scwrl_1445199456.pdb > /var/tmp/scwrl_1445199456.log sh: /var/tmp/scwrl_1445199456.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1445199456.pdb or /var/tmp/from_scwrl_1445199456.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1445199456_b.pdb or decoys//var/tmp/from_scwrl_1445199456_b.pdb.gz for input Trying /var/tmp/from_scwrl_1445199456_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1445199456_b.pdb or /var/tmp/from_scwrl_1445199456_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1445199456_a.pdb or decoys//var/tmp/from_scwrl_1445199456_a.pdb.gz for input Trying /var/tmp/from_scwrl_1445199456_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1445199456_a.pdb or /var/tmp/from_scwrl_1445199456_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1445199456.pdb or /var/tmp/from_scwrl_1445199456_b.pdb or /var/tmp/from_scwrl_1445199456_a.pdb Error: no new SCWRL conformation added # naming current conformation GeneSilicoMetaServer_TS3-scwrl # ReadConformPDB reading from PDB file servers/GeneSilicoMetaServer_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation GeneSilicoMetaServer_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_167921601.pdb -s /var/tmp/to_scwrl_167921601.seq -o /var/tmp/from_scwrl_167921601.pdb > /var/tmp/scwrl_167921601.log sh: /var/tmp/scwrl_167921601.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_167921601.pdb or /var/tmp/from_scwrl_167921601.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_167921601_b.pdb or decoys//var/tmp/from_scwrl_167921601_b.pdb.gz for input Trying /var/tmp/from_scwrl_167921601_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_167921601_b.pdb or /var/tmp/from_scwrl_167921601_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_167921601_a.pdb or decoys//var/tmp/from_scwrl_167921601_a.pdb.gz for input Trying /var/tmp/from_scwrl_167921601_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_167921601_a.pdb or /var/tmp/from_scwrl_167921601_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_167921601.pdb or /var/tmp/from_scwrl_167921601_b.pdb or /var/tmp/from_scwrl_167921601_a.pdb Error: no new SCWRL conformation added # naming current conformation GeneSilicoMetaServer_TS4-scwrl # ReadConformPDB reading from PDB file servers/GeneSilicoMetaServer_TS5.pdb.gz looking for model 1 # Found a chain break before 316 # copying to AlignedFragments data structure # naming current conformation GeneSilicoMetaServer_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_454211861.pdb -s /var/tmp/to_scwrl_454211861.seq -o /var/tmp/from_scwrl_454211861.pdb > /var/tmp/scwrl_454211861.log sh: /var/tmp/scwrl_454211861.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_454211861.pdb or /var/tmp/from_scwrl_454211861.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_454211861_b.pdb or decoys//var/tmp/from_scwrl_454211861_b.pdb.gz for input Trying /var/tmp/from_scwrl_454211861_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_454211861_b.pdb or /var/tmp/from_scwrl_454211861_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_454211861_a.pdb or decoys//var/tmp/from_scwrl_454211861_a.pdb.gz for input Trying /var/tmp/from_scwrl_454211861_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_454211861_a.pdb or /var/tmp/from_scwrl_454211861_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_454211861.pdb or /var/tmp/from_scwrl_454211861_b.pdb or /var/tmp/from_scwrl_454211861_a.pdb Error: no new SCWRL conformation added # naming current conformation GeneSilicoMetaServer_TS5-scwrl # ReadConformPDB reading from PDB file servers/HHpred1_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation HHpred1_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_563940117.pdb -s /var/tmp/to_scwrl_563940117.seq -o /var/tmp/from_scwrl_563940117.pdb > /var/tmp/scwrl_563940117.log sh: /var/tmp/scwrl_563940117.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_563940117.pdb or /var/tmp/from_scwrl_563940117.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_563940117_b.pdb or decoys//var/tmp/from_scwrl_563940117_b.pdb.gz for input Trying /var/tmp/from_scwrl_563940117_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_563940117_b.pdb or /var/tmp/from_scwrl_563940117_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_563940117_a.pdb or decoys//var/tmp/from_scwrl_563940117_a.pdb.gz for input Trying /var/tmp/from_scwrl_563940117_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_563940117_a.pdb or /var/tmp/from_scwrl_563940117_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_563940117.pdb or /var/tmp/from_scwrl_563940117_b.pdb or /var/tmp/from_scwrl_563940117_a.pdb Error: no new SCWRL conformation added # naming current conformation HHpred1_TS1-scwrl # ReadConformPDB reading from PDB file servers/HHpred2_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation HHpred2_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_203198210.pdb -s /var/tmp/to_scwrl_203198210.seq -o /var/tmp/from_scwrl_203198210.pdb > /var/tmp/scwrl_203198210.log sh: /var/tmp/scwrl_203198210.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_203198210.pdb or /var/tmp/from_scwrl_203198210.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_203198210_b.pdb or decoys//var/tmp/from_scwrl_203198210_b.pdb.gz for input Trying /var/tmp/from_scwrl_203198210_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_203198210_b.pdb or /var/tmp/from_scwrl_203198210_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_203198210_a.pdb or decoys//var/tmp/from_scwrl_203198210_a.pdb.gz for input Trying /var/tmp/from_scwrl_203198210_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_203198210_a.pdb or /var/tmp/from_scwrl_203198210_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_203198210.pdb or /var/tmp/from_scwrl_203198210_b.pdb or /var/tmp/from_scwrl_203198210_a.pdb Error: no new SCWRL conformation added # naming current conformation HHpred2_TS1-scwrl # ReadConformPDB reading from PDB file servers/HHpred3_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation HHpred3_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1889036828.pdb -s /var/tmp/to_scwrl_1889036828.seq -o /var/tmp/from_scwrl_1889036828.pdb > /var/tmp/scwrl_1889036828.log sh: /var/tmp/scwrl_1889036828.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1889036828.pdb or /var/tmp/from_scwrl_1889036828.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1889036828_b.pdb or decoys//var/tmp/from_scwrl_1889036828_b.pdb.gz for input Trying /var/tmp/from_scwrl_1889036828_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1889036828_b.pdb or /var/tmp/from_scwrl_1889036828_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1889036828_a.pdb or decoys//var/tmp/from_scwrl_1889036828_a.pdb.gz for input Trying /var/tmp/from_scwrl_1889036828_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1889036828_a.pdb or /var/tmp/from_scwrl_1889036828_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1889036828.pdb or /var/tmp/from_scwrl_1889036828_b.pdb or /var/tmp/from_scwrl_1889036828_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation Huber-Torda-Server_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1761517517.pdb -s /var/tmp/to_scwrl_1761517517.seq -o /var/tmp/from_scwrl_1761517517.pdb > /var/tmp/scwrl_1761517517.log sh: /var/tmp/scwrl_1761517517.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1761517517.pdb or /var/tmp/from_scwrl_1761517517.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1761517517_b.pdb or decoys//var/tmp/from_scwrl_1761517517_b.pdb.gz for input Trying /var/tmp/from_scwrl_1761517517_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1761517517_b.pdb or /var/tmp/from_scwrl_1761517517_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1761517517_a.pdb or decoys//var/tmp/from_scwrl_1761517517_a.pdb.gz for input Trying /var/tmp/from_scwrl_1761517517_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1761517517_a.pdb or /var/tmp/from_scwrl_1761517517_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1761517517.pdb or /var/tmp/from_scwrl_1761517517_b.pdb or /var/tmp/from_scwrl_1761517517_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation Huber-Torda-Server_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_617567359.pdb -s /var/tmp/to_scwrl_617567359.seq -o /var/tmp/from_scwrl_617567359.pdb > /var/tmp/scwrl_617567359.log sh: /var/tmp/scwrl_617567359.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_617567359.pdb or /var/tmp/from_scwrl_617567359.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_617567359_b.pdb or decoys//var/tmp/from_scwrl_617567359_b.pdb.gz for input Trying /var/tmp/from_scwrl_617567359_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_617567359_b.pdb or /var/tmp/from_scwrl_617567359_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_617567359_a.pdb or decoys//var/tmp/from_scwrl_617567359_a.pdb.gz for input Trying /var/tmp/from_scwrl_617567359_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_617567359_a.pdb or /var/tmp/from_scwrl_617567359_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_617567359.pdb or /var/tmp/from_scwrl_617567359_b.pdb or /var/tmp/from_scwrl_617567359_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation Huber-Torda-Server_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1215325280.pdb -s /var/tmp/to_scwrl_1215325280.seq -o /var/tmp/from_scwrl_1215325280.pdb > /var/tmp/scwrl_1215325280.log sh: /var/tmp/scwrl_1215325280.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1215325280.pdb or /var/tmp/from_scwrl_1215325280.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1215325280_b.pdb or decoys//var/tmp/from_scwrl_1215325280_b.pdb.gz for input Trying /var/tmp/from_scwrl_1215325280_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1215325280_b.pdb or /var/tmp/from_scwrl_1215325280_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1215325280_a.pdb or decoys//var/tmp/from_scwrl_1215325280_a.pdb.gz for input Trying /var/tmp/from_scwrl_1215325280_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1215325280_a.pdb or /var/tmp/from_scwrl_1215325280_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1215325280.pdb or /var/tmp/from_scwrl_1215325280_b.pdb or /var/tmp/from_scwrl_1215325280_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation Huber-Torda-Server_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_550668971.pdb -s /var/tmp/to_scwrl_550668971.seq -o /var/tmp/from_scwrl_550668971.pdb > /var/tmp/scwrl_550668971.log sh: /var/tmp/scwrl_550668971.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_550668971.pdb or /var/tmp/from_scwrl_550668971.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_550668971_b.pdb or decoys//var/tmp/from_scwrl_550668971_b.pdb.gz for input Trying /var/tmp/from_scwrl_550668971_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_550668971_b.pdb or /var/tmp/from_scwrl_550668971_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_550668971_a.pdb or decoys//var/tmp/from_scwrl_550668971_a.pdb.gz for input Trying /var/tmp/from_scwrl_550668971_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_550668971_a.pdb or /var/tmp/from_scwrl_550668971_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_550668971.pdb or /var/tmp/from_scwrl_550668971_b.pdb or /var/tmp/from_scwrl_550668971_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation Huber-Torda-Server_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_2046986415.pdb -s /var/tmp/to_scwrl_2046986415.seq -o /var/tmp/from_scwrl_2046986415.pdb > /var/tmp/scwrl_2046986415.log sh: /var/tmp/scwrl_2046986415.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_2046986415.pdb or /var/tmp/from_scwrl_2046986415.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2046986415_b.pdb or decoys//var/tmp/from_scwrl_2046986415_b.pdb.gz for input Trying /var/tmp/from_scwrl_2046986415_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_2046986415_b.pdb or /var/tmp/from_scwrl_2046986415_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2046986415_a.pdb or decoys//var/tmp/from_scwrl_2046986415_a.pdb.gz for input Trying /var/tmp/from_scwrl_2046986415_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_2046986415_a.pdb or /var/tmp/from_scwrl_2046986415_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_2046986415.pdb or /var/tmp/from_scwrl_2046986415_b.pdb or /var/tmp/from_scwrl_2046986415_a.pdb Error: no new SCWRL conformation added # naming current conformation Huber-Torda-Server_TS5-scwrl # ReadConformPDB reading from PDB file servers/LOOPP_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation LOOPP_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_819768253.pdb -s /var/tmp/to_scwrl_819768253.seq -o /var/tmp/from_scwrl_819768253.pdb > /var/tmp/scwrl_819768253.log sh: /var/tmp/scwrl_819768253.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_819768253.pdb or /var/tmp/from_scwrl_819768253.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_819768253_b.pdb or decoys//var/tmp/from_scwrl_819768253_b.pdb.gz for input Trying /var/tmp/from_scwrl_819768253_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_819768253_b.pdb or /var/tmp/from_scwrl_819768253_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_819768253_a.pdb or decoys//var/tmp/from_scwrl_819768253_a.pdb.gz for input Trying /var/tmp/from_scwrl_819768253_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_819768253_a.pdb or /var/tmp/from_scwrl_819768253_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_819768253.pdb or /var/tmp/from_scwrl_819768253_b.pdb or /var/tmp/from_scwrl_819768253_a.pdb Error: no new SCWRL conformation added # naming current conformation LOOPP_TS1-scwrl # ReadConformPDB reading from PDB file servers/LOOPP_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation LOOPP_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1700604403.pdb -s /var/tmp/to_scwrl_1700604403.seq -o /var/tmp/from_scwrl_1700604403.pdb > /var/tmp/scwrl_1700604403.log sh: /var/tmp/scwrl_1700604403.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1700604403.pdb or /var/tmp/from_scwrl_1700604403.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1700604403_b.pdb or decoys//var/tmp/from_scwrl_1700604403_b.pdb.gz for input Trying /var/tmp/from_scwrl_1700604403_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1700604403_b.pdb or /var/tmp/from_scwrl_1700604403_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1700604403_a.pdb or decoys//var/tmp/from_scwrl_1700604403_a.pdb.gz for input Trying /var/tmp/from_scwrl_1700604403_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1700604403_a.pdb or /var/tmp/from_scwrl_1700604403_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1700604403.pdb or /var/tmp/from_scwrl_1700604403_b.pdb or /var/tmp/from_scwrl_1700604403_a.pdb Error: no new SCWRL conformation added # naming current conformation LOOPP_TS2-scwrl # ReadConformPDB reading from PDB file servers/LOOPP_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation LOOPP_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_406933929.pdb -s /var/tmp/to_scwrl_406933929.seq -o /var/tmp/from_scwrl_406933929.pdb > /var/tmp/scwrl_406933929.log sh: /var/tmp/scwrl_406933929.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_406933929.pdb or /var/tmp/from_scwrl_406933929.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_406933929_b.pdb or decoys//var/tmp/from_scwrl_406933929_b.pdb.gz for input Trying /var/tmp/from_scwrl_406933929_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_406933929_b.pdb or /var/tmp/from_scwrl_406933929_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_406933929_a.pdb or decoys//var/tmp/from_scwrl_406933929_a.pdb.gz for input Trying /var/tmp/from_scwrl_406933929_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_406933929_a.pdb or /var/tmp/from_scwrl_406933929_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_406933929.pdb or /var/tmp/from_scwrl_406933929_b.pdb or /var/tmp/from_scwrl_406933929_a.pdb Error: no new SCWRL conformation added # naming current conformation LOOPP_TS3-scwrl # ReadConformPDB reading from PDB file servers/LOOPP_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation LOOPP_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1896238661.pdb -s /var/tmp/to_scwrl_1896238661.seq -o /var/tmp/from_scwrl_1896238661.pdb > /var/tmp/scwrl_1896238661.log sh: /var/tmp/scwrl_1896238661.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1896238661.pdb or /var/tmp/from_scwrl_1896238661.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1896238661_b.pdb or decoys//var/tmp/from_scwrl_1896238661_b.pdb.gz for input Trying /var/tmp/from_scwrl_1896238661_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1896238661_b.pdb or /var/tmp/from_scwrl_1896238661_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1896238661_a.pdb or decoys//var/tmp/from_scwrl_1896238661_a.pdb.gz for input Trying /var/tmp/from_scwrl_1896238661_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1896238661_a.pdb or /var/tmp/from_scwrl_1896238661_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1896238661.pdb or /var/tmp/from_scwrl_1896238661_b.pdb or /var/tmp/from_scwrl_1896238661_a.pdb Error: no new SCWRL conformation added # naming current conformation LOOPP_TS4-scwrl # ReadConformPDB reading from PDB file servers/LOOPP_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation LOOPP_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_2036492409.pdb -s /var/tmp/to_scwrl_2036492409.seq -o /var/tmp/from_scwrl_2036492409.pdb > /var/tmp/scwrl_2036492409.log sh: /var/tmp/scwrl_2036492409.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_2036492409.pdb or /var/tmp/from_scwrl_2036492409.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2036492409_b.pdb or decoys//var/tmp/from_scwrl_2036492409_b.pdb.gz for input Trying /var/tmp/from_scwrl_2036492409_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_2036492409_b.pdb or /var/tmp/from_scwrl_2036492409_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2036492409_a.pdb or decoys//var/tmp/from_scwrl_2036492409_a.pdb.gz for input Trying /var/tmp/from_scwrl_2036492409_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_2036492409_a.pdb or /var/tmp/from_scwrl_2036492409_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_2036492409.pdb or /var/tmp/from_scwrl_2036492409_b.pdb or /var/tmp/from_scwrl_2036492409_a.pdb Error: no new SCWRL conformation added # naming current conformation LOOPP_TS5-scwrl # ReadConformPDB reading from PDB file servers/Ma-OPUS-server_TS1.pdb.gz looking for model 1 # Found a chain break before 294 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_234853207.pdb -s /var/tmp/to_scwrl_234853207.seq -o /var/tmp/from_scwrl_234853207.pdb > /var/tmp/scwrl_234853207.log sh: /var/tmp/scwrl_234853207.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_234853207.pdb or /var/tmp/from_scwrl_234853207.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_234853207_b.pdb or decoys//var/tmp/from_scwrl_234853207_b.pdb.gz for input Trying /var/tmp/from_scwrl_234853207_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_234853207_b.pdb or /var/tmp/from_scwrl_234853207_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_234853207_a.pdb or decoys//var/tmp/from_scwrl_234853207_a.pdb.gz for input Trying /var/tmp/from_scwrl_234853207_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_234853207_a.pdb or /var/tmp/from_scwrl_234853207_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_234853207.pdb or /var/tmp/from_scwrl_234853207_b.pdb or /var/tmp/from_scwrl_234853207_a.pdb Error: no new SCWRL conformation added # 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 346 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_87104286.pdb -s /var/tmp/to_scwrl_87104286.seq -o /var/tmp/from_scwrl_87104286.pdb > /var/tmp/scwrl_87104286.log sh: /var/tmp/scwrl_87104286.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_87104286.pdb or /var/tmp/from_scwrl_87104286.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_87104286_b.pdb or decoys//var/tmp/from_scwrl_87104286_b.pdb.gz for input Trying /var/tmp/from_scwrl_87104286_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_87104286_b.pdb or /var/tmp/from_scwrl_87104286_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_87104286_a.pdb or decoys//var/tmp/from_scwrl_87104286_a.pdb.gz for input Trying /var/tmp/from_scwrl_87104286_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_87104286_a.pdb or /var/tmp/from_scwrl_87104286_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_87104286.pdb or /var/tmp/from_scwrl_87104286_b.pdb or /var/tmp/from_scwrl_87104286_a.pdb Error: no new SCWRL conformation added # 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 298 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_2117988123.pdb -s /var/tmp/to_scwrl_2117988123.seq -o /var/tmp/from_scwrl_2117988123.pdb > /var/tmp/scwrl_2117988123.log sh: /var/tmp/scwrl_2117988123.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_2117988123.pdb or /var/tmp/from_scwrl_2117988123.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2117988123_b.pdb or decoys//var/tmp/from_scwrl_2117988123_b.pdb.gz for input Trying /var/tmp/from_scwrl_2117988123_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_2117988123_b.pdb or /var/tmp/from_scwrl_2117988123_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2117988123_a.pdb or decoys//var/tmp/from_scwrl_2117988123_a.pdb.gz for input Trying /var/tmp/from_scwrl_2117988123_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_2117988123_a.pdb or /var/tmp/from_scwrl_2117988123_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_2117988123.pdb or /var/tmp/from_scwrl_2117988123_b.pdb or /var/tmp/from_scwrl_2117988123_a.pdb Error: no new SCWRL conformation added # 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 364 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_693999885.pdb -s /var/tmp/to_scwrl_693999885.seq -o /var/tmp/from_scwrl_693999885.pdb > /var/tmp/scwrl_693999885.log sh: /var/tmp/scwrl_693999885.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_693999885.pdb or /var/tmp/from_scwrl_693999885.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_693999885_b.pdb or decoys//var/tmp/from_scwrl_693999885_b.pdb.gz for input Trying /var/tmp/from_scwrl_693999885_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_693999885_b.pdb or /var/tmp/from_scwrl_693999885_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_693999885_a.pdb or decoys//var/tmp/from_scwrl_693999885_a.pdb.gz for input Trying /var/tmp/from_scwrl_693999885_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_693999885_a.pdb or /var/tmp/from_scwrl_693999885_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_693999885.pdb or /var/tmp/from_scwrl_693999885_b.pdb or /var/tmp/from_scwrl_693999885_a.pdb Error: no new SCWRL conformation added # 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 330 # copying to AlignedFragments data structure # naming current conformation Ma-OPUS-server_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_2067249743.pdb -s /var/tmp/to_scwrl_2067249743.seq -o /var/tmp/from_scwrl_2067249743.pdb > /var/tmp/scwrl_2067249743.log sh: /var/tmp/scwrl_2067249743.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_2067249743.pdb or /var/tmp/from_scwrl_2067249743.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2067249743_b.pdb or decoys//var/tmp/from_scwrl_2067249743_b.pdb.gz for input Trying /var/tmp/from_scwrl_2067249743_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_2067249743_b.pdb or /var/tmp/from_scwrl_2067249743_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2067249743_a.pdb or decoys//var/tmp/from_scwrl_2067249743_a.pdb.gz for input Trying /var/tmp/from_scwrl_2067249743_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_2067249743_a.pdb or /var/tmp/from_scwrl_2067249743_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_2067249743.pdb or /var/tmp/from_scwrl_2067249743_b.pdb or /var/tmp/from_scwrl_2067249743_a.pdb Error: no new SCWRL conformation added # 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 372 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_303756827.pdb -s /var/tmp/to_scwrl_303756827.seq -o /var/tmp/from_scwrl_303756827.pdb > /var/tmp/scwrl_303756827.log sh: /var/tmp/scwrl_303756827.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_303756827.pdb or /var/tmp/from_scwrl_303756827.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_303756827_b.pdb or decoys//var/tmp/from_scwrl_303756827_b.pdb.gz for input Trying /var/tmp/from_scwrl_303756827_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_303756827_b.pdb or /var/tmp/from_scwrl_303756827_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_303756827_a.pdb or decoys//var/tmp/from_scwrl_303756827_a.pdb.gz for input Trying /var/tmp/from_scwrl_303756827_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_303756827_a.pdb or /var/tmp/from_scwrl_303756827_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_303756827.pdb or /var/tmp/from_scwrl_303756827_b.pdb or /var/tmp/from_scwrl_303756827_a.pdb Error: no new SCWRL conformation added # 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 369 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1426548875.pdb -s /var/tmp/to_scwrl_1426548875.seq -o /var/tmp/from_scwrl_1426548875.pdb > /var/tmp/scwrl_1426548875.log sh: /var/tmp/scwrl_1426548875.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1426548875.pdb or /var/tmp/from_scwrl_1426548875.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1426548875_b.pdb or decoys//var/tmp/from_scwrl_1426548875_b.pdb.gz for input Trying /var/tmp/from_scwrl_1426548875_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1426548875_b.pdb or /var/tmp/from_scwrl_1426548875_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1426548875_a.pdb or decoys//var/tmp/from_scwrl_1426548875_a.pdb.gz for input Trying /var/tmp/from_scwrl_1426548875_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1426548875_a.pdb or /var/tmp/from_scwrl_1426548875_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1426548875.pdb or /var/tmp/from_scwrl_1426548875_b.pdb or /var/tmp/from_scwrl_1426548875_a.pdb Error: no new SCWRL conformation added # 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 362 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_510721305.pdb -s /var/tmp/to_scwrl_510721305.seq -o /var/tmp/from_scwrl_510721305.pdb > /var/tmp/scwrl_510721305.log sh: /var/tmp/scwrl_510721305.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_510721305.pdb or /var/tmp/from_scwrl_510721305.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_510721305_b.pdb or decoys//var/tmp/from_scwrl_510721305_b.pdb.gz for input Trying /var/tmp/from_scwrl_510721305_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_510721305_b.pdb or /var/tmp/from_scwrl_510721305_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_510721305_a.pdb or decoys//var/tmp/from_scwrl_510721305_a.pdb.gz for input Trying /var/tmp/from_scwrl_510721305_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_510721305_a.pdb or /var/tmp/from_scwrl_510721305_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_510721305.pdb or /var/tmp/from_scwrl_510721305_b.pdb or /var/tmp/from_scwrl_510721305_a.pdb Error: no new SCWRL conformation added # 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 372 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_2117816563.pdb -s /var/tmp/to_scwrl_2117816563.seq -o /var/tmp/from_scwrl_2117816563.pdb > /var/tmp/scwrl_2117816563.log sh: /var/tmp/scwrl_2117816563.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_2117816563.pdb or /var/tmp/from_scwrl_2117816563.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2117816563_b.pdb or decoys//var/tmp/from_scwrl_2117816563_b.pdb.gz for input Trying /var/tmp/from_scwrl_2117816563_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_2117816563_b.pdb or /var/tmp/from_scwrl_2117816563_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2117816563_a.pdb or decoys//var/tmp/from_scwrl_2117816563_a.pdb.gz for input Trying /var/tmp/from_scwrl_2117816563_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_2117816563_a.pdb or /var/tmp/from_scwrl_2117816563_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_2117816563.pdb or /var/tmp/from_scwrl_2117816563_b.pdb or /var/tmp/from_scwrl_2117816563_a.pdb Error: no new SCWRL conformation added # 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 361 # copying to AlignedFragments data structure # naming current conformation MetaTasser_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1746950811.pdb -s /var/tmp/to_scwrl_1746950811.seq -o /var/tmp/from_scwrl_1746950811.pdb > /var/tmp/scwrl_1746950811.log sh: /var/tmp/scwrl_1746950811.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1746950811.pdb or /var/tmp/from_scwrl_1746950811.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1746950811_b.pdb or decoys//var/tmp/from_scwrl_1746950811_b.pdb.gz for input Trying /var/tmp/from_scwrl_1746950811_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1746950811_b.pdb or /var/tmp/from_scwrl_1746950811_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1746950811_a.pdb or decoys//var/tmp/from_scwrl_1746950811_a.pdb.gz for input Trying /var/tmp/from_scwrl_1746950811_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1746950811_a.pdb or /var/tmp/from_scwrl_1746950811_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1746950811.pdb or /var/tmp/from_scwrl_1746950811_b.pdb or /var/tmp/from_scwrl_1746950811_a.pdb Error: no new SCWRL conformation added # naming current conformation MetaTasser_TS5-scwrl # ReadConformPDB reading from PDB file servers/NN_PUT_lab_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation NN_PUT_lab_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1552106237.pdb -s /var/tmp/to_scwrl_1552106237.seq -o /var/tmp/from_scwrl_1552106237.pdb > /var/tmp/scwrl_1552106237.log sh: /var/tmp/scwrl_1552106237.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1552106237.pdb or /var/tmp/from_scwrl_1552106237.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1552106237_b.pdb or decoys//var/tmp/from_scwrl_1552106237_b.pdb.gz for input Trying /var/tmp/from_scwrl_1552106237_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1552106237_b.pdb or /var/tmp/from_scwrl_1552106237_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1552106237_a.pdb or decoys//var/tmp/from_scwrl_1552106237_a.pdb.gz for input Trying /var/tmp/from_scwrl_1552106237_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1552106237_a.pdb or /var/tmp/from_scwrl_1552106237_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1552106237.pdb or /var/tmp/from_scwrl_1552106237_b.pdb or /var/tmp/from_scwrl_1552106237_a.pdb Error: no new SCWRL conformation added # naming current conformation NN_PUT_lab_TS1-scwrl # ReadConformPDB reading from PDB file servers/POMYSL_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation POMYSL_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1014709415.pdb -s /var/tmp/to_scwrl_1014709415.seq -o /var/tmp/from_scwrl_1014709415.pdb > /var/tmp/scwrl_1014709415.log sh: /var/tmp/scwrl_1014709415.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1014709415.pdb or /var/tmp/from_scwrl_1014709415.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1014709415_b.pdb or decoys//var/tmp/from_scwrl_1014709415_b.pdb.gz for input Trying /var/tmp/from_scwrl_1014709415_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1014709415_b.pdb or /var/tmp/from_scwrl_1014709415_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1014709415_a.pdb or decoys//var/tmp/from_scwrl_1014709415_a.pdb.gz for input Trying /var/tmp/from_scwrl_1014709415_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1014709415_a.pdb or /var/tmp/from_scwrl_1014709415_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1014709415.pdb or /var/tmp/from_scwrl_1014709415_b.pdb or /var/tmp/from_scwrl_1014709415_a.pdb Error: no new SCWRL conformation added # naming current conformation POMYSL_TS1-scwrl # ReadConformPDB reading from PDB file servers/POMYSL_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation POMYSL_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1456353069.pdb -s /var/tmp/to_scwrl_1456353069.seq -o /var/tmp/from_scwrl_1456353069.pdb > /var/tmp/scwrl_1456353069.log sh: /var/tmp/scwrl_1456353069.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1456353069.pdb or /var/tmp/from_scwrl_1456353069.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1456353069_b.pdb or decoys//var/tmp/from_scwrl_1456353069_b.pdb.gz for input Trying /var/tmp/from_scwrl_1456353069_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1456353069_b.pdb or /var/tmp/from_scwrl_1456353069_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1456353069_a.pdb or decoys//var/tmp/from_scwrl_1456353069_a.pdb.gz for input Trying /var/tmp/from_scwrl_1456353069_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1456353069_a.pdb or /var/tmp/from_scwrl_1456353069_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1456353069.pdb or /var/tmp/from_scwrl_1456353069_b.pdb or /var/tmp/from_scwrl_1456353069_a.pdb Error: no new SCWRL conformation added # naming current conformation POMYSL_TS2-scwrl # ReadConformPDB reading from PDB file servers/POMYSL_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation POMYSL_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_438873874.pdb -s /var/tmp/to_scwrl_438873874.seq -o /var/tmp/from_scwrl_438873874.pdb > /var/tmp/scwrl_438873874.log sh: /var/tmp/scwrl_438873874.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_438873874.pdb or /var/tmp/from_scwrl_438873874.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_438873874_b.pdb or decoys//var/tmp/from_scwrl_438873874_b.pdb.gz for input Trying /var/tmp/from_scwrl_438873874_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_438873874_b.pdb or /var/tmp/from_scwrl_438873874_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_438873874_a.pdb or decoys//var/tmp/from_scwrl_438873874_a.pdb.gz for input Trying /var/tmp/from_scwrl_438873874_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_438873874_a.pdb or /var/tmp/from_scwrl_438873874_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_438873874.pdb or /var/tmp/from_scwrl_438873874_b.pdb or /var/tmp/from_scwrl_438873874_a.pdb Error: no new SCWRL conformation added # naming current conformation POMYSL_TS3-scwrl # ReadConformPDB reading from PDB file servers/POMYSL_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation POMYSL_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_2018948154.pdb -s /var/tmp/to_scwrl_2018948154.seq -o /var/tmp/from_scwrl_2018948154.pdb > /var/tmp/scwrl_2018948154.log sh: /var/tmp/scwrl_2018948154.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_2018948154.pdb or /var/tmp/from_scwrl_2018948154.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2018948154_b.pdb or decoys//var/tmp/from_scwrl_2018948154_b.pdb.gz for input Trying /var/tmp/from_scwrl_2018948154_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_2018948154_b.pdb or /var/tmp/from_scwrl_2018948154_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2018948154_a.pdb or decoys//var/tmp/from_scwrl_2018948154_a.pdb.gz for input Trying /var/tmp/from_scwrl_2018948154_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_2018948154_a.pdb or /var/tmp/from_scwrl_2018948154_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_2018948154.pdb or /var/tmp/from_scwrl_2018948154_b.pdb or /var/tmp/from_scwrl_2018948154_a.pdb Error: no new SCWRL conformation added # naming current conformation POMYSL_TS4-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 336 ; scwrl3 -i /var/tmp/to_scwrl_754068879.pdb -s /var/tmp/to_scwrl_754068879.seq -o /var/tmp/from_scwrl_754068879.pdb > /var/tmp/scwrl_754068879.log sh: /var/tmp/scwrl_754068879.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_754068879.pdb or /var/tmp/from_scwrl_754068879.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_754068879_b.pdb or decoys//var/tmp/from_scwrl_754068879_b.pdb.gz for input Trying /var/tmp/from_scwrl_754068879_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_754068879_b.pdb or /var/tmp/from_scwrl_754068879_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_754068879_a.pdb or decoys//var/tmp/from_scwrl_754068879_a.pdb.gz for input Trying /var/tmp/from_scwrl_754068879_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_754068879_a.pdb or /var/tmp/from_scwrl_754068879_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_754068879.pdb or /var/tmp/from_scwrl_754068879_b.pdb or /var/tmp/from_scwrl_754068879_a.pdb Error: no new SCWRL conformation added # 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 336 ; scwrl3 -i /var/tmp/to_scwrl_606795475.pdb -s /var/tmp/to_scwrl_606795475.seq -o /var/tmp/from_scwrl_606795475.pdb > /var/tmp/scwrl_606795475.log sh: /var/tmp/scwrl_606795475.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_606795475.pdb or /var/tmp/from_scwrl_606795475.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_606795475_b.pdb or decoys//var/tmp/from_scwrl_606795475_b.pdb.gz for input Trying /var/tmp/from_scwrl_606795475_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_606795475_b.pdb or /var/tmp/from_scwrl_606795475_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_606795475_a.pdb or decoys//var/tmp/from_scwrl_606795475_a.pdb.gz for input Trying /var/tmp/from_scwrl_606795475_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_606795475_a.pdb or /var/tmp/from_scwrl_606795475_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_606795475.pdb or /var/tmp/from_scwrl_606795475_b.pdb or /var/tmp/from_scwrl_606795475_a.pdb Error: no new SCWRL conformation added # 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 336 ; scwrl3 -i /var/tmp/to_scwrl_325676368.pdb -s /var/tmp/to_scwrl_325676368.seq -o /var/tmp/from_scwrl_325676368.pdb > /var/tmp/scwrl_325676368.log sh: /var/tmp/scwrl_325676368.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_325676368.pdb or /var/tmp/from_scwrl_325676368.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_325676368_b.pdb or decoys//var/tmp/from_scwrl_325676368_b.pdb.gz for input Trying /var/tmp/from_scwrl_325676368_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_325676368_b.pdb or /var/tmp/from_scwrl_325676368_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_325676368_a.pdb or decoys//var/tmp/from_scwrl_325676368_a.pdb.gz for input Trying /var/tmp/from_scwrl_325676368_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_325676368_a.pdb or /var/tmp/from_scwrl_325676368_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_325676368.pdb or /var/tmp/from_scwrl_325676368_b.pdb or /var/tmp/from_scwrl_325676368_a.pdb Error: no new SCWRL conformation added # 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 336 ; scwrl3 -i /var/tmp/to_scwrl_1318008995.pdb -s /var/tmp/to_scwrl_1318008995.seq -o /var/tmp/from_scwrl_1318008995.pdb > /var/tmp/scwrl_1318008995.log sh: /var/tmp/scwrl_1318008995.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1318008995.pdb or /var/tmp/from_scwrl_1318008995.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1318008995_b.pdb or decoys//var/tmp/from_scwrl_1318008995_b.pdb.gz for input Trying /var/tmp/from_scwrl_1318008995_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1318008995_b.pdb or /var/tmp/from_scwrl_1318008995_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1318008995_a.pdb or decoys//var/tmp/from_scwrl_1318008995_a.pdb.gz for input Trying /var/tmp/from_scwrl_1318008995_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1318008995_a.pdb or /var/tmp/from_scwrl_1318008995_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1318008995.pdb or /var/tmp/from_scwrl_1318008995_b.pdb or /var/tmp/from_scwrl_1318008995_a.pdb Error: no new SCWRL conformation added # 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 336 ; scwrl3 -i /var/tmp/to_scwrl_809993685.pdb -s /var/tmp/to_scwrl_809993685.seq -o /var/tmp/from_scwrl_809993685.pdb > /var/tmp/scwrl_809993685.log sh: /var/tmp/scwrl_809993685.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_809993685.pdb or /var/tmp/from_scwrl_809993685.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_809993685_b.pdb or decoys//var/tmp/from_scwrl_809993685_b.pdb.gz for input Trying /var/tmp/from_scwrl_809993685_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_809993685_b.pdb or /var/tmp/from_scwrl_809993685_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_809993685_a.pdb or decoys//var/tmp/from_scwrl_809993685_a.pdb.gz for input Trying /var/tmp/from_scwrl_809993685_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_809993685_a.pdb or /var/tmp/from_scwrl_809993685_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_809993685.pdb or /var/tmp/from_scwrl_809993685_b.pdb or /var/tmp/from_scwrl_809993685_a.pdb Error: no new SCWRL conformation added # 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 338 # copying to AlignedFragments data structure # naming current conformation PROTINFO_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_67229549.pdb -s /var/tmp/to_scwrl_67229549.seq -o /var/tmp/from_scwrl_67229549.pdb > /var/tmp/scwrl_67229549.log sh: /var/tmp/scwrl_67229549.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_67229549.pdb or /var/tmp/from_scwrl_67229549.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_67229549_b.pdb or decoys//var/tmp/from_scwrl_67229549_b.pdb.gz for input Trying /var/tmp/from_scwrl_67229549_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_67229549_b.pdb or /var/tmp/from_scwrl_67229549_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_67229549_a.pdb or decoys//var/tmp/from_scwrl_67229549_a.pdb.gz for input Trying /var/tmp/from_scwrl_67229549_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_67229549_a.pdb or /var/tmp/from_scwrl_67229549_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_67229549.pdb or /var/tmp/from_scwrl_67229549_b.pdb or /var/tmp/from_scwrl_67229549_a.pdb Error: no new SCWRL conformation added # naming current conformation PROTINFO_TS1-scwrl # ReadConformPDB reading from PDB file servers/PROTINFO_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation PROTINFO_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_932042866.pdb -s /var/tmp/to_scwrl_932042866.seq -o /var/tmp/from_scwrl_932042866.pdb > /var/tmp/scwrl_932042866.log sh: /var/tmp/scwrl_932042866.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_932042866.pdb or /var/tmp/from_scwrl_932042866.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_932042866_b.pdb or decoys//var/tmp/from_scwrl_932042866_b.pdb.gz for input Trying /var/tmp/from_scwrl_932042866_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_932042866_b.pdb or /var/tmp/from_scwrl_932042866_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_932042866_a.pdb or decoys//var/tmp/from_scwrl_932042866_a.pdb.gz for input Trying /var/tmp/from_scwrl_932042866_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_932042866_a.pdb or /var/tmp/from_scwrl_932042866_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_932042866.pdb or /var/tmp/from_scwrl_932042866_b.pdb or /var/tmp/from_scwrl_932042866_a.pdb Error: no new SCWRL conformation added # 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 336 # copying to AlignedFragments data structure # naming current conformation PROTINFO_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1427561043.pdb -s /var/tmp/to_scwrl_1427561043.seq -o /var/tmp/from_scwrl_1427561043.pdb > /var/tmp/scwrl_1427561043.log sh: /var/tmp/scwrl_1427561043.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1427561043.pdb or /var/tmp/from_scwrl_1427561043.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1427561043_b.pdb or decoys//var/tmp/from_scwrl_1427561043_b.pdb.gz for input Trying /var/tmp/from_scwrl_1427561043_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1427561043_b.pdb or /var/tmp/from_scwrl_1427561043_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1427561043_a.pdb or decoys//var/tmp/from_scwrl_1427561043_a.pdb.gz for input Trying /var/tmp/from_scwrl_1427561043_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1427561043_a.pdb or /var/tmp/from_scwrl_1427561043_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1427561043.pdb or /var/tmp/from_scwrl_1427561043_b.pdb or /var/tmp/from_scwrl_1427561043_a.pdb Error: no new SCWRL conformation added # 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 341 # copying to AlignedFragments data structure # naming current conformation PROTINFO_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1282554830.pdb -s /var/tmp/to_scwrl_1282554830.seq -o /var/tmp/from_scwrl_1282554830.pdb > /var/tmp/scwrl_1282554830.log sh: /var/tmp/scwrl_1282554830.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1282554830.pdb or /var/tmp/from_scwrl_1282554830.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1282554830_b.pdb or decoys//var/tmp/from_scwrl_1282554830_b.pdb.gz for input Trying /var/tmp/from_scwrl_1282554830_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1282554830_b.pdb or /var/tmp/from_scwrl_1282554830_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1282554830_a.pdb or decoys//var/tmp/from_scwrl_1282554830_a.pdb.gz for input Trying /var/tmp/from_scwrl_1282554830_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1282554830_a.pdb or /var/tmp/from_scwrl_1282554830_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1282554830.pdb or /var/tmp/from_scwrl_1282554830_b.pdb or /var/tmp/from_scwrl_1282554830_a.pdb Error: no new SCWRL conformation added # 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 365 # copying to AlignedFragments data structure # naming current conformation PROTINFO_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1482711837.pdb -s /var/tmp/to_scwrl_1482711837.seq -o /var/tmp/from_scwrl_1482711837.pdb > /var/tmp/scwrl_1482711837.log sh: /var/tmp/scwrl_1482711837.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1482711837.pdb or /var/tmp/from_scwrl_1482711837.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1482711837_b.pdb or decoys//var/tmp/from_scwrl_1482711837_b.pdb.gz for input Trying /var/tmp/from_scwrl_1482711837_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1482711837_b.pdb or /var/tmp/from_scwrl_1482711837_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1482711837_a.pdb or decoys//var/tmp/from_scwrl_1482711837_a.pdb.gz for input Trying /var/tmp/from_scwrl_1482711837_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1482711837_a.pdb or /var/tmp/from_scwrl_1482711837_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1482711837.pdb or /var/tmp/from_scwrl_1482711837_b.pdb or /var/tmp/from_scwrl_1482711837_a.pdb Error: no new SCWRL conformation added # naming current conformation PROTINFO_TS5-scwrl # ReadConformPDB reading from PDB file servers/Pcons6_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation Pcons6_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1327063811.pdb -s /var/tmp/to_scwrl_1327063811.seq -o /var/tmp/from_scwrl_1327063811.pdb > /var/tmp/scwrl_1327063811.log sh: /var/tmp/scwrl_1327063811.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1327063811.pdb or /var/tmp/from_scwrl_1327063811.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1327063811_b.pdb or decoys//var/tmp/from_scwrl_1327063811_b.pdb.gz for input Trying /var/tmp/from_scwrl_1327063811_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1327063811_b.pdb or /var/tmp/from_scwrl_1327063811_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1327063811_a.pdb or decoys//var/tmp/from_scwrl_1327063811_a.pdb.gz for input Trying /var/tmp/from_scwrl_1327063811_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1327063811_a.pdb or /var/tmp/from_scwrl_1327063811_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1327063811.pdb or /var/tmp/from_scwrl_1327063811_b.pdb or /var/tmp/from_scwrl_1327063811_a.pdb Error: no new SCWRL conformation added # naming current conformation Pcons6_TS1-scwrl # ReadConformPDB reading from PDB file servers/Pcons6_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation Pcons6_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_2102323083.pdb -s /var/tmp/to_scwrl_2102323083.seq -o /var/tmp/from_scwrl_2102323083.pdb > /var/tmp/scwrl_2102323083.log sh: /var/tmp/scwrl_2102323083.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_2102323083.pdb or /var/tmp/from_scwrl_2102323083.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2102323083_b.pdb or decoys//var/tmp/from_scwrl_2102323083_b.pdb.gz for input Trying /var/tmp/from_scwrl_2102323083_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_2102323083_b.pdb or /var/tmp/from_scwrl_2102323083_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2102323083_a.pdb or decoys//var/tmp/from_scwrl_2102323083_a.pdb.gz for input Trying /var/tmp/from_scwrl_2102323083_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_2102323083_a.pdb or /var/tmp/from_scwrl_2102323083_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_2102323083.pdb or /var/tmp/from_scwrl_2102323083_b.pdb or /var/tmp/from_scwrl_2102323083_a.pdb Error: no new SCWRL conformation added # naming current conformation Pcons6_TS2-scwrl # ReadConformPDB reading from PDB file servers/Pcons6_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation Pcons6_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1035832594.pdb -s /var/tmp/to_scwrl_1035832594.seq -o /var/tmp/from_scwrl_1035832594.pdb > /var/tmp/scwrl_1035832594.log sh: /var/tmp/scwrl_1035832594.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1035832594.pdb or /var/tmp/from_scwrl_1035832594.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1035832594_b.pdb or decoys//var/tmp/from_scwrl_1035832594_b.pdb.gz for input Trying /var/tmp/from_scwrl_1035832594_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1035832594_b.pdb or /var/tmp/from_scwrl_1035832594_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1035832594_a.pdb or decoys//var/tmp/from_scwrl_1035832594_a.pdb.gz for input Trying /var/tmp/from_scwrl_1035832594_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1035832594_a.pdb or /var/tmp/from_scwrl_1035832594_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1035832594.pdb or /var/tmp/from_scwrl_1035832594_b.pdb or /var/tmp/from_scwrl_1035832594_a.pdb Error: no new SCWRL conformation added # naming current conformation Pcons6_TS3-scwrl # ReadConformPDB reading from PDB file servers/Pcons6_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation Pcons6_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1733997741.pdb -s /var/tmp/to_scwrl_1733997741.seq -o /var/tmp/from_scwrl_1733997741.pdb > /var/tmp/scwrl_1733997741.log sh: /var/tmp/scwrl_1733997741.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1733997741.pdb or /var/tmp/from_scwrl_1733997741.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1733997741_b.pdb or decoys//var/tmp/from_scwrl_1733997741_b.pdb.gz for input Trying /var/tmp/from_scwrl_1733997741_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1733997741_b.pdb or /var/tmp/from_scwrl_1733997741_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1733997741_a.pdb or decoys//var/tmp/from_scwrl_1733997741_a.pdb.gz for input Trying /var/tmp/from_scwrl_1733997741_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1733997741_a.pdb or /var/tmp/from_scwrl_1733997741_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1733997741.pdb or /var/tmp/from_scwrl_1733997741_b.pdb or /var/tmp/from_scwrl_1733997741_a.pdb Error: no new SCWRL conformation added # 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 360 # copying to AlignedFragments data structure # naming current conformation Pcons6_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1851078097.pdb -s /var/tmp/to_scwrl_1851078097.seq -o /var/tmp/from_scwrl_1851078097.pdb > /var/tmp/scwrl_1851078097.log sh: /var/tmp/scwrl_1851078097.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1851078097.pdb or /var/tmp/from_scwrl_1851078097.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1851078097_b.pdb or decoys//var/tmp/from_scwrl_1851078097_b.pdb.gz for input Trying /var/tmp/from_scwrl_1851078097_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1851078097_b.pdb or /var/tmp/from_scwrl_1851078097_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1851078097_a.pdb or decoys//var/tmp/from_scwrl_1851078097_a.pdb.gz for input Trying /var/tmp/from_scwrl_1851078097_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1851078097_a.pdb or /var/tmp/from_scwrl_1851078097_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1851078097.pdb or /var/tmp/from_scwrl_1851078097_b.pdb or /var/tmp/from_scwrl_1851078097_a.pdb Error: no new SCWRL conformation added # naming current conformation Pcons6_TS5-scwrl # ReadConformPDB reading from PDB file servers/Phyre-1_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation Phyre-1_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_924841357.pdb -s /var/tmp/to_scwrl_924841357.seq -o /var/tmp/from_scwrl_924841357.pdb > /var/tmp/scwrl_924841357.log sh: /var/tmp/scwrl_924841357.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_924841357.pdb or /var/tmp/from_scwrl_924841357.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_924841357_b.pdb or decoys//var/tmp/from_scwrl_924841357_b.pdb.gz for input Trying /var/tmp/from_scwrl_924841357_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_924841357_b.pdb or /var/tmp/from_scwrl_924841357_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_924841357_a.pdb or decoys//var/tmp/from_scwrl_924841357_a.pdb.gz for input Trying /var/tmp/from_scwrl_924841357_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_924841357_a.pdb or /var/tmp/from_scwrl_924841357_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_924841357.pdb or /var/tmp/from_scwrl_924841357_b.pdb or /var/tmp/from_scwrl_924841357_a.pdb Error: no new SCWRL conformation added # naming current conformation Phyre-1_TS1-scwrl # ReadConformPDB reading from PDB file servers/Phyre-2_TS1.pdb.gz looking for model 1 # Found a chain break before 358 # copying to AlignedFragments data structure # naming current conformation Phyre-2_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1968850948.pdb -s /var/tmp/to_scwrl_1968850948.seq -o /var/tmp/from_scwrl_1968850948.pdb > /var/tmp/scwrl_1968850948.log sh: /var/tmp/scwrl_1968850948.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1968850948.pdb or /var/tmp/from_scwrl_1968850948.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1968850948_b.pdb or decoys//var/tmp/from_scwrl_1968850948_b.pdb.gz for input Trying /var/tmp/from_scwrl_1968850948_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1968850948_b.pdb or /var/tmp/from_scwrl_1968850948_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1968850948_a.pdb or decoys//var/tmp/from_scwrl_1968850948_a.pdb.gz for input Trying /var/tmp/from_scwrl_1968850948_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1968850948_a.pdb or /var/tmp/from_scwrl_1968850948_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1968850948.pdb or /var/tmp/from_scwrl_1968850948_b.pdb or /var/tmp/from_scwrl_1968850948_a.pdb Error: no new SCWRL conformation added # naming current conformation Phyre-2_TS1-scwrl # ReadConformPDB reading from PDB file servers/Phyre-2_TS2.pdb.gz looking for model 1 # Found a chain break before 329 # copying to AlignedFragments data structure # naming current conformation Phyre-2_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1938182383.pdb -s /var/tmp/to_scwrl_1938182383.seq -o /var/tmp/from_scwrl_1938182383.pdb > /var/tmp/scwrl_1938182383.log sh: /var/tmp/scwrl_1938182383.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1938182383.pdb or /var/tmp/from_scwrl_1938182383.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1938182383_b.pdb or decoys//var/tmp/from_scwrl_1938182383_b.pdb.gz for input Trying /var/tmp/from_scwrl_1938182383_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1938182383_b.pdb or /var/tmp/from_scwrl_1938182383_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1938182383_a.pdb or decoys//var/tmp/from_scwrl_1938182383_a.pdb.gz for input Trying /var/tmp/from_scwrl_1938182383_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1938182383_a.pdb or /var/tmp/from_scwrl_1938182383_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1938182383.pdb or /var/tmp/from_scwrl_1938182383_b.pdb or /var/tmp/from_scwrl_1938182383_a.pdb Error: no new SCWRL conformation added # naming current conformation Phyre-2_TS2-scwrl # ReadConformPDB reading from PDB file servers/Phyre-2_TS3.pdb.gz looking for model 1 # Found a chain break before 367 # copying to AlignedFragments data structure # naming current conformation Phyre-2_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_895345833.pdb -s /var/tmp/to_scwrl_895345833.seq -o /var/tmp/from_scwrl_895345833.pdb > /var/tmp/scwrl_895345833.log sh: /var/tmp/scwrl_895345833.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_895345833.pdb or /var/tmp/from_scwrl_895345833.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_895345833_b.pdb or decoys//var/tmp/from_scwrl_895345833_b.pdb.gz for input Trying /var/tmp/from_scwrl_895345833_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_895345833_b.pdb or /var/tmp/from_scwrl_895345833_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_895345833_a.pdb or decoys//var/tmp/from_scwrl_895345833_a.pdb.gz for input Trying /var/tmp/from_scwrl_895345833_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_895345833_a.pdb or /var/tmp/from_scwrl_895345833_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_895345833.pdb or /var/tmp/from_scwrl_895345833_b.pdb or /var/tmp/from_scwrl_895345833_a.pdb Error: no new SCWRL conformation added # naming current conformation Phyre-2_TS3-scwrl # ReadConformPDB reading from PDB file servers/Phyre-2_TS4.pdb.gz looking for model 1 # Found a chain break before 334 # copying to AlignedFragments data structure # naming current conformation Phyre-2_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_515367186.pdb -s /var/tmp/to_scwrl_515367186.seq -o /var/tmp/from_scwrl_515367186.pdb > /var/tmp/scwrl_515367186.log sh: /var/tmp/scwrl_515367186.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_515367186.pdb or /var/tmp/from_scwrl_515367186.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_515367186_b.pdb or decoys//var/tmp/from_scwrl_515367186_b.pdb.gz for input Trying /var/tmp/from_scwrl_515367186_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_515367186_b.pdb or /var/tmp/from_scwrl_515367186_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_515367186_a.pdb or decoys//var/tmp/from_scwrl_515367186_a.pdb.gz for input Trying /var/tmp/from_scwrl_515367186_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_515367186_a.pdb or /var/tmp/from_scwrl_515367186_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_515367186.pdb or /var/tmp/from_scwrl_515367186_b.pdb or /var/tmp/from_scwrl_515367186_a.pdb Error: no new SCWRL conformation added # naming current conformation Phyre-2_TS4-scwrl # ReadConformPDB reading from PDB file servers/Phyre-2_TS5.pdb.gz looking for model 1 # Found a chain break before 365 # copying to AlignedFragments data structure # naming current conformation Phyre-2_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1857948479.pdb -s /var/tmp/to_scwrl_1857948479.seq -o /var/tmp/from_scwrl_1857948479.pdb > /var/tmp/scwrl_1857948479.log sh: /var/tmp/scwrl_1857948479.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1857948479.pdb or /var/tmp/from_scwrl_1857948479.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1857948479_b.pdb or decoys//var/tmp/from_scwrl_1857948479_b.pdb.gz for input Trying /var/tmp/from_scwrl_1857948479_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1857948479_b.pdb or /var/tmp/from_scwrl_1857948479_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1857948479_a.pdb or decoys//var/tmp/from_scwrl_1857948479_a.pdb.gz for input Trying /var/tmp/from_scwrl_1857948479_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1857948479_a.pdb or /var/tmp/from_scwrl_1857948479_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1857948479.pdb or /var/tmp/from_scwrl_1857948479_b.pdb or /var/tmp/from_scwrl_1857948479_a.pdb Error: no new SCWRL conformation added # naming current conformation Phyre-2_TS5-scwrl # ReadConformPDB reading from PDB file servers/Pmodeller6_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation Pmodeller6_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1199102659.pdb -s /var/tmp/to_scwrl_1199102659.seq -o /var/tmp/from_scwrl_1199102659.pdb > /var/tmp/scwrl_1199102659.log sh: /var/tmp/scwrl_1199102659.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1199102659.pdb or /var/tmp/from_scwrl_1199102659.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1199102659_b.pdb or decoys//var/tmp/from_scwrl_1199102659_b.pdb.gz for input Trying /var/tmp/from_scwrl_1199102659_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1199102659_b.pdb or /var/tmp/from_scwrl_1199102659_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1199102659_a.pdb or decoys//var/tmp/from_scwrl_1199102659_a.pdb.gz for input Trying /var/tmp/from_scwrl_1199102659_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1199102659_a.pdb or /var/tmp/from_scwrl_1199102659_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1199102659.pdb or /var/tmp/from_scwrl_1199102659_b.pdb or /var/tmp/from_scwrl_1199102659_a.pdb Error: no new SCWRL conformation added # naming current conformation Pmodeller6_TS1-scwrl # ReadConformPDB reading from PDB file servers/Pmodeller6_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation Pmodeller6_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1941916061.pdb -s /var/tmp/to_scwrl_1941916061.seq -o /var/tmp/from_scwrl_1941916061.pdb > /var/tmp/scwrl_1941916061.log sh: /var/tmp/scwrl_1941916061.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1941916061.pdb or /var/tmp/from_scwrl_1941916061.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1941916061_b.pdb or decoys//var/tmp/from_scwrl_1941916061_b.pdb.gz for input Trying /var/tmp/from_scwrl_1941916061_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1941916061_b.pdb or /var/tmp/from_scwrl_1941916061_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1941916061_a.pdb or decoys//var/tmp/from_scwrl_1941916061_a.pdb.gz for input Trying /var/tmp/from_scwrl_1941916061_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1941916061_a.pdb or /var/tmp/from_scwrl_1941916061_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1941916061.pdb or /var/tmp/from_scwrl_1941916061_b.pdb or /var/tmp/from_scwrl_1941916061_a.pdb Error: no new SCWRL conformation added # naming current conformation Pmodeller6_TS2-scwrl # ReadConformPDB reading from PDB file servers/Pmodeller6_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation Pmodeller6_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_221186137.pdb -s /var/tmp/to_scwrl_221186137.seq -o /var/tmp/from_scwrl_221186137.pdb > /var/tmp/scwrl_221186137.log sh: /var/tmp/scwrl_221186137.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_221186137.pdb or /var/tmp/from_scwrl_221186137.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_221186137_b.pdb or decoys//var/tmp/from_scwrl_221186137_b.pdb.gz for input Trying /var/tmp/from_scwrl_221186137_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_221186137_b.pdb or /var/tmp/from_scwrl_221186137_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_221186137_a.pdb or decoys//var/tmp/from_scwrl_221186137_a.pdb.gz for input Trying /var/tmp/from_scwrl_221186137_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_221186137_a.pdb or /var/tmp/from_scwrl_221186137_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_221186137.pdb or /var/tmp/from_scwrl_221186137_b.pdb or /var/tmp/from_scwrl_221186137_a.pdb Error: no new SCWRL conformation added # naming current conformation Pmodeller6_TS3-scwrl # ReadConformPDB reading from PDB file servers/Pmodeller6_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation Pmodeller6_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1169435575.pdb -s /var/tmp/to_scwrl_1169435575.seq -o /var/tmp/from_scwrl_1169435575.pdb > /var/tmp/scwrl_1169435575.log sh: /var/tmp/scwrl_1169435575.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1169435575.pdb or /var/tmp/from_scwrl_1169435575.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1169435575_b.pdb or decoys//var/tmp/from_scwrl_1169435575_b.pdb.gz for input Trying /var/tmp/from_scwrl_1169435575_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1169435575_b.pdb or /var/tmp/from_scwrl_1169435575_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1169435575_a.pdb or decoys//var/tmp/from_scwrl_1169435575_a.pdb.gz for input Trying /var/tmp/from_scwrl_1169435575_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1169435575_a.pdb or /var/tmp/from_scwrl_1169435575_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1169435575.pdb or /var/tmp/from_scwrl_1169435575_b.pdb or /var/tmp/from_scwrl_1169435575_a.pdb Error: no new SCWRL conformation added # naming current conformation Pmodeller6_TS4-scwrl # ReadConformPDB reading from PDB file servers/Pmodeller6_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation Pmodeller6_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1541383226.pdb -s /var/tmp/to_scwrl_1541383226.seq -o /var/tmp/from_scwrl_1541383226.pdb > /var/tmp/scwrl_1541383226.log sh: /var/tmp/scwrl_1541383226.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1541383226.pdb or /var/tmp/from_scwrl_1541383226.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1541383226_b.pdb or decoys//var/tmp/from_scwrl_1541383226_b.pdb.gz for input Trying /var/tmp/from_scwrl_1541383226_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1541383226_b.pdb or /var/tmp/from_scwrl_1541383226_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1541383226_a.pdb or decoys//var/tmp/from_scwrl_1541383226_a.pdb.gz for input Trying /var/tmp/from_scwrl_1541383226_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1541383226_a.pdb or /var/tmp/from_scwrl_1541383226_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1541383226.pdb or /var/tmp/from_scwrl_1541383226_b.pdb or /var/tmp/from_scwrl_1541383226_a.pdb Error: no new SCWRL conformation added # 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 340 # copying to AlignedFragments data structure # naming current conformation RAPTOR-ACE_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1773292374.pdb -s /var/tmp/to_scwrl_1773292374.seq -o /var/tmp/from_scwrl_1773292374.pdb > /var/tmp/scwrl_1773292374.log sh: /var/tmp/scwrl_1773292374.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1773292374.pdb or /var/tmp/from_scwrl_1773292374.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1773292374_b.pdb or decoys//var/tmp/from_scwrl_1773292374_b.pdb.gz for input Trying /var/tmp/from_scwrl_1773292374_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1773292374_b.pdb or /var/tmp/from_scwrl_1773292374_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1773292374_a.pdb or decoys//var/tmp/from_scwrl_1773292374_a.pdb.gz for input Trying /var/tmp/from_scwrl_1773292374_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1773292374_a.pdb or /var/tmp/from_scwrl_1773292374_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1773292374.pdb or /var/tmp/from_scwrl_1773292374_b.pdb or /var/tmp/from_scwrl_1773292374_a.pdb Error: no new SCWRL conformation added # 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 219 # copying to AlignedFragments data structure # naming current conformation RAPTOR-ACE_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_36661343.pdb -s /var/tmp/to_scwrl_36661343.seq -o /var/tmp/from_scwrl_36661343.pdb > /var/tmp/scwrl_36661343.log sh: /var/tmp/scwrl_36661343.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_36661343.pdb or /var/tmp/from_scwrl_36661343.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_36661343_b.pdb or decoys//var/tmp/from_scwrl_36661343_b.pdb.gz for input Trying /var/tmp/from_scwrl_36661343_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_36661343_b.pdb or /var/tmp/from_scwrl_36661343_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_36661343_a.pdb or decoys//var/tmp/from_scwrl_36661343_a.pdb.gz for input Trying /var/tmp/from_scwrl_36661343_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_36661343_a.pdb or /var/tmp/from_scwrl_36661343_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_36661343.pdb or /var/tmp/from_scwrl_36661343_b.pdb or /var/tmp/from_scwrl_36661343_a.pdb Error: no new SCWRL conformation added # naming current conformation RAPTOR-ACE_TS2-scwrl # ReadConformPDB reading from PDB file servers/RAPTOR-ACE_TS3.pdb.gz looking for model 1 # naming current conformation RAPTOR-ACE_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_850252649.pdb -s /var/tmp/to_scwrl_850252649.seq -o /var/tmp/from_scwrl_850252649.pdb > /var/tmp/scwrl_850252649.log sh: /var/tmp/scwrl_850252649.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_850252649.pdb or /var/tmp/from_scwrl_850252649.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_850252649_b.pdb or decoys//var/tmp/from_scwrl_850252649_b.pdb.gz for input Trying /var/tmp/from_scwrl_850252649_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_850252649_b.pdb or /var/tmp/from_scwrl_850252649_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_850252649_a.pdb or decoys//var/tmp/from_scwrl_850252649_a.pdb.gz for input Trying /var/tmp/from_scwrl_850252649_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_850252649_a.pdb or /var/tmp/from_scwrl_850252649_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_850252649.pdb or /var/tmp/from_scwrl_850252649_b.pdb or /var/tmp/from_scwrl_850252649_a.pdb Error: no new SCWRL conformation added # 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 317 # copying to AlignedFragments data structure # naming current conformation RAPTOR-ACE_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_64682601.pdb -s /var/tmp/to_scwrl_64682601.seq -o /var/tmp/from_scwrl_64682601.pdb > /var/tmp/scwrl_64682601.log sh: /var/tmp/scwrl_64682601.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_64682601.pdb or /var/tmp/from_scwrl_64682601.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_64682601_b.pdb or decoys//var/tmp/from_scwrl_64682601_b.pdb.gz for input Trying /var/tmp/from_scwrl_64682601_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_64682601_b.pdb or /var/tmp/from_scwrl_64682601_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_64682601_a.pdb or decoys//var/tmp/from_scwrl_64682601_a.pdb.gz for input Trying /var/tmp/from_scwrl_64682601_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_64682601_a.pdb or /var/tmp/from_scwrl_64682601_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_64682601.pdb or /var/tmp/from_scwrl_64682601_b.pdb or /var/tmp/from_scwrl_64682601_a.pdb Error: no new SCWRL conformation added # 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 293 # copying to AlignedFragments data structure # naming current conformation RAPTOR-ACE_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_2055609498.pdb -s /var/tmp/to_scwrl_2055609498.seq -o /var/tmp/from_scwrl_2055609498.pdb > /var/tmp/scwrl_2055609498.log sh: /var/tmp/scwrl_2055609498.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_2055609498.pdb or /var/tmp/from_scwrl_2055609498.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2055609498_b.pdb or decoys//var/tmp/from_scwrl_2055609498_b.pdb.gz for input Trying /var/tmp/from_scwrl_2055609498_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_2055609498_b.pdb or /var/tmp/from_scwrl_2055609498_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2055609498_a.pdb or decoys//var/tmp/from_scwrl_2055609498_a.pdb.gz for input Trying /var/tmp/from_scwrl_2055609498_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_2055609498_a.pdb or /var/tmp/from_scwrl_2055609498_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_2055609498.pdb or /var/tmp/from_scwrl_2055609498_b.pdb or /var/tmp/from_scwrl_2055609498_a.pdb Error: no new SCWRL conformation added # 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 372 # copying to AlignedFragments data structure # naming current conformation RAPTORESS_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1604321527.pdb -s /var/tmp/to_scwrl_1604321527.seq -o /var/tmp/from_scwrl_1604321527.pdb > /var/tmp/scwrl_1604321527.log sh: /var/tmp/scwrl_1604321527.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1604321527.pdb or /var/tmp/from_scwrl_1604321527.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1604321527_b.pdb or decoys//var/tmp/from_scwrl_1604321527_b.pdb.gz for input Trying /var/tmp/from_scwrl_1604321527_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1604321527_b.pdb or /var/tmp/from_scwrl_1604321527_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1604321527_a.pdb or decoys//var/tmp/from_scwrl_1604321527_a.pdb.gz for input Trying /var/tmp/from_scwrl_1604321527_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1604321527_a.pdb or /var/tmp/from_scwrl_1604321527_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1604321527.pdb or /var/tmp/from_scwrl_1604321527_b.pdb or /var/tmp/from_scwrl_1604321527_a.pdb Error: no new SCWRL conformation added # 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 371 # copying to AlignedFragments data structure # naming current conformation RAPTORESS_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_671478076.pdb -s /var/tmp/to_scwrl_671478076.seq -o /var/tmp/from_scwrl_671478076.pdb > /var/tmp/scwrl_671478076.log sh: /var/tmp/scwrl_671478076.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_671478076.pdb or /var/tmp/from_scwrl_671478076.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_671478076_b.pdb or decoys//var/tmp/from_scwrl_671478076_b.pdb.gz for input Trying /var/tmp/from_scwrl_671478076_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_671478076_b.pdb or /var/tmp/from_scwrl_671478076_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_671478076_a.pdb or decoys//var/tmp/from_scwrl_671478076_a.pdb.gz for input Trying /var/tmp/from_scwrl_671478076_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_671478076_a.pdb or /var/tmp/from_scwrl_671478076_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_671478076.pdb or /var/tmp/from_scwrl_671478076_b.pdb or /var/tmp/from_scwrl_671478076_a.pdb Error: no new SCWRL conformation added # 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 360 # copying to AlignedFragments data structure # naming current conformation RAPTORESS_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_233802219.pdb -s /var/tmp/to_scwrl_233802219.seq -o /var/tmp/from_scwrl_233802219.pdb > /var/tmp/scwrl_233802219.log sh: /var/tmp/scwrl_233802219.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_233802219.pdb or /var/tmp/from_scwrl_233802219.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_233802219_b.pdb or decoys//var/tmp/from_scwrl_233802219_b.pdb.gz for input Trying /var/tmp/from_scwrl_233802219_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_233802219_b.pdb or /var/tmp/from_scwrl_233802219_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_233802219_a.pdb or decoys//var/tmp/from_scwrl_233802219_a.pdb.gz for input Trying /var/tmp/from_scwrl_233802219_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_233802219_a.pdb or /var/tmp/from_scwrl_233802219_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_233802219.pdb or /var/tmp/from_scwrl_233802219_b.pdb or /var/tmp/from_scwrl_233802219_a.pdb Error: no new SCWRL conformation added # 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 365 # copying to AlignedFragments data structure # naming current conformation RAPTORESS_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_774846876.pdb -s /var/tmp/to_scwrl_774846876.seq -o /var/tmp/from_scwrl_774846876.pdb > /var/tmp/scwrl_774846876.log sh: /var/tmp/scwrl_774846876.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_774846876.pdb or /var/tmp/from_scwrl_774846876.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_774846876_b.pdb or decoys//var/tmp/from_scwrl_774846876_b.pdb.gz for input Trying /var/tmp/from_scwrl_774846876_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_774846876_b.pdb or /var/tmp/from_scwrl_774846876_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_774846876_a.pdb or decoys//var/tmp/from_scwrl_774846876_a.pdb.gz for input Trying /var/tmp/from_scwrl_774846876_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_774846876_a.pdb or /var/tmp/from_scwrl_774846876_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_774846876.pdb or /var/tmp/from_scwrl_774846876_b.pdb or /var/tmp/from_scwrl_774846876_a.pdb Error: no new SCWRL conformation added # 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 341 # copying to AlignedFragments data structure # naming current conformation RAPTORESS_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1481471760.pdb -s /var/tmp/to_scwrl_1481471760.seq -o /var/tmp/from_scwrl_1481471760.pdb > /var/tmp/scwrl_1481471760.log sh: /var/tmp/scwrl_1481471760.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1481471760.pdb or /var/tmp/from_scwrl_1481471760.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1481471760_b.pdb or decoys//var/tmp/from_scwrl_1481471760_b.pdb.gz for input Trying /var/tmp/from_scwrl_1481471760_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1481471760_b.pdb or /var/tmp/from_scwrl_1481471760_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1481471760_a.pdb or decoys//var/tmp/from_scwrl_1481471760_a.pdb.gz for input Trying /var/tmp/from_scwrl_1481471760_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1481471760_a.pdb or /var/tmp/from_scwrl_1481471760_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1481471760.pdb or /var/tmp/from_scwrl_1481471760_b.pdb or /var/tmp/from_scwrl_1481471760_a.pdb Error: no new SCWRL conformation added # 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 369 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_301031769.pdb -s /var/tmp/to_scwrl_301031769.seq -o /var/tmp/from_scwrl_301031769.pdb > /var/tmp/scwrl_301031769.log sh: /var/tmp/scwrl_301031769.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_301031769.pdb or /var/tmp/from_scwrl_301031769.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_301031769_b.pdb or decoys//var/tmp/from_scwrl_301031769_b.pdb.gz for input Trying /var/tmp/from_scwrl_301031769_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_301031769_b.pdb or /var/tmp/from_scwrl_301031769_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_301031769_a.pdb or decoys//var/tmp/from_scwrl_301031769_a.pdb.gz for input Trying /var/tmp/from_scwrl_301031769_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_301031769_a.pdb or /var/tmp/from_scwrl_301031769_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_301031769.pdb or /var/tmp/from_scwrl_301031769_b.pdb or /var/tmp/from_scwrl_301031769_a.pdb Error: no new SCWRL conformation added # 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 341 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1706889741.pdb -s /var/tmp/to_scwrl_1706889741.seq -o /var/tmp/from_scwrl_1706889741.pdb > /var/tmp/scwrl_1706889741.log sh: /var/tmp/scwrl_1706889741.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1706889741.pdb or /var/tmp/from_scwrl_1706889741.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1706889741_b.pdb or decoys//var/tmp/from_scwrl_1706889741_b.pdb.gz for input Trying /var/tmp/from_scwrl_1706889741_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1706889741_b.pdb or /var/tmp/from_scwrl_1706889741_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1706889741_a.pdb or decoys//var/tmp/from_scwrl_1706889741_a.pdb.gz for input Trying /var/tmp/from_scwrl_1706889741_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1706889741_a.pdb or /var/tmp/from_scwrl_1706889741_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1706889741.pdb or /var/tmp/from_scwrl_1706889741_b.pdb or /var/tmp/from_scwrl_1706889741_a.pdb Error: no new SCWRL conformation added # 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 360 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_761549158.pdb -s /var/tmp/to_scwrl_761549158.seq -o /var/tmp/from_scwrl_761549158.pdb > /var/tmp/scwrl_761549158.log sh: /var/tmp/scwrl_761549158.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_761549158.pdb or /var/tmp/from_scwrl_761549158.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_761549158_b.pdb or decoys//var/tmp/from_scwrl_761549158_b.pdb.gz for input Trying /var/tmp/from_scwrl_761549158_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_761549158_b.pdb or /var/tmp/from_scwrl_761549158_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_761549158_a.pdb or decoys//var/tmp/from_scwrl_761549158_a.pdb.gz for input Trying /var/tmp/from_scwrl_761549158_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_761549158_a.pdb or /var/tmp/from_scwrl_761549158_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_761549158.pdb or /var/tmp/from_scwrl_761549158_b.pdb or /var/tmp/from_scwrl_761549158_a.pdb Error: no new SCWRL conformation added # 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 364 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1583586599.pdb -s /var/tmp/to_scwrl_1583586599.seq -o /var/tmp/from_scwrl_1583586599.pdb > /var/tmp/scwrl_1583586599.log sh: /var/tmp/scwrl_1583586599.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1583586599.pdb or /var/tmp/from_scwrl_1583586599.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1583586599_b.pdb or decoys//var/tmp/from_scwrl_1583586599_b.pdb.gz for input Trying /var/tmp/from_scwrl_1583586599_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1583586599_b.pdb or /var/tmp/from_scwrl_1583586599_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1583586599_a.pdb or decoys//var/tmp/from_scwrl_1583586599_a.pdb.gz for input Trying /var/tmp/from_scwrl_1583586599_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1583586599_a.pdb or /var/tmp/from_scwrl_1583586599_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1583586599.pdb or /var/tmp/from_scwrl_1583586599_b.pdb or /var/tmp/from_scwrl_1583586599_a.pdb Error: no new SCWRL conformation added # 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 339 # copying to AlignedFragments data structure # naming current conformation RAPTOR_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1042117932.pdb -s /var/tmp/to_scwrl_1042117932.seq -o /var/tmp/from_scwrl_1042117932.pdb > /var/tmp/scwrl_1042117932.log sh: /var/tmp/scwrl_1042117932.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1042117932.pdb or /var/tmp/from_scwrl_1042117932.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1042117932_b.pdb or decoys//var/tmp/from_scwrl_1042117932_b.pdb.gz for input Trying /var/tmp/from_scwrl_1042117932_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1042117932_b.pdb or /var/tmp/from_scwrl_1042117932_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1042117932_a.pdb or decoys//var/tmp/from_scwrl_1042117932_a.pdb.gz for input Trying /var/tmp/from_scwrl_1042117932_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1042117932_a.pdb or /var/tmp/from_scwrl_1042117932_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1042117932.pdb or /var/tmp/from_scwrl_1042117932_b.pdb or /var/tmp/from_scwrl_1042117932_a.pdb Error: no new SCWRL conformation added # 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 293 # copying to AlignedFragments data structure # naming current conformation ROBETTA_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_2088612969.pdb -s /var/tmp/to_scwrl_2088612969.seq -o /var/tmp/from_scwrl_2088612969.pdb > /var/tmp/scwrl_2088612969.log sh: /var/tmp/scwrl_2088612969.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_2088612969.pdb or /var/tmp/from_scwrl_2088612969.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2088612969_b.pdb or decoys//var/tmp/from_scwrl_2088612969_b.pdb.gz for input Trying /var/tmp/from_scwrl_2088612969_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_2088612969_b.pdb or /var/tmp/from_scwrl_2088612969_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2088612969_a.pdb or decoys//var/tmp/from_scwrl_2088612969_a.pdb.gz for input Trying /var/tmp/from_scwrl_2088612969_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_2088612969_a.pdb or /var/tmp/from_scwrl_2088612969_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_2088612969.pdb or /var/tmp/from_scwrl_2088612969_b.pdb or /var/tmp/from_scwrl_2088612969_a.pdb Error: no new SCWRL conformation added # 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 339 # copying to AlignedFragments data structure # naming current conformation ROBETTA_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1538426035.pdb -s /var/tmp/to_scwrl_1538426035.seq -o /var/tmp/from_scwrl_1538426035.pdb > /var/tmp/scwrl_1538426035.log sh: /var/tmp/scwrl_1538426035.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1538426035.pdb or /var/tmp/from_scwrl_1538426035.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1538426035_b.pdb or decoys//var/tmp/from_scwrl_1538426035_b.pdb.gz for input Trying /var/tmp/from_scwrl_1538426035_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1538426035_b.pdb or /var/tmp/from_scwrl_1538426035_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1538426035_a.pdb or decoys//var/tmp/from_scwrl_1538426035_a.pdb.gz for input Trying /var/tmp/from_scwrl_1538426035_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1538426035_a.pdb or /var/tmp/from_scwrl_1538426035_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1538426035.pdb or /var/tmp/from_scwrl_1538426035_b.pdb or /var/tmp/from_scwrl_1538426035_a.pdb Error: no new SCWRL conformation added # 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 345 # copying to AlignedFragments data structure # naming current conformation ROBETTA_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_2077950526.pdb -s /var/tmp/to_scwrl_2077950526.seq -o /var/tmp/from_scwrl_2077950526.pdb > /var/tmp/scwrl_2077950526.log sh: /var/tmp/scwrl_2077950526.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_2077950526.pdb or /var/tmp/from_scwrl_2077950526.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2077950526_b.pdb or decoys//var/tmp/from_scwrl_2077950526_b.pdb.gz for input Trying /var/tmp/from_scwrl_2077950526_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_2077950526_b.pdb or /var/tmp/from_scwrl_2077950526_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2077950526_a.pdb or decoys//var/tmp/from_scwrl_2077950526_a.pdb.gz for input Trying /var/tmp/from_scwrl_2077950526_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_2077950526_a.pdb or /var/tmp/from_scwrl_2077950526_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_2077950526.pdb or /var/tmp/from_scwrl_2077950526_b.pdb or /var/tmp/from_scwrl_2077950526_a.pdb Error: no new SCWRL conformation added # 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 271 # copying to AlignedFragments data structure # naming current conformation ROBETTA_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1675127063.pdb -s /var/tmp/to_scwrl_1675127063.seq -o /var/tmp/from_scwrl_1675127063.pdb > /var/tmp/scwrl_1675127063.log sh: /var/tmp/scwrl_1675127063.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1675127063.pdb or /var/tmp/from_scwrl_1675127063.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1675127063_b.pdb or decoys//var/tmp/from_scwrl_1675127063_b.pdb.gz for input Trying /var/tmp/from_scwrl_1675127063_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1675127063_b.pdb or /var/tmp/from_scwrl_1675127063_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1675127063_a.pdb or decoys//var/tmp/from_scwrl_1675127063_a.pdb.gz for input Trying /var/tmp/from_scwrl_1675127063_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1675127063_a.pdb or /var/tmp/from_scwrl_1675127063_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1675127063.pdb or /var/tmp/from_scwrl_1675127063_b.pdb or /var/tmp/from_scwrl_1675127063_a.pdb Error: no new SCWRL conformation added # 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 305 # copying to AlignedFragments data structure # naming current conformation ROBETTA_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1242020486.pdb -s /var/tmp/to_scwrl_1242020486.seq -o /var/tmp/from_scwrl_1242020486.pdb > /var/tmp/scwrl_1242020486.log sh: /var/tmp/scwrl_1242020486.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1242020486.pdb or /var/tmp/from_scwrl_1242020486.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1242020486_b.pdb or decoys//var/tmp/from_scwrl_1242020486_b.pdb.gz for input Trying /var/tmp/from_scwrl_1242020486_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1242020486_b.pdb or /var/tmp/from_scwrl_1242020486_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1242020486_a.pdb or decoys//var/tmp/from_scwrl_1242020486_a.pdb.gz for input Trying /var/tmp/from_scwrl_1242020486_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1242020486_a.pdb or /var/tmp/from_scwrl_1242020486_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1242020486.pdb or /var/tmp/from_scwrl_1242020486_b.pdb or /var/tmp/from_scwrl_1242020486_a.pdb Error: no new SCWRL conformation added # naming current conformation ROBETTA_TS5-scwrl # ReadConformPDB reading from PDB file servers/ROKKY_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation ROKKY_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_855308236.pdb -s /var/tmp/to_scwrl_855308236.seq -o /var/tmp/from_scwrl_855308236.pdb > /var/tmp/scwrl_855308236.log sh: /var/tmp/scwrl_855308236.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_855308236.pdb or /var/tmp/from_scwrl_855308236.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_855308236_b.pdb or decoys//var/tmp/from_scwrl_855308236_b.pdb.gz for input Trying /var/tmp/from_scwrl_855308236_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_855308236_b.pdb or /var/tmp/from_scwrl_855308236_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_855308236_a.pdb or decoys//var/tmp/from_scwrl_855308236_a.pdb.gz for input Trying /var/tmp/from_scwrl_855308236_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_855308236_a.pdb or /var/tmp/from_scwrl_855308236_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_855308236.pdb or /var/tmp/from_scwrl_855308236_b.pdb or /var/tmp/from_scwrl_855308236_a.pdb Error: no new SCWRL conformation added # naming current conformation ROKKY_TS1-scwrl # ReadConformPDB reading from PDB file servers/ROKKY_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation ROKKY_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1496494364.pdb -s /var/tmp/to_scwrl_1496494364.seq -o /var/tmp/from_scwrl_1496494364.pdb > /var/tmp/scwrl_1496494364.log sh: /var/tmp/scwrl_1496494364.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1496494364.pdb or /var/tmp/from_scwrl_1496494364.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1496494364_b.pdb or decoys//var/tmp/from_scwrl_1496494364_b.pdb.gz for input Trying /var/tmp/from_scwrl_1496494364_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1496494364_b.pdb or /var/tmp/from_scwrl_1496494364_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1496494364_a.pdb or decoys//var/tmp/from_scwrl_1496494364_a.pdb.gz for input Trying /var/tmp/from_scwrl_1496494364_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1496494364_a.pdb or /var/tmp/from_scwrl_1496494364_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1496494364.pdb or /var/tmp/from_scwrl_1496494364_b.pdb or /var/tmp/from_scwrl_1496494364_a.pdb Error: no new SCWRL conformation added # naming current conformation ROKKY_TS2-scwrl # ReadConformPDB reading from PDB file servers/ROKKY_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation ROKKY_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1032719223.pdb -s /var/tmp/to_scwrl_1032719223.seq -o /var/tmp/from_scwrl_1032719223.pdb > /var/tmp/scwrl_1032719223.log sh: /var/tmp/scwrl_1032719223.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1032719223.pdb or /var/tmp/from_scwrl_1032719223.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1032719223_b.pdb or decoys//var/tmp/from_scwrl_1032719223_b.pdb.gz for input Trying /var/tmp/from_scwrl_1032719223_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1032719223_b.pdb or /var/tmp/from_scwrl_1032719223_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1032719223_a.pdb or decoys//var/tmp/from_scwrl_1032719223_a.pdb.gz for input Trying /var/tmp/from_scwrl_1032719223_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1032719223_a.pdb or /var/tmp/from_scwrl_1032719223_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1032719223.pdb or /var/tmp/from_scwrl_1032719223_b.pdb or /var/tmp/from_scwrl_1032719223_a.pdb Error: no new SCWRL conformation added # naming current conformation ROKKY_TS3-scwrl # ReadConformPDB reading from PDB file servers/ROKKY_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation ROKKY_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1750654068.pdb -s /var/tmp/to_scwrl_1750654068.seq -o /var/tmp/from_scwrl_1750654068.pdb > /var/tmp/scwrl_1750654068.log sh: /var/tmp/scwrl_1750654068.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1750654068.pdb or /var/tmp/from_scwrl_1750654068.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1750654068_b.pdb or decoys//var/tmp/from_scwrl_1750654068_b.pdb.gz for input Trying /var/tmp/from_scwrl_1750654068_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1750654068_b.pdb or /var/tmp/from_scwrl_1750654068_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1750654068_a.pdb or decoys//var/tmp/from_scwrl_1750654068_a.pdb.gz for input Trying /var/tmp/from_scwrl_1750654068_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1750654068_a.pdb or /var/tmp/from_scwrl_1750654068_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1750654068.pdb or /var/tmp/from_scwrl_1750654068_b.pdb or /var/tmp/from_scwrl_1750654068_a.pdb Error: no new SCWRL conformation added # naming current conformation ROKKY_TS4-scwrl # ReadConformPDB reading from PDB file servers/ROKKY_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation ROKKY_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_2011861550.pdb -s /var/tmp/to_scwrl_2011861550.seq -o /var/tmp/from_scwrl_2011861550.pdb > /var/tmp/scwrl_2011861550.log sh: /var/tmp/scwrl_2011861550.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_2011861550.pdb or /var/tmp/from_scwrl_2011861550.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2011861550_b.pdb or decoys//var/tmp/from_scwrl_2011861550_b.pdb.gz for input Trying /var/tmp/from_scwrl_2011861550_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_2011861550_b.pdb or /var/tmp/from_scwrl_2011861550_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2011861550_a.pdb or decoys//var/tmp/from_scwrl_2011861550_a.pdb.gz for input Trying /var/tmp/from_scwrl_2011861550_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_2011861550_a.pdb or /var/tmp/from_scwrl_2011861550_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_2011861550.pdb or /var/tmp/from_scwrl_2011861550_b.pdb or /var/tmp/from_scwrl_2011861550_a.pdb Error: no new SCWRL conformation added # naming current conformation ROKKY_TS5-scwrl # ReadConformPDB reading from PDB file servers/SAM-T02_AL1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_743184056.pdb -s /var/tmp/to_scwrl_743184056.seq -o /var/tmp/from_scwrl_743184056.pdb > /var/tmp/scwrl_743184056.log sh: /var/tmp/scwrl_743184056.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_743184056.pdb or /var/tmp/from_scwrl_743184056.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_743184056_b.pdb or decoys//var/tmp/from_scwrl_743184056_b.pdb.gz for input Trying /var/tmp/from_scwrl_743184056_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_743184056_b.pdb or /var/tmp/from_scwrl_743184056_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_743184056_a.pdb or decoys//var/tmp/from_scwrl_743184056_a.pdb.gz for input Trying /var/tmp/from_scwrl_743184056_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_743184056_a.pdb or /var/tmp/from_scwrl_743184056_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_743184056.pdb or /var/tmp/from_scwrl_743184056_b.pdb or /var/tmp/from_scwrl_743184056_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_802273081.pdb -s /var/tmp/to_scwrl_802273081.seq -o /var/tmp/from_scwrl_802273081.pdb > /var/tmp/scwrl_802273081.log sh: /var/tmp/scwrl_802273081.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_802273081.pdb or /var/tmp/from_scwrl_802273081.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_802273081_b.pdb or decoys//var/tmp/from_scwrl_802273081_b.pdb.gz for input Trying /var/tmp/from_scwrl_802273081_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_802273081_b.pdb or /var/tmp/from_scwrl_802273081_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_802273081_a.pdb or decoys//var/tmp/from_scwrl_802273081_a.pdb.gz for input Trying /var/tmp/from_scwrl_802273081_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_802273081_a.pdb or /var/tmp/from_scwrl_802273081_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_802273081.pdb or /var/tmp/from_scwrl_802273081_b.pdb or /var/tmp/from_scwrl_802273081_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1806293965.pdb -s /var/tmp/to_scwrl_1806293965.seq -o /var/tmp/from_scwrl_1806293965.pdb > /var/tmp/scwrl_1806293965.log sh: /var/tmp/scwrl_1806293965.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1806293965.pdb or /var/tmp/from_scwrl_1806293965.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1806293965_b.pdb or decoys//var/tmp/from_scwrl_1806293965_b.pdb.gz for input Trying /var/tmp/from_scwrl_1806293965_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1806293965_b.pdb or /var/tmp/from_scwrl_1806293965_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1806293965_a.pdb or decoys//var/tmp/from_scwrl_1806293965_a.pdb.gz for input Trying /var/tmp/from_scwrl_1806293965_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1806293965_a.pdb or /var/tmp/from_scwrl_1806293965_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1806293965.pdb or /var/tmp/from_scwrl_1806293965_b.pdb or /var/tmp/from_scwrl_1806293965_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_964370193.pdb -s /var/tmp/to_scwrl_964370193.seq -o /var/tmp/from_scwrl_964370193.pdb > /var/tmp/scwrl_964370193.log sh: /var/tmp/scwrl_964370193.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_964370193.pdb or /var/tmp/from_scwrl_964370193.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_964370193_b.pdb or decoys//var/tmp/from_scwrl_964370193_b.pdb.gz for input Trying /var/tmp/from_scwrl_964370193_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_964370193_b.pdb or /var/tmp/from_scwrl_964370193_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_964370193_a.pdb or decoys//var/tmp/from_scwrl_964370193_a.pdb.gz for input Trying /var/tmp/from_scwrl_964370193_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_964370193_a.pdb or /var/tmp/from_scwrl_964370193_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_964370193.pdb or /var/tmp/from_scwrl_964370193_b.pdb or /var/tmp/from_scwrl_964370193_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation SAM-T02_AL5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1971708657.pdb -s /var/tmp/to_scwrl_1971708657.seq -o /var/tmp/from_scwrl_1971708657.pdb > /var/tmp/scwrl_1971708657.log sh: /var/tmp/scwrl_1971708657.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1971708657.pdb or /var/tmp/from_scwrl_1971708657.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1971708657_b.pdb or decoys//var/tmp/from_scwrl_1971708657_b.pdb.gz for input Trying /var/tmp/from_scwrl_1971708657_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1971708657_b.pdb or /var/tmp/from_scwrl_1971708657_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1971708657_a.pdb or decoys//var/tmp/from_scwrl_1971708657_a.pdb.gz for input Trying /var/tmp/from_scwrl_1971708657_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1971708657_a.pdb or /var/tmp/from_scwrl_1971708657_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1971708657.pdb or /var/tmp/from_scwrl_1971708657_b.pdb or /var/tmp/from_scwrl_1971708657_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation SAM-T99_AL1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1200193544.pdb -s /var/tmp/to_scwrl_1200193544.seq -o /var/tmp/from_scwrl_1200193544.pdb > /var/tmp/scwrl_1200193544.log sh: /var/tmp/scwrl_1200193544.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1200193544.pdb or /var/tmp/from_scwrl_1200193544.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1200193544_b.pdb or decoys//var/tmp/from_scwrl_1200193544_b.pdb.gz for input Trying /var/tmp/from_scwrl_1200193544_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1200193544_b.pdb or /var/tmp/from_scwrl_1200193544_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1200193544_a.pdb or decoys//var/tmp/from_scwrl_1200193544_a.pdb.gz for input Trying /var/tmp/from_scwrl_1200193544_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1200193544_a.pdb or /var/tmp/from_scwrl_1200193544_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1200193544.pdb or /var/tmp/from_scwrl_1200193544_b.pdb or /var/tmp/from_scwrl_1200193544_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation SAM-T99_AL2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_590178921.pdb -s /var/tmp/to_scwrl_590178921.seq -o /var/tmp/from_scwrl_590178921.pdb > /var/tmp/scwrl_590178921.log sh: /var/tmp/scwrl_590178921.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_590178921.pdb or /var/tmp/from_scwrl_590178921.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_590178921_b.pdb or decoys//var/tmp/from_scwrl_590178921_b.pdb.gz for input Trying /var/tmp/from_scwrl_590178921_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_590178921_b.pdb or /var/tmp/from_scwrl_590178921_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_590178921_a.pdb or decoys//var/tmp/from_scwrl_590178921_a.pdb.gz for input Trying /var/tmp/from_scwrl_590178921_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_590178921_a.pdb or /var/tmp/from_scwrl_590178921_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_590178921.pdb or /var/tmp/from_scwrl_590178921_b.pdb or /var/tmp/from_scwrl_590178921_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation SAM-T99_AL3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_2008370000.pdb -s /var/tmp/to_scwrl_2008370000.seq -o /var/tmp/from_scwrl_2008370000.pdb > /var/tmp/scwrl_2008370000.log sh: /var/tmp/scwrl_2008370000.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_2008370000.pdb or /var/tmp/from_scwrl_2008370000.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2008370000_b.pdb or decoys//var/tmp/from_scwrl_2008370000_b.pdb.gz for input Trying /var/tmp/from_scwrl_2008370000_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_2008370000_b.pdb or /var/tmp/from_scwrl_2008370000_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2008370000_a.pdb or decoys//var/tmp/from_scwrl_2008370000_a.pdb.gz for input Trying /var/tmp/from_scwrl_2008370000_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_2008370000_a.pdb or /var/tmp/from_scwrl_2008370000_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_2008370000.pdb or /var/tmp/from_scwrl_2008370000_b.pdb or /var/tmp/from_scwrl_2008370000_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation SAM-T99_AL4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_2050446193.pdb -s /var/tmp/to_scwrl_2050446193.seq -o /var/tmp/from_scwrl_2050446193.pdb > /var/tmp/scwrl_2050446193.log sh: /var/tmp/scwrl_2050446193.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_2050446193.pdb or /var/tmp/from_scwrl_2050446193.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2050446193_b.pdb or decoys//var/tmp/from_scwrl_2050446193_b.pdb.gz for input Trying /var/tmp/from_scwrl_2050446193_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_2050446193_b.pdb or /var/tmp/from_scwrl_2050446193_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2050446193_a.pdb or decoys//var/tmp/from_scwrl_2050446193_a.pdb.gz for input Trying /var/tmp/from_scwrl_2050446193_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_2050446193_a.pdb or /var/tmp/from_scwrl_2050446193_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_2050446193.pdb or /var/tmp/from_scwrl_2050446193_b.pdb or /var/tmp/from_scwrl_2050446193_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation SAM-T99_AL5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_654861522.pdb -s /var/tmp/to_scwrl_654861522.seq -o /var/tmp/from_scwrl_654861522.pdb > /var/tmp/scwrl_654861522.log sh: /var/tmp/scwrl_654861522.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_654861522.pdb or /var/tmp/from_scwrl_654861522.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_654861522_b.pdb or decoys//var/tmp/from_scwrl_654861522_b.pdb.gz for input Trying /var/tmp/from_scwrl_654861522_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_654861522_b.pdb or /var/tmp/from_scwrl_654861522_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_654861522_a.pdb or decoys//var/tmp/from_scwrl_654861522_a.pdb.gz for input Trying /var/tmp/from_scwrl_654861522_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_654861522_a.pdb or /var/tmp/from_scwrl_654861522_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_654861522.pdb or /var/tmp/from_scwrl_654861522_b.pdb or /var/tmp/from_scwrl_654861522_a.pdb Error: no new SCWRL conformation added # 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 372 # copying to AlignedFragments data structure # naming current conformation SAM_T06_server_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1916495851.pdb -s /var/tmp/to_scwrl_1916495851.seq -o /var/tmp/from_scwrl_1916495851.pdb > /var/tmp/scwrl_1916495851.log sh: /var/tmp/scwrl_1916495851.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1916495851.pdb or /var/tmp/from_scwrl_1916495851.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1916495851_b.pdb or decoys//var/tmp/from_scwrl_1916495851_b.pdb.gz for input Trying /var/tmp/from_scwrl_1916495851_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1916495851_b.pdb or /var/tmp/from_scwrl_1916495851_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1916495851_a.pdb or decoys//var/tmp/from_scwrl_1916495851_a.pdb.gz for input Trying /var/tmp/from_scwrl_1916495851_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1916495851_a.pdb or /var/tmp/from_scwrl_1916495851_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1916495851.pdb or /var/tmp/from_scwrl_1916495851_b.pdb or /var/tmp/from_scwrl_1916495851_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation SAM_T06_server_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1507284073.pdb -s /var/tmp/to_scwrl_1507284073.seq -o /var/tmp/from_scwrl_1507284073.pdb > /var/tmp/scwrl_1507284073.log sh: /var/tmp/scwrl_1507284073.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1507284073.pdb or /var/tmp/from_scwrl_1507284073.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1507284073_b.pdb or decoys//var/tmp/from_scwrl_1507284073_b.pdb.gz for input Trying /var/tmp/from_scwrl_1507284073_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1507284073_b.pdb or /var/tmp/from_scwrl_1507284073_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1507284073_a.pdb or decoys//var/tmp/from_scwrl_1507284073_a.pdb.gz for input Trying /var/tmp/from_scwrl_1507284073_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1507284073_a.pdb or /var/tmp/from_scwrl_1507284073_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1507284073.pdb or /var/tmp/from_scwrl_1507284073_b.pdb or /var/tmp/from_scwrl_1507284073_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation SAM_T06_server_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1326339598.pdb -s /var/tmp/to_scwrl_1326339598.seq -o /var/tmp/from_scwrl_1326339598.pdb > /var/tmp/scwrl_1326339598.log sh: /var/tmp/scwrl_1326339598.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1326339598.pdb or /var/tmp/from_scwrl_1326339598.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1326339598_b.pdb or decoys//var/tmp/from_scwrl_1326339598_b.pdb.gz for input Trying /var/tmp/from_scwrl_1326339598_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1326339598_b.pdb or /var/tmp/from_scwrl_1326339598_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1326339598_a.pdb or decoys//var/tmp/from_scwrl_1326339598_a.pdb.gz for input Trying /var/tmp/from_scwrl_1326339598_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1326339598_a.pdb or /var/tmp/from_scwrl_1326339598_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1326339598.pdb or /var/tmp/from_scwrl_1326339598_b.pdb or /var/tmp/from_scwrl_1326339598_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation SAM_T06_server_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_2814424.pdb -s /var/tmp/to_scwrl_2814424.seq -o /var/tmp/from_scwrl_2814424.pdb > /var/tmp/scwrl_2814424.log sh: /var/tmp/scwrl_2814424.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_2814424.pdb or /var/tmp/from_scwrl_2814424.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2814424_b.pdb or decoys//var/tmp/from_scwrl_2814424_b.pdb.gz for input Trying /var/tmp/from_scwrl_2814424_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_2814424_b.pdb or /var/tmp/from_scwrl_2814424_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2814424_a.pdb or decoys//var/tmp/from_scwrl_2814424_a.pdb.gz for input Trying /var/tmp/from_scwrl_2814424_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_2814424_a.pdb or /var/tmp/from_scwrl_2814424_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_2814424.pdb or /var/tmp/from_scwrl_2814424_b.pdb or /var/tmp/from_scwrl_2814424_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation SAM_T06_server_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_134647302.pdb -s /var/tmp/to_scwrl_134647302.seq -o /var/tmp/from_scwrl_134647302.pdb > /var/tmp/scwrl_134647302.log sh: /var/tmp/scwrl_134647302.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_134647302.pdb or /var/tmp/from_scwrl_134647302.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_134647302_b.pdb or decoys//var/tmp/from_scwrl_134647302_b.pdb.gz for input Trying /var/tmp/from_scwrl_134647302_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_134647302_b.pdb or /var/tmp/from_scwrl_134647302_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_134647302_a.pdb or decoys//var/tmp/from_scwrl_134647302_a.pdb.gz for input Trying /var/tmp/from_scwrl_134647302_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_134647302_a.pdb or /var/tmp/from_scwrl_134647302_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_134647302.pdb or /var/tmp/from_scwrl_134647302_b.pdb or /var/tmp/from_scwrl_134647302_a.pdb Error: no new SCWRL conformation added # 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 143 # copying to AlignedFragments data structure # naming current conformation SP3_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_660327712.pdb -s /var/tmp/to_scwrl_660327712.seq -o /var/tmp/from_scwrl_660327712.pdb > /var/tmp/scwrl_660327712.log sh: /var/tmp/scwrl_660327712.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_660327712.pdb or /var/tmp/from_scwrl_660327712.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_660327712_b.pdb or decoys//var/tmp/from_scwrl_660327712_b.pdb.gz for input Trying /var/tmp/from_scwrl_660327712_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_660327712_b.pdb or /var/tmp/from_scwrl_660327712_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_660327712_a.pdb or decoys//var/tmp/from_scwrl_660327712_a.pdb.gz for input Trying /var/tmp/from_scwrl_660327712_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_660327712_a.pdb or /var/tmp/from_scwrl_660327712_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_660327712.pdb or /var/tmp/from_scwrl_660327712_b.pdb or /var/tmp/from_scwrl_660327712_a.pdb Error: no new SCWRL conformation added # 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 301 # copying to AlignedFragments data structure # naming current conformation SP3_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_303846193.pdb -s /var/tmp/to_scwrl_303846193.seq -o /var/tmp/from_scwrl_303846193.pdb > /var/tmp/scwrl_303846193.log sh: /var/tmp/scwrl_303846193.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_303846193.pdb or /var/tmp/from_scwrl_303846193.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_303846193_b.pdb or decoys//var/tmp/from_scwrl_303846193_b.pdb.gz for input Trying /var/tmp/from_scwrl_303846193_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_303846193_b.pdb or /var/tmp/from_scwrl_303846193_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_303846193_a.pdb or decoys//var/tmp/from_scwrl_303846193_a.pdb.gz for input Trying /var/tmp/from_scwrl_303846193_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_303846193_a.pdb or /var/tmp/from_scwrl_303846193_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_303846193.pdb or /var/tmp/from_scwrl_303846193_b.pdb or /var/tmp/from_scwrl_303846193_a.pdb Error: no new SCWRL conformation added # naming current conformation SP3_TS2-scwrl # ReadConformPDB reading from PDB file servers/SP3_TS3.pdb.gz looking for model 1 # Found a chain break before 198 # copying to AlignedFragments data structure # naming current conformation SP3_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1841537043.pdb -s /var/tmp/to_scwrl_1841537043.seq -o /var/tmp/from_scwrl_1841537043.pdb > /var/tmp/scwrl_1841537043.log sh: /var/tmp/scwrl_1841537043.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1841537043.pdb or /var/tmp/from_scwrl_1841537043.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1841537043_b.pdb or decoys//var/tmp/from_scwrl_1841537043_b.pdb.gz for input Trying /var/tmp/from_scwrl_1841537043_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1841537043_b.pdb or /var/tmp/from_scwrl_1841537043_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1841537043_a.pdb or decoys//var/tmp/from_scwrl_1841537043_a.pdb.gz for input Trying /var/tmp/from_scwrl_1841537043_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1841537043_a.pdb or /var/tmp/from_scwrl_1841537043_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1841537043.pdb or /var/tmp/from_scwrl_1841537043_b.pdb or /var/tmp/from_scwrl_1841537043_a.pdb Error: no new SCWRL conformation added # 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 259 # copying to AlignedFragments data structure # naming current conformation SP3_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1421876869.pdb -s /var/tmp/to_scwrl_1421876869.seq -o /var/tmp/from_scwrl_1421876869.pdb > /var/tmp/scwrl_1421876869.log sh: /var/tmp/scwrl_1421876869.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1421876869.pdb or /var/tmp/from_scwrl_1421876869.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1421876869_b.pdb or decoys//var/tmp/from_scwrl_1421876869_b.pdb.gz for input Trying /var/tmp/from_scwrl_1421876869_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1421876869_b.pdb or /var/tmp/from_scwrl_1421876869_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1421876869_a.pdb or decoys//var/tmp/from_scwrl_1421876869_a.pdb.gz for input Trying /var/tmp/from_scwrl_1421876869_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1421876869_a.pdb or /var/tmp/from_scwrl_1421876869_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1421876869.pdb or /var/tmp/from_scwrl_1421876869_b.pdb or /var/tmp/from_scwrl_1421876869_a.pdb Error: no new SCWRL conformation added # 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 212 # copying to AlignedFragments data structure # naming current conformation SP3_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1887432792.pdb -s /var/tmp/to_scwrl_1887432792.seq -o /var/tmp/from_scwrl_1887432792.pdb > /var/tmp/scwrl_1887432792.log sh: /var/tmp/scwrl_1887432792.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1887432792.pdb or /var/tmp/from_scwrl_1887432792.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1887432792_b.pdb or decoys//var/tmp/from_scwrl_1887432792_b.pdb.gz for input Trying /var/tmp/from_scwrl_1887432792_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1887432792_b.pdb or /var/tmp/from_scwrl_1887432792_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1887432792_a.pdb or decoys//var/tmp/from_scwrl_1887432792_a.pdb.gz for input Trying /var/tmp/from_scwrl_1887432792_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1887432792_a.pdb or /var/tmp/from_scwrl_1887432792_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1887432792.pdb or /var/tmp/from_scwrl_1887432792_b.pdb or /var/tmp/from_scwrl_1887432792_a.pdb Error: no new SCWRL conformation added # 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 128 # copying to AlignedFragments data structure # naming current conformation SP4_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_736171329.pdb -s /var/tmp/to_scwrl_736171329.seq -o /var/tmp/from_scwrl_736171329.pdb > /var/tmp/scwrl_736171329.log sh: /var/tmp/scwrl_736171329.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_736171329.pdb or /var/tmp/from_scwrl_736171329.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_736171329_b.pdb or decoys//var/tmp/from_scwrl_736171329_b.pdb.gz for input Trying /var/tmp/from_scwrl_736171329_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_736171329_b.pdb or /var/tmp/from_scwrl_736171329_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_736171329_a.pdb or decoys//var/tmp/from_scwrl_736171329_a.pdb.gz for input Trying /var/tmp/from_scwrl_736171329_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_736171329_a.pdb or /var/tmp/from_scwrl_736171329_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_736171329.pdb or /var/tmp/from_scwrl_736171329_b.pdb or /var/tmp/from_scwrl_736171329_a.pdb Error: no new SCWRL conformation added # 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 142 # copying to AlignedFragments data structure # naming current conformation SP4_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1363006192.pdb -s /var/tmp/to_scwrl_1363006192.seq -o /var/tmp/from_scwrl_1363006192.pdb > /var/tmp/scwrl_1363006192.log sh: /var/tmp/scwrl_1363006192.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1363006192.pdb or /var/tmp/from_scwrl_1363006192.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1363006192_b.pdb or decoys//var/tmp/from_scwrl_1363006192_b.pdb.gz for input Trying /var/tmp/from_scwrl_1363006192_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1363006192_b.pdb or /var/tmp/from_scwrl_1363006192_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1363006192_a.pdb or decoys//var/tmp/from_scwrl_1363006192_a.pdb.gz for input Trying /var/tmp/from_scwrl_1363006192_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1363006192_a.pdb or /var/tmp/from_scwrl_1363006192_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1363006192.pdb or /var/tmp/from_scwrl_1363006192_b.pdb or /var/tmp/from_scwrl_1363006192_a.pdb Error: no new SCWRL conformation added # 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 248 # copying to AlignedFragments data structure # naming current conformation SP4_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1278375180.pdb -s /var/tmp/to_scwrl_1278375180.seq -o /var/tmp/from_scwrl_1278375180.pdb > /var/tmp/scwrl_1278375180.log sh: /var/tmp/scwrl_1278375180.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1278375180.pdb or /var/tmp/from_scwrl_1278375180.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1278375180_b.pdb or decoys//var/tmp/from_scwrl_1278375180_b.pdb.gz for input Trying /var/tmp/from_scwrl_1278375180_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1278375180_b.pdb or /var/tmp/from_scwrl_1278375180_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1278375180_a.pdb or decoys//var/tmp/from_scwrl_1278375180_a.pdb.gz for input Trying /var/tmp/from_scwrl_1278375180_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1278375180_a.pdb or /var/tmp/from_scwrl_1278375180_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1278375180.pdb or /var/tmp/from_scwrl_1278375180_b.pdb or /var/tmp/from_scwrl_1278375180_a.pdb Error: no new SCWRL conformation added # naming current conformation SP4_TS3-scwrl # ReadConformPDB reading from PDB file servers/SP4_TS4.pdb.gz looking for model 1 # Found a chain break before 301 # copying to AlignedFragments data structure # naming current conformation SP4_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_666638208.pdb -s /var/tmp/to_scwrl_666638208.seq -o /var/tmp/from_scwrl_666638208.pdb > /var/tmp/scwrl_666638208.log sh: /var/tmp/scwrl_666638208.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_666638208.pdb or /var/tmp/from_scwrl_666638208.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_666638208_b.pdb or decoys//var/tmp/from_scwrl_666638208_b.pdb.gz for input Trying /var/tmp/from_scwrl_666638208_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_666638208_b.pdb or /var/tmp/from_scwrl_666638208_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_666638208_a.pdb or decoys//var/tmp/from_scwrl_666638208_a.pdb.gz for input Trying /var/tmp/from_scwrl_666638208_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_666638208_a.pdb or /var/tmp/from_scwrl_666638208_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_666638208.pdb or /var/tmp/from_scwrl_666638208_b.pdb or /var/tmp/from_scwrl_666638208_a.pdb Error: no new SCWRL conformation added # 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 212 # copying to AlignedFragments data structure # naming current conformation SP4_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_890649609.pdb -s /var/tmp/to_scwrl_890649609.seq -o /var/tmp/from_scwrl_890649609.pdb > /var/tmp/scwrl_890649609.log sh: /var/tmp/scwrl_890649609.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_890649609.pdb or /var/tmp/from_scwrl_890649609.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_890649609_b.pdb or decoys//var/tmp/from_scwrl_890649609_b.pdb.gz for input Trying /var/tmp/from_scwrl_890649609_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_890649609_b.pdb or /var/tmp/from_scwrl_890649609_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_890649609_a.pdb or decoys//var/tmp/from_scwrl_890649609_a.pdb.gz for input Trying /var/tmp/from_scwrl_890649609_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_890649609_a.pdb or /var/tmp/from_scwrl_890649609_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_890649609.pdb or /var/tmp/from_scwrl_890649609_b.pdb or /var/tmp/from_scwrl_890649609_a.pdb Error: no new SCWRL conformation added # 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 162 # copying to AlignedFragments data structure # naming current conformation SPARKS2_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_372912020.pdb -s /var/tmp/to_scwrl_372912020.seq -o /var/tmp/from_scwrl_372912020.pdb > /var/tmp/scwrl_372912020.log sh: /var/tmp/scwrl_372912020.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_372912020.pdb or /var/tmp/from_scwrl_372912020.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_372912020_b.pdb or decoys//var/tmp/from_scwrl_372912020_b.pdb.gz for input Trying /var/tmp/from_scwrl_372912020_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_372912020_b.pdb or /var/tmp/from_scwrl_372912020_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_372912020_a.pdb or decoys//var/tmp/from_scwrl_372912020_a.pdb.gz for input Trying /var/tmp/from_scwrl_372912020_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_372912020_a.pdb or /var/tmp/from_scwrl_372912020_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_372912020.pdb or /var/tmp/from_scwrl_372912020_b.pdb or /var/tmp/from_scwrl_372912020_a.pdb Error: no new SCWRL conformation added # 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 218 # copying to AlignedFragments data structure # naming current conformation SPARKS2_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1521946443.pdb -s /var/tmp/to_scwrl_1521946443.seq -o /var/tmp/from_scwrl_1521946443.pdb > /var/tmp/scwrl_1521946443.log sh: /var/tmp/scwrl_1521946443.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1521946443.pdb or /var/tmp/from_scwrl_1521946443.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1521946443_b.pdb or decoys//var/tmp/from_scwrl_1521946443_b.pdb.gz for input Trying /var/tmp/from_scwrl_1521946443_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1521946443_b.pdb or /var/tmp/from_scwrl_1521946443_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1521946443_a.pdb or decoys//var/tmp/from_scwrl_1521946443_a.pdb.gz for input Trying /var/tmp/from_scwrl_1521946443_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1521946443_a.pdb or /var/tmp/from_scwrl_1521946443_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1521946443.pdb or /var/tmp/from_scwrl_1521946443_b.pdb or /var/tmp/from_scwrl_1521946443_a.pdb Error: no new SCWRL conformation added # 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 366 # copying to AlignedFragments data structure # naming current conformation SPARKS2_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_239660327.pdb -s /var/tmp/to_scwrl_239660327.seq -o /var/tmp/from_scwrl_239660327.pdb > /var/tmp/scwrl_239660327.log sh: /var/tmp/scwrl_239660327.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_239660327.pdb or /var/tmp/from_scwrl_239660327.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_239660327_b.pdb or decoys//var/tmp/from_scwrl_239660327_b.pdb.gz for input Trying /var/tmp/from_scwrl_239660327_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_239660327_b.pdb or /var/tmp/from_scwrl_239660327_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_239660327_a.pdb or decoys//var/tmp/from_scwrl_239660327_a.pdb.gz for input Trying /var/tmp/from_scwrl_239660327_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_239660327_a.pdb or /var/tmp/from_scwrl_239660327_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_239660327.pdb or /var/tmp/from_scwrl_239660327_b.pdb or /var/tmp/from_scwrl_239660327_a.pdb Error: no new SCWRL conformation added # naming current conformation SPARKS2_TS3-scwrl # ReadConformPDB reading from PDB file servers/SPARKS2_TS4.pdb.gz looking for model 1 # Found a chain break before 199 # copying to AlignedFragments data structure # naming current conformation SPARKS2_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1405631243.pdb -s /var/tmp/to_scwrl_1405631243.seq -o /var/tmp/from_scwrl_1405631243.pdb > /var/tmp/scwrl_1405631243.log sh: /var/tmp/scwrl_1405631243.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1405631243.pdb or /var/tmp/from_scwrl_1405631243.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1405631243_b.pdb or decoys//var/tmp/from_scwrl_1405631243_b.pdb.gz for input Trying /var/tmp/from_scwrl_1405631243_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1405631243_b.pdb or /var/tmp/from_scwrl_1405631243_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1405631243_a.pdb or decoys//var/tmp/from_scwrl_1405631243_a.pdb.gz for input Trying /var/tmp/from_scwrl_1405631243_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1405631243_a.pdb or /var/tmp/from_scwrl_1405631243_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1405631243.pdb or /var/tmp/from_scwrl_1405631243_b.pdb or /var/tmp/from_scwrl_1405631243_a.pdb Error: no new SCWRL conformation added # 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 127 # copying to AlignedFragments data structure # naming current conformation SPARKS2_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1125116864.pdb -s /var/tmp/to_scwrl_1125116864.seq -o /var/tmp/from_scwrl_1125116864.pdb > /var/tmp/scwrl_1125116864.log sh: /var/tmp/scwrl_1125116864.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1125116864.pdb or /var/tmp/from_scwrl_1125116864.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1125116864_b.pdb or decoys//var/tmp/from_scwrl_1125116864_b.pdb.gz for input Trying /var/tmp/from_scwrl_1125116864_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1125116864_b.pdb or /var/tmp/from_scwrl_1125116864_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1125116864_a.pdb or decoys//var/tmp/from_scwrl_1125116864_a.pdb.gz for input Trying /var/tmp/from_scwrl_1125116864_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1125116864_a.pdb or /var/tmp/from_scwrl_1125116864_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1125116864.pdb or /var/tmp/from_scwrl_1125116864_b.pdb or /var/tmp/from_scwrl_1125116864_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation UNI-EID_bnmx_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_104038230.pdb -s /var/tmp/to_scwrl_104038230.seq -o /var/tmp/from_scwrl_104038230.pdb > /var/tmp/scwrl_104038230.log sh: /var/tmp/scwrl_104038230.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_104038230.pdb or /var/tmp/from_scwrl_104038230.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_104038230_b.pdb or decoys//var/tmp/from_scwrl_104038230_b.pdb.gz for input Trying /var/tmp/from_scwrl_104038230_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_104038230_b.pdb or /var/tmp/from_scwrl_104038230_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_104038230_a.pdb or decoys//var/tmp/from_scwrl_104038230_a.pdb.gz for input Trying /var/tmp/from_scwrl_104038230_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_104038230_a.pdb or /var/tmp/from_scwrl_104038230_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_104038230.pdb or /var/tmp/from_scwrl_104038230_b.pdb or /var/tmp/from_scwrl_104038230_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation UNI-EID_bnmx_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1331652.pdb -s /var/tmp/to_scwrl_1331652.seq -o /var/tmp/from_scwrl_1331652.pdb > /var/tmp/scwrl_1331652.log sh: /var/tmp/scwrl_1331652.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1331652.pdb or /var/tmp/from_scwrl_1331652.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1331652_b.pdb or decoys//var/tmp/from_scwrl_1331652_b.pdb.gz for input Trying /var/tmp/from_scwrl_1331652_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1331652_b.pdb or /var/tmp/from_scwrl_1331652_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1331652_a.pdb or decoys//var/tmp/from_scwrl_1331652_a.pdb.gz for input Trying /var/tmp/from_scwrl_1331652_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1331652_a.pdb or /var/tmp/from_scwrl_1331652_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1331652.pdb or /var/tmp/from_scwrl_1331652_b.pdb or /var/tmp/from_scwrl_1331652_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation UNI-EID_bnmx_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1927389945.pdb -s /var/tmp/to_scwrl_1927389945.seq -o /var/tmp/from_scwrl_1927389945.pdb > /var/tmp/scwrl_1927389945.log sh: /var/tmp/scwrl_1927389945.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1927389945.pdb or /var/tmp/from_scwrl_1927389945.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1927389945_b.pdb or decoys//var/tmp/from_scwrl_1927389945_b.pdb.gz for input Trying /var/tmp/from_scwrl_1927389945_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1927389945_b.pdb or /var/tmp/from_scwrl_1927389945_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1927389945_a.pdb or decoys//var/tmp/from_scwrl_1927389945_a.pdb.gz for input Trying /var/tmp/from_scwrl_1927389945_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1927389945_a.pdb or /var/tmp/from_scwrl_1927389945_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1927389945.pdb or /var/tmp/from_scwrl_1927389945_b.pdb or /var/tmp/from_scwrl_1927389945_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation UNI-EID_bnmx_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1910332195.pdb -s /var/tmp/to_scwrl_1910332195.seq -o /var/tmp/from_scwrl_1910332195.pdb > /var/tmp/scwrl_1910332195.log sh: /var/tmp/scwrl_1910332195.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1910332195.pdb or /var/tmp/from_scwrl_1910332195.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1910332195_b.pdb or decoys//var/tmp/from_scwrl_1910332195_b.pdb.gz for input Trying /var/tmp/from_scwrl_1910332195_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1910332195_b.pdb or /var/tmp/from_scwrl_1910332195_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1910332195_a.pdb or decoys//var/tmp/from_scwrl_1910332195_a.pdb.gz for input Trying /var/tmp/from_scwrl_1910332195_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1910332195_a.pdb or /var/tmp/from_scwrl_1910332195_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1910332195.pdb or /var/tmp/from_scwrl_1910332195_b.pdb or /var/tmp/from_scwrl_1910332195_a.pdb Error: no new SCWRL conformation added # naming current conformation UNI-EID_bnmx_TS4-scwrl # ReadConformPDB reading from PDB file servers/UNI-EID_expm_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation UNI-EID_expm_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_965701845.pdb -s /var/tmp/to_scwrl_965701845.seq -o /var/tmp/from_scwrl_965701845.pdb > /var/tmp/scwrl_965701845.log sh: /var/tmp/scwrl_965701845.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_965701845.pdb or /var/tmp/from_scwrl_965701845.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_965701845_b.pdb or decoys//var/tmp/from_scwrl_965701845_b.pdb.gz for input Trying /var/tmp/from_scwrl_965701845_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_965701845_b.pdb or /var/tmp/from_scwrl_965701845_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_965701845_a.pdb or decoys//var/tmp/from_scwrl_965701845_a.pdb.gz for input Trying /var/tmp/from_scwrl_965701845_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_965701845_a.pdb or /var/tmp/from_scwrl_965701845_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_965701845.pdb or /var/tmp/from_scwrl_965701845_b.pdb or /var/tmp/from_scwrl_965701845_a.pdb Error: no new SCWRL conformation added # naming current conformation UNI-EID_expm_TS1-scwrl # ReadConformPDB reading from PDB file servers/UNI-EID_sfst_AL1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation UNI-EID_sfst_AL1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1751614955.pdb -s /var/tmp/to_scwrl_1751614955.seq -o /var/tmp/from_scwrl_1751614955.pdb > /var/tmp/scwrl_1751614955.log sh: /var/tmp/scwrl_1751614955.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1751614955.pdb or /var/tmp/from_scwrl_1751614955.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1751614955_b.pdb or decoys//var/tmp/from_scwrl_1751614955_b.pdb.gz for input Trying /var/tmp/from_scwrl_1751614955_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1751614955_b.pdb or /var/tmp/from_scwrl_1751614955_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1751614955_a.pdb or decoys//var/tmp/from_scwrl_1751614955_a.pdb.gz for input Trying /var/tmp/from_scwrl_1751614955_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1751614955_a.pdb or /var/tmp/from_scwrl_1751614955_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1751614955.pdb or /var/tmp/from_scwrl_1751614955_b.pdb or /var/tmp/from_scwrl_1751614955_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation UNI-EID_sfst_AL2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_963042093.pdb -s /var/tmp/to_scwrl_963042093.seq -o /var/tmp/from_scwrl_963042093.pdb > /var/tmp/scwrl_963042093.log sh: /var/tmp/scwrl_963042093.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_963042093.pdb or /var/tmp/from_scwrl_963042093.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_963042093_b.pdb or decoys//var/tmp/from_scwrl_963042093_b.pdb.gz for input Trying /var/tmp/from_scwrl_963042093_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_963042093_b.pdb or /var/tmp/from_scwrl_963042093_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_963042093_a.pdb or decoys//var/tmp/from_scwrl_963042093_a.pdb.gz for input Trying /var/tmp/from_scwrl_963042093_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_963042093_a.pdb or /var/tmp/from_scwrl_963042093_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_963042093.pdb or /var/tmp/from_scwrl_963042093_b.pdb or /var/tmp/from_scwrl_963042093_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation UNI-EID_sfst_AL3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1555880765.pdb -s /var/tmp/to_scwrl_1555880765.seq -o /var/tmp/from_scwrl_1555880765.pdb > /var/tmp/scwrl_1555880765.log sh: /var/tmp/scwrl_1555880765.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1555880765.pdb or /var/tmp/from_scwrl_1555880765.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1555880765_b.pdb or decoys//var/tmp/from_scwrl_1555880765_b.pdb.gz for input Trying /var/tmp/from_scwrl_1555880765_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1555880765_b.pdb or /var/tmp/from_scwrl_1555880765_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1555880765_a.pdb or decoys//var/tmp/from_scwrl_1555880765_a.pdb.gz for input Trying /var/tmp/from_scwrl_1555880765_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1555880765_a.pdb or /var/tmp/from_scwrl_1555880765_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1555880765.pdb or /var/tmp/from_scwrl_1555880765_b.pdb or /var/tmp/from_scwrl_1555880765_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation UNI-EID_sfst_AL4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1612501309.pdb -s /var/tmp/to_scwrl_1612501309.seq -o /var/tmp/from_scwrl_1612501309.pdb > /var/tmp/scwrl_1612501309.log sh: /var/tmp/scwrl_1612501309.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1612501309.pdb or /var/tmp/from_scwrl_1612501309.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1612501309_b.pdb or decoys//var/tmp/from_scwrl_1612501309_b.pdb.gz for input Trying /var/tmp/from_scwrl_1612501309_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1612501309_b.pdb or /var/tmp/from_scwrl_1612501309_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1612501309_a.pdb or decoys//var/tmp/from_scwrl_1612501309_a.pdb.gz for input Trying /var/tmp/from_scwrl_1612501309_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1612501309_a.pdb or /var/tmp/from_scwrl_1612501309_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1612501309.pdb or /var/tmp/from_scwrl_1612501309_b.pdb or /var/tmp/from_scwrl_1612501309_a.pdb Error: no new SCWRL conformation added # naming current conformation UNI-EID_sfst_AL4-scwrl # ReadConformPDB reading from PDB file servers/Zhang-Server_TS1.pdb.gz looking for model 1 # Found a chain break before 371 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_866004639.pdb -s /var/tmp/to_scwrl_866004639.seq -o /var/tmp/from_scwrl_866004639.pdb > /var/tmp/scwrl_866004639.log sh: /var/tmp/scwrl_866004639.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_866004639.pdb or /var/tmp/from_scwrl_866004639.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_866004639_b.pdb or decoys//var/tmp/from_scwrl_866004639_b.pdb.gz for input Trying /var/tmp/from_scwrl_866004639_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_866004639_b.pdb or /var/tmp/from_scwrl_866004639_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_866004639_a.pdb or decoys//var/tmp/from_scwrl_866004639_a.pdb.gz for input Trying /var/tmp/from_scwrl_866004639_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_866004639_a.pdb or /var/tmp/from_scwrl_866004639_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_866004639.pdb or /var/tmp/from_scwrl_866004639_b.pdb or /var/tmp/from_scwrl_866004639_a.pdb Error: no new SCWRL conformation added # 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 361 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_63258641.pdb -s /var/tmp/to_scwrl_63258641.seq -o /var/tmp/from_scwrl_63258641.pdb > /var/tmp/scwrl_63258641.log sh: /var/tmp/scwrl_63258641.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_63258641.pdb or /var/tmp/from_scwrl_63258641.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_63258641_b.pdb or decoys//var/tmp/from_scwrl_63258641_b.pdb.gz for input Trying /var/tmp/from_scwrl_63258641_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_63258641_b.pdb or /var/tmp/from_scwrl_63258641_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_63258641_a.pdb or decoys//var/tmp/from_scwrl_63258641_a.pdb.gz for input Trying /var/tmp/from_scwrl_63258641_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_63258641_a.pdb or /var/tmp/from_scwrl_63258641_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_63258641.pdb or /var/tmp/from_scwrl_63258641_b.pdb or /var/tmp/from_scwrl_63258641_a.pdb Error: no new SCWRL conformation added # 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 371 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1381513513.pdb -s /var/tmp/to_scwrl_1381513513.seq -o /var/tmp/from_scwrl_1381513513.pdb > /var/tmp/scwrl_1381513513.log sh: /var/tmp/scwrl_1381513513.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1381513513.pdb or /var/tmp/from_scwrl_1381513513.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1381513513_b.pdb or decoys//var/tmp/from_scwrl_1381513513_b.pdb.gz for input Trying /var/tmp/from_scwrl_1381513513_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1381513513_b.pdb or /var/tmp/from_scwrl_1381513513_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1381513513_a.pdb or decoys//var/tmp/from_scwrl_1381513513_a.pdb.gz for input Trying /var/tmp/from_scwrl_1381513513_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1381513513_a.pdb or /var/tmp/from_scwrl_1381513513_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1381513513.pdb or /var/tmp/from_scwrl_1381513513_b.pdb or /var/tmp/from_scwrl_1381513513_a.pdb Error: no new SCWRL conformation added # 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 359 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_225805065.pdb -s /var/tmp/to_scwrl_225805065.seq -o /var/tmp/from_scwrl_225805065.pdb > /var/tmp/scwrl_225805065.log sh: /var/tmp/scwrl_225805065.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_225805065.pdb or /var/tmp/from_scwrl_225805065.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_225805065_b.pdb or decoys//var/tmp/from_scwrl_225805065_b.pdb.gz for input Trying /var/tmp/from_scwrl_225805065_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_225805065_b.pdb or /var/tmp/from_scwrl_225805065_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_225805065_a.pdb or decoys//var/tmp/from_scwrl_225805065_a.pdb.gz for input Trying /var/tmp/from_scwrl_225805065_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_225805065_a.pdb or /var/tmp/from_scwrl_225805065_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_225805065.pdb or /var/tmp/from_scwrl_225805065_b.pdb or /var/tmp/from_scwrl_225805065_a.pdb Error: no new SCWRL conformation added # 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 359 # copying to AlignedFragments data structure # naming current conformation Zhang-Server_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1389598239.pdb -s /var/tmp/to_scwrl_1389598239.seq -o /var/tmp/from_scwrl_1389598239.pdb > /var/tmp/scwrl_1389598239.log sh: /var/tmp/scwrl_1389598239.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1389598239.pdb or /var/tmp/from_scwrl_1389598239.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1389598239_b.pdb or decoys//var/tmp/from_scwrl_1389598239_b.pdb.gz for input Trying /var/tmp/from_scwrl_1389598239_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1389598239_b.pdb or /var/tmp/from_scwrl_1389598239_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1389598239_a.pdb or decoys//var/tmp/from_scwrl_1389598239_a.pdb.gz for input Trying /var/tmp/from_scwrl_1389598239_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1389598239_a.pdb or /var/tmp/from_scwrl_1389598239_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1389598239.pdb or /var/tmp/from_scwrl_1389598239_b.pdb or /var/tmp/from_scwrl_1389598239_a.pdb Error: no new SCWRL conformation added # 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 370 # copying to AlignedFragments data structure # naming current conformation beautshot_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1384327937.pdb -s /var/tmp/to_scwrl_1384327937.seq -o /var/tmp/from_scwrl_1384327937.pdb > /var/tmp/scwrl_1384327937.log sh: /var/tmp/scwrl_1384327937.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1384327937.pdb or /var/tmp/from_scwrl_1384327937.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1384327937_b.pdb or decoys//var/tmp/from_scwrl_1384327937_b.pdb.gz for input Trying /var/tmp/from_scwrl_1384327937_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1384327937_b.pdb or /var/tmp/from_scwrl_1384327937_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1384327937_a.pdb or decoys//var/tmp/from_scwrl_1384327937_a.pdb.gz for input Trying /var/tmp/from_scwrl_1384327937_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1384327937_a.pdb or /var/tmp/from_scwrl_1384327937_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1384327937.pdb or /var/tmp/from_scwrl_1384327937_b.pdb or /var/tmp/from_scwrl_1384327937_a.pdb Error: no new SCWRL conformation added # naming current conformation beautshot_TS1-scwrl # ReadConformPDB reading from PDB file servers/beautshotbase_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation beautshotbase_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_360452367.pdb -s /var/tmp/to_scwrl_360452367.seq -o /var/tmp/from_scwrl_360452367.pdb > /var/tmp/scwrl_360452367.log sh: /var/tmp/scwrl_360452367.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_360452367.pdb or /var/tmp/from_scwrl_360452367.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_360452367_b.pdb or decoys//var/tmp/from_scwrl_360452367_b.pdb.gz for input Trying /var/tmp/from_scwrl_360452367_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_360452367_b.pdb or /var/tmp/from_scwrl_360452367_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_360452367_a.pdb or decoys//var/tmp/from_scwrl_360452367_a.pdb.gz for input Trying /var/tmp/from_scwrl_360452367_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_360452367_a.pdb or /var/tmp/from_scwrl_360452367_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_360452367.pdb or /var/tmp/from_scwrl_360452367_b.pdb or /var/tmp/from_scwrl_360452367_a.pdb Error: no new SCWRL conformation added # naming current conformation beautshotbase_TS1-scwrl # ReadConformPDB reading from PDB file servers/forecast-s_AL1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation forecast-s_AL1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_2049925951.pdb -s /var/tmp/to_scwrl_2049925951.seq -o /var/tmp/from_scwrl_2049925951.pdb > /var/tmp/scwrl_2049925951.log sh: /var/tmp/scwrl_2049925951.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_2049925951.pdb or /var/tmp/from_scwrl_2049925951.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2049925951_b.pdb or decoys//var/tmp/from_scwrl_2049925951_b.pdb.gz for input Trying /var/tmp/from_scwrl_2049925951_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_2049925951_b.pdb or /var/tmp/from_scwrl_2049925951_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2049925951_a.pdb or decoys//var/tmp/from_scwrl_2049925951_a.pdb.gz for input Trying /var/tmp/from_scwrl_2049925951_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_2049925951_a.pdb or /var/tmp/from_scwrl_2049925951_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_2049925951.pdb or /var/tmp/from_scwrl_2049925951_b.pdb or /var/tmp/from_scwrl_2049925951_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation forecast-s_AL2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1688174130.pdb -s /var/tmp/to_scwrl_1688174130.seq -o /var/tmp/from_scwrl_1688174130.pdb > /var/tmp/scwrl_1688174130.log sh: /var/tmp/scwrl_1688174130.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1688174130.pdb or /var/tmp/from_scwrl_1688174130.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1688174130_b.pdb or decoys//var/tmp/from_scwrl_1688174130_b.pdb.gz for input Trying /var/tmp/from_scwrl_1688174130_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1688174130_b.pdb or /var/tmp/from_scwrl_1688174130_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1688174130_a.pdb or decoys//var/tmp/from_scwrl_1688174130_a.pdb.gz for input Trying /var/tmp/from_scwrl_1688174130_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1688174130_a.pdb or /var/tmp/from_scwrl_1688174130_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1688174130.pdb or /var/tmp/from_scwrl_1688174130_b.pdb or /var/tmp/from_scwrl_1688174130_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation forecast-s_AL3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_54505764.pdb -s /var/tmp/to_scwrl_54505764.seq -o /var/tmp/from_scwrl_54505764.pdb > /var/tmp/scwrl_54505764.log sh: /var/tmp/scwrl_54505764.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_54505764.pdb or /var/tmp/from_scwrl_54505764.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_54505764_b.pdb or decoys//var/tmp/from_scwrl_54505764_b.pdb.gz for input Trying /var/tmp/from_scwrl_54505764_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_54505764_b.pdb or /var/tmp/from_scwrl_54505764_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_54505764_a.pdb or decoys//var/tmp/from_scwrl_54505764_a.pdb.gz for input Trying /var/tmp/from_scwrl_54505764_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_54505764_a.pdb or /var/tmp/from_scwrl_54505764_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_54505764.pdb or /var/tmp/from_scwrl_54505764_b.pdb or /var/tmp/from_scwrl_54505764_a.pdb Error: no new SCWRL conformation added # naming current conformation forecast-s_AL3-scwrl # ReadConformPDB reading from PDB file servers/forecast-s_AL4.pdb.gz looking for model 1 Skipped atom 334, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 336, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 338, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 340, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 342, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 344, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 346, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 348, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 350, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 352, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 354, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz Skipped atom 356, because occupancy 1.000 <= existing 1.000 in servers/forecast-s_AL4.pdb.gz # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation forecast-s_AL4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1324319174.pdb -s /var/tmp/to_scwrl_1324319174.seq -o /var/tmp/from_scwrl_1324319174.pdb > /var/tmp/scwrl_1324319174.log sh: /var/tmp/scwrl_1324319174.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1324319174.pdb or /var/tmp/from_scwrl_1324319174.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1324319174_b.pdb or decoys//var/tmp/from_scwrl_1324319174_b.pdb.gz for input Trying /var/tmp/from_scwrl_1324319174_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1324319174_b.pdb or /var/tmp/from_scwrl_1324319174_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1324319174_a.pdb or decoys//var/tmp/from_scwrl_1324319174_a.pdb.gz for input Trying /var/tmp/from_scwrl_1324319174_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1324319174_a.pdb or /var/tmp/from_scwrl_1324319174_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1324319174.pdb or /var/tmp/from_scwrl_1324319174_b.pdb or /var/tmp/from_scwrl_1324319174_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation forecast-s_AL5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1428123275.pdb -s /var/tmp/to_scwrl_1428123275.seq -o /var/tmp/from_scwrl_1428123275.pdb > /var/tmp/scwrl_1428123275.log sh: /var/tmp/scwrl_1428123275.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1428123275.pdb or /var/tmp/from_scwrl_1428123275.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1428123275_b.pdb or decoys//var/tmp/from_scwrl_1428123275_b.pdb.gz for input Trying /var/tmp/from_scwrl_1428123275_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1428123275_b.pdb or /var/tmp/from_scwrl_1428123275_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1428123275_a.pdb or decoys//var/tmp/from_scwrl_1428123275_a.pdb.gz for input Trying /var/tmp/from_scwrl_1428123275_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1428123275_a.pdb or /var/tmp/from_scwrl_1428123275_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1428123275.pdb or /var/tmp/from_scwrl_1428123275_b.pdb or /var/tmp/from_scwrl_1428123275_a.pdb Error: no new SCWRL conformation added # naming current conformation forecast-s_AL5-scwrl # ReadConformPDB reading from PDB file servers/gtg_AL1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation gtg_AL1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_790677093.pdb -s /var/tmp/to_scwrl_790677093.seq -o /var/tmp/from_scwrl_790677093.pdb > /var/tmp/scwrl_790677093.log sh: /var/tmp/scwrl_790677093.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_790677093.pdb or /var/tmp/from_scwrl_790677093.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_790677093_b.pdb or decoys//var/tmp/from_scwrl_790677093_b.pdb.gz for input Trying /var/tmp/from_scwrl_790677093_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_790677093_b.pdb or /var/tmp/from_scwrl_790677093_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_790677093_a.pdb or decoys//var/tmp/from_scwrl_790677093_a.pdb.gz for input Trying /var/tmp/from_scwrl_790677093_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_790677093_a.pdb or /var/tmp/from_scwrl_790677093_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_790677093.pdb or /var/tmp/from_scwrl_790677093_b.pdb or /var/tmp/from_scwrl_790677093_a.pdb Error: no new SCWRL conformation added # naming current conformation gtg_AL1-scwrl # ReadConformPDB reading from PDB file servers/gtg_AL2.pdb.gz looking for model 1 Skipped atom 278, because occupancy 1.000 <= existing 1.000 in servers/gtg_AL2.pdb.gz Skipped atom 280, because occupancy 1.000 <= existing 1.000 in servers/gtg_AL2.pdb.gz Skipped atom 282, because occupancy 1.000 <= existing 1.000 in servers/gtg_AL2.pdb.gz Skipped atom 284, because occupancy 1.000 <= existing 1.000 in servers/gtg_AL2.pdb.gz Skipped atom 286, because occupancy 1.000 <= existing 1.000 in servers/gtg_AL2.pdb.gz Skipped atom 288, because occupancy 1.000 <= existing 1.000 in servers/gtg_AL2.pdb.gz Skipped atom 290, because occupancy 1.000 <= existing 1.000 in servers/gtg_AL2.pdb.gz Skipped atom 292, because occupancy 1.000 <= existing 1.000 in servers/gtg_AL2.pdb.gz Skipped atom 606, because occupancy 1.000 <= existing 1.000 in servers/gtg_AL2.pdb.gz Skipped atom 608, because occupancy 1.000 <= existing 1.000 in servers/gtg_AL2.pdb.gz Skipped atom 610, because occupancy 1.000 <= existing 1.000 in servers/gtg_AL2.pdb.gz Skipped atom 612, because occupancy 1.000 <= existing 1.000 in servers/gtg_AL2.pdb.gz Skipped atom 622, because occupancy 1.000 <= existing 1.000 in servers/gtg_AL2.pdb.gz Skipped atom 624, because occupancy 1.000 <= existing 1.000 in servers/gtg_AL2.pdb.gz Skipped atom 626, because occupancy 1.000 <= existing 1.000 in servers/gtg_AL2.pdb.gz Skipped atom 628, because occupancy 1.000 <= existing 1.000 in servers/gtg_AL2.pdb.gz Skipped atom 734, because occupancy 1.000 <= existing 1.000 in servers/gtg_AL2.pdb.gz Skipped atom 736, because occupancy 1.000 <= existing 1.000 in servers/gtg_AL2.pdb.gz Skipped atom 738, because occupancy 1.000 <= existing 1.000 in servers/gtg_AL2.pdb.gz Skipped atom 740, because occupancy 1.000 <= existing 1.000 in servers/gtg_AL2.pdb.gz Skipped atom 934, because occupancy 1.000 <= existing 1.000 in servers/gtg_AL2.pdb.gz Skipped atom 936, because occupancy 1.000 <= existing 1.000 in servers/gtg_AL2.pdb.gz Skipped atom 938, because occupancy 1.000 <= existing 1.000 in servers/gtg_AL2.pdb.gz Skipped atom 940, because occupancy 1.000 <= existing 1.000 in servers/gtg_AL2.pdb.gz Skipped atom 1042, because occupancy 1.000 <= existing 1.000 in servers/gtg_AL2.pdb.gz Skipped atom 1044, because occupancy 1.000 <= existing 1.000 in servers/gtg_AL2.pdb.gz Skipped atom 1046, because occupancy 1.000 <= existing 1.000 in servers/gtg_AL2.pdb.gz Skipped atom 1048, because occupancy 1.000 <= existing 1.000 in servers/gtg_AL2.pdb.gz # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation gtg_AL2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_539841720.pdb -s /var/tmp/to_scwrl_539841720.seq -o /var/tmp/from_scwrl_539841720.pdb > /var/tmp/scwrl_539841720.log sh: /var/tmp/scwrl_539841720.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_539841720.pdb or /var/tmp/from_scwrl_539841720.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_539841720_b.pdb or decoys//var/tmp/from_scwrl_539841720_b.pdb.gz for input Trying /var/tmp/from_scwrl_539841720_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_539841720_b.pdb or /var/tmp/from_scwrl_539841720_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_539841720_a.pdb or decoys//var/tmp/from_scwrl_539841720_a.pdb.gz for input Trying /var/tmp/from_scwrl_539841720_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_539841720_a.pdb or /var/tmp/from_scwrl_539841720_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_539841720.pdb or /var/tmp/from_scwrl_539841720_b.pdb or /var/tmp/from_scwrl_539841720_a.pdb Error: no new SCWRL conformation added # naming current conformation gtg_AL2-scwrl # ReadConformPDB reading from PDB file servers/gtg_AL3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation gtg_AL3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_559014810.pdb -s /var/tmp/to_scwrl_559014810.seq -o /var/tmp/from_scwrl_559014810.pdb > /var/tmp/scwrl_559014810.log sh: /var/tmp/scwrl_559014810.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_559014810.pdb or /var/tmp/from_scwrl_559014810.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_559014810_b.pdb or decoys//var/tmp/from_scwrl_559014810_b.pdb.gz for input Trying /var/tmp/from_scwrl_559014810_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_559014810_b.pdb or /var/tmp/from_scwrl_559014810_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_559014810_a.pdb or decoys//var/tmp/from_scwrl_559014810_a.pdb.gz for input Trying /var/tmp/from_scwrl_559014810_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_559014810_a.pdb or /var/tmp/from_scwrl_559014810_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_559014810.pdb or /var/tmp/from_scwrl_559014810_b.pdb or /var/tmp/from_scwrl_559014810_a.pdb Error: no new SCWRL conformation added # naming current conformation gtg_AL3-scwrl # ReadConformPDB reading from PDB file servers/gtg_AL4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation gtg_AL4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1457315300.pdb -s /var/tmp/to_scwrl_1457315300.seq -o /var/tmp/from_scwrl_1457315300.pdb > /var/tmp/scwrl_1457315300.log sh: /var/tmp/scwrl_1457315300.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1457315300.pdb or /var/tmp/from_scwrl_1457315300.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1457315300_b.pdb or decoys//var/tmp/from_scwrl_1457315300_b.pdb.gz for input Trying /var/tmp/from_scwrl_1457315300_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1457315300_b.pdb or /var/tmp/from_scwrl_1457315300_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1457315300_a.pdb or decoys//var/tmp/from_scwrl_1457315300_a.pdb.gz for input Trying /var/tmp/from_scwrl_1457315300_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1457315300_a.pdb or /var/tmp/from_scwrl_1457315300_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1457315300.pdb or /var/tmp/from_scwrl_1457315300_b.pdb or /var/tmp/from_scwrl_1457315300_a.pdb Error: no new SCWRL conformation added # naming current conformation gtg_AL4-scwrl # ReadConformPDB reading from PDB file servers/gtg_AL5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation gtg_AL5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1430491328.pdb -s /var/tmp/to_scwrl_1430491328.seq -o /var/tmp/from_scwrl_1430491328.pdb > /var/tmp/scwrl_1430491328.log sh: /var/tmp/scwrl_1430491328.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1430491328.pdb or /var/tmp/from_scwrl_1430491328.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1430491328_b.pdb or decoys//var/tmp/from_scwrl_1430491328_b.pdb.gz for input Trying /var/tmp/from_scwrl_1430491328_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1430491328_b.pdb or /var/tmp/from_scwrl_1430491328_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1430491328_a.pdb or decoys//var/tmp/from_scwrl_1430491328_a.pdb.gz for input Trying /var/tmp/from_scwrl_1430491328_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1430491328_a.pdb or /var/tmp/from_scwrl_1430491328_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1430491328.pdb or /var/tmp/from_scwrl_1430491328_b.pdb or /var/tmp/from_scwrl_1430491328_a.pdb Error: no new SCWRL conformation added # naming current conformation gtg_AL5-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv.2_TS1.pdb.gz looking for model 1 # Found a chain break before 317 # copying to AlignedFragments data structure # naming current conformation karypis.srv.2_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_931926830.pdb -s /var/tmp/to_scwrl_931926830.seq -o /var/tmp/from_scwrl_931926830.pdb > /var/tmp/scwrl_931926830.log sh: /var/tmp/scwrl_931926830.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_931926830.pdb or /var/tmp/from_scwrl_931926830.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_931926830_b.pdb or decoys//var/tmp/from_scwrl_931926830_b.pdb.gz for input Trying /var/tmp/from_scwrl_931926830_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_931926830_b.pdb or /var/tmp/from_scwrl_931926830_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_931926830_a.pdb or decoys//var/tmp/from_scwrl_931926830_a.pdb.gz for input Trying /var/tmp/from_scwrl_931926830_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_931926830_a.pdb or /var/tmp/from_scwrl_931926830_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_931926830.pdb or /var/tmp/from_scwrl_931926830_b.pdb or /var/tmp/from_scwrl_931926830_a.pdb Error: no new SCWRL conformation added # 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 340 # copying to AlignedFragments data structure # naming current conformation karypis.srv.2_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_831778097.pdb -s /var/tmp/to_scwrl_831778097.seq -o /var/tmp/from_scwrl_831778097.pdb > /var/tmp/scwrl_831778097.log sh: /var/tmp/scwrl_831778097.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_831778097.pdb or /var/tmp/from_scwrl_831778097.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_831778097_b.pdb or decoys//var/tmp/from_scwrl_831778097_b.pdb.gz for input Trying /var/tmp/from_scwrl_831778097_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_831778097_b.pdb or /var/tmp/from_scwrl_831778097_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_831778097_a.pdb or decoys//var/tmp/from_scwrl_831778097_a.pdb.gz for input Trying /var/tmp/from_scwrl_831778097_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_831778097_a.pdb or /var/tmp/from_scwrl_831778097_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_831778097.pdb or /var/tmp/from_scwrl_831778097_b.pdb or /var/tmp/from_scwrl_831778097_a.pdb Error: no new SCWRL conformation added # naming current conformation karypis.srv.2_TS2-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv.2_TS3.pdb.gz looking for model 1 # Found a chain break before 359 # copying to AlignedFragments data structure # naming current conformation karypis.srv.2_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1670151655.pdb -s /var/tmp/to_scwrl_1670151655.seq -o /var/tmp/from_scwrl_1670151655.pdb > /var/tmp/scwrl_1670151655.log sh: /var/tmp/scwrl_1670151655.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1670151655.pdb or /var/tmp/from_scwrl_1670151655.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1670151655_b.pdb or decoys//var/tmp/from_scwrl_1670151655_b.pdb.gz for input Trying /var/tmp/from_scwrl_1670151655_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1670151655_b.pdb or /var/tmp/from_scwrl_1670151655_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1670151655_a.pdb or decoys//var/tmp/from_scwrl_1670151655_a.pdb.gz for input Trying /var/tmp/from_scwrl_1670151655_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1670151655_a.pdb or /var/tmp/from_scwrl_1670151655_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1670151655.pdb or /var/tmp/from_scwrl_1670151655_b.pdb or /var/tmp/from_scwrl_1670151655_a.pdb Error: no new SCWRL conformation added # 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 317 # copying to AlignedFragments data structure # naming current conformation karypis.srv.2_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_190074426.pdb -s /var/tmp/to_scwrl_190074426.seq -o /var/tmp/from_scwrl_190074426.pdb > /var/tmp/scwrl_190074426.log sh: /var/tmp/scwrl_190074426.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_190074426.pdb or /var/tmp/from_scwrl_190074426.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_190074426_b.pdb or decoys//var/tmp/from_scwrl_190074426_b.pdb.gz for input Trying /var/tmp/from_scwrl_190074426_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_190074426_b.pdb or /var/tmp/from_scwrl_190074426_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_190074426_a.pdb or decoys//var/tmp/from_scwrl_190074426_a.pdb.gz for input Trying /var/tmp/from_scwrl_190074426_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_190074426_a.pdb or /var/tmp/from_scwrl_190074426_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_190074426.pdb or /var/tmp/from_scwrl_190074426_b.pdb or /var/tmp/from_scwrl_190074426_a.pdb Error: no new SCWRL conformation added # 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 317 # copying to AlignedFragments data structure # naming current conformation karypis.srv.2_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1956894961.pdb -s /var/tmp/to_scwrl_1956894961.seq -o /var/tmp/from_scwrl_1956894961.pdb > /var/tmp/scwrl_1956894961.log sh: /var/tmp/scwrl_1956894961.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1956894961.pdb or /var/tmp/from_scwrl_1956894961.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1956894961_b.pdb or decoys//var/tmp/from_scwrl_1956894961_b.pdb.gz for input Trying /var/tmp/from_scwrl_1956894961_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1956894961_b.pdb or /var/tmp/from_scwrl_1956894961_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1956894961_a.pdb or decoys//var/tmp/from_scwrl_1956894961_a.pdb.gz for input Trying /var/tmp/from_scwrl_1956894961_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1956894961_a.pdb or /var/tmp/from_scwrl_1956894961_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1956894961.pdb or /var/tmp/from_scwrl_1956894961_b.pdb or /var/tmp/from_scwrl_1956894961_a.pdb Error: no new SCWRL conformation added # 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: (T0316)G172.O and (T0316)H173.N only 0.000 apart, marking (T0316)H173.N as missing WARNING: atoms too close: (T0316)H280.O and (T0316)D281.N only 0.000 apart, marking (T0316)D281.N as missing WARNING: atoms too close: (T0316)Y364.O and (T0316)R365.N only 0.000 apart, marking (T0316)R365.N as missing # WARNING: incomplete conformation T0316 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 336 ; scwrl3 -i /var/tmp/to_scwrl_1774189886.pdb -s /var/tmp/to_scwrl_1774189886.seq -o /var/tmp/from_scwrl_1774189886.pdb > /var/tmp/scwrl_1774189886.log sh: /var/tmp/scwrl_1774189886.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1774189886.pdb or /var/tmp/from_scwrl_1774189886.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1774189886_b.pdb or decoys//var/tmp/from_scwrl_1774189886_b.pdb.gz for input Trying /var/tmp/from_scwrl_1774189886_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1774189886_b.pdb or /var/tmp/from_scwrl_1774189886_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1774189886_a.pdb or decoys//var/tmp/from_scwrl_1774189886_a.pdb.gz for input Trying /var/tmp/from_scwrl_1774189886_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1774189886_a.pdb or /var/tmp/from_scwrl_1774189886_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1774189886.pdb or /var/tmp/from_scwrl_1774189886_b.pdb or /var/tmp/from_scwrl_1774189886_a.pdb Error: no new SCWRL conformation added # naming current conformation karypis.srv.4_TS1-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv.4_TS2.pdb.gz looking for model 1 # Found a chain break before 370 # copying to AlignedFragments data structure # naming current conformation karypis.srv.4_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_191406078.pdb -s /var/tmp/to_scwrl_191406078.seq -o /var/tmp/from_scwrl_191406078.pdb > /var/tmp/scwrl_191406078.log sh: /var/tmp/scwrl_191406078.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_191406078.pdb or /var/tmp/from_scwrl_191406078.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_191406078_b.pdb or decoys//var/tmp/from_scwrl_191406078_b.pdb.gz for input Trying /var/tmp/from_scwrl_191406078_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_191406078_b.pdb or /var/tmp/from_scwrl_191406078_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_191406078_a.pdb or decoys//var/tmp/from_scwrl_191406078_a.pdb.gz for input Trying /var/tmp/from_scwrl_191406078_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_191406078_a.pdb or /var/tmp/from_scwrl_191406078_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_191406078.pdb or /var/tmp/from_scwrl_191406078_b.pdb or /var/tmp/from_scwrl_191406078_a.pdb Error: no new SCWRL conformation added # naming current conformation karypis.srv.4_TS2-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv.4_TS3.pdb.gz looking for model 1 WARNING: atoms too close: (T0316)I202.O and (T0316)G203.N only 0.000 apart, marking (T0316)G203.N as missing WARNING: atoms too close: (T0316)G264.O and (T0316)K265.N only 0.000 apart, marking (T0316)K265.N as missing # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation karypis.srv.4_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1736801259.pdb -s /var/tmp/to_scwrl_1736801259.seq -o /var/tmp/from_scwrl_1736801259.pdb > /var/tmp/scwrl_1736801259.log sh: /var/tmp/scwrl_1736801259.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1736801259.pdb or /var/tmp/from_scwrl_1736801259.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1736801259_b.pdb or decoys//var/tmp/from_scwrl_1736801259_b.pdb.gz for input Trying /var/tmp/from_scwrl_1736801259_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1736801259_b.pdb or /var/tmp/from_scwrl_1736801259_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1736801259_a.pdb or decoys//var/tmp/from_scwrl_1736801259_a.pdb.gz for input Trying /var/tmp/from_scwrl_1736801259_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1736801259_a.pdb or /var/tmp/from_scwrl_1736801259_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1736801259.pdb or /var/tmp/from_scwrl_1736801259_b.pdb or /var/tmp/from_scwrl_1736801259_a.pdb Error: no new SCWRL conformation added # naming current conformation karypis.srv.4_TS3-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv.4_TS4.pdb.gz looking for model 1 WARNING: atoms too close: (T0316)L143.O and (T0316)R144.N only 0.000 apart, marking (T0316)R144.N as missing WARNING: atoms too close: (T0316)R312.O and (T0316)Y313.N only 0.000 apart, marking (T0316)Y313.N as missing # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # copying to AlignedFragments data structure # naming current conformation karypis.srv.4_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1537038434.pdb -s /var/tmp/to_scwrl_1537038434.seq -o /var/tmp/from_scwrl_1537038434.pdb > /var/tmp/scwrl_1537038434.log sh: /var/tmp/scwrl_1537038434.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1537038434.pdb or /var/tmp/from_scwrl_1537038434.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1537038434_b.pdb or decoys//var/tmp/from_scwrl_1537038434_b.pdb.gz for input Trying /var/tmp/from_scwrl_1537038434_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1537038434_b.pdb or /var/tmp/from_scwrl_1537038434_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1537038434_a.pdb or decoys//var/tmp/from_scwrl_1537038434_a.pdb.gz for input Trying /var/tmp/from_scwrl_1537038434_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1537038434_a.pdb or /var/tmp/from_scwrl_1537038434_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1537038434.pdb or /var/tmp/from_scwrl_1537038434_b.pdb or /var/tmp/from_scwrl_1537038434_a.pdb Error: no new SCWRL conformation added # 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: (T0316)C50.O and (T0316)T51.N only 0.000 apart, marking (T0316)T51.N as missing WARNING: atoms too close: (T0316)A186.O and (T0316)G187.N only 0.000 apart, marking (T0316)G187.N as missing WARNING: atoms too close: (T0316)T304.O and (T0316)L305.N only 0.000 apart, marking (T0316)L305.N as missing WARNING: atoms too close: (T0316)Y349.O and (T0316)D350.N only 0.000 apart, marking (T0316)D350.N as missing # WARNING: incomplete conformation T0316 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 336 ; scwrl3 -i /var/tmp/to_scwrl_1157107923.pdb -s /var/tmp/to_scwrl_1157107923.seq -o /var/tmp/from_scwrl_1157107923.pdb > /var/tmp/scwrl_1157107923.log sh: /var/tmp/scwrl_1157107923.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1157107923.pdb or /var/tmp/from_scwrl_1157107923.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1157107923_b.pdb or decoys//var/tmp/from_scwrl_1157107923_b.pdb.gz for input Trying /var/tmp/from_scwrl_1157107923_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1157107923_b.pdb or /var/tmp/from_scwrl_1157107923_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1157107923_a.pdb or decoys//var/tmp/from_scwrl_1157107923_a.pdb.gz for input Trying /var/tmp/from_scwrl_1157107923_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1157107923_a.pdb or /var/tmp/from_scwrl_1157107923_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1157107923.pdb or /var/tmp/from_scwrl_1157107923_b.pdb or /var/tmp/from_scwrl_1157107923_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation karypis.srv_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1340932568.pdb -s /var/tmp/to_scwrl_1340932568.seq -o /var/tmp/from_scwrl_1340932568.pdb > /var/tmp/scwrl_1340932568.log sh: /var/tmp/scwrl_1340932568.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1340932568.pdb or /var/tmp/from_scwrl_1340932568.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1340932568_b.pdb or decoys//var/tmp/from_scwrl_1340932568_b.pdb.gz for input Trying /var/tmp/from_scwrl_1340932568_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1340932568_b.pdb or /var/tmp/from_scwrl_1340932568_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1340932568_a.pdb or decoys//var/tmp/from_scwrl_1340932568_a.pdb.gz for input Trying /var/tmp/from_scwrl_1340932568_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1340932568_a.pdb or /var/tmp/from_scwrl_1340932568_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1340932568.pdb or /var/tmp/from_scwrl_1340932568_b.pdb or /var/tmp/from_scwrl_1340932568_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation karypis.srv_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_352596881.pdb -s /var/tmp/to_scwrl_352596881.seq -o /var/tmp/from_scwrl_352596881.pdb > /var/tmp/scwrl_352596881.log sh: /var/tmp/scwrl_352596881.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_352596881.pdb or /var/tmp/from_scwrl_352596881.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_352596881_b.pdb or decoys//var/tmp/from_scwrl_352596881_b.pdb.gz for input Trying /var/tmp/from_scwrl_352596881_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_352596881_b.pdb or /var/tmp/from_scwrl_352596881_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_352596881_a.pdb or decoys//var/tmp/from_scwrl_352596881_a.pdb.gz for input Trying /var/tmp/from_scwrl_352596881_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_352596881_a.pdb or /var/tmp/from_scwrl_352596881_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_352596881.pdb or /var/tmp/from_scwrl_352596881_b.pdb or /var/tmp/from_scwrl_352596881_a.pdb Error: no new SCWRL conformation added # naming current conformation karypis.srv_TS2-scwrl # ReadConformPDB reading from PDB file servers/karypis.srv_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation karypis.srv_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_565505042.pdb -s /var/tmp/to_scwrl_565505042.seq -o /var/tmp/from_scwrl_565505042.pdb > /var/tmp/scwrl_565505042.log sh: /var/tmp/scwrl_565505042.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_565505042.pdb or /var/tmp/from_scwrl_565505042.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_565505042_b.pdb or decoys//var/tmp/from_scwrl_565505042_b.pdb.gz for input Trying /var/tmp/from_scwrl_565505042_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_565505042_b.pdb or /var/tmp/from_scwrl_565505042_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_565505042_a.pdb or decoys//var/tmp/from_scwrl_565505042_a.pdb.gz for input Trying /var/tmp/from_scwrl_565505042_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_565505042_a.pdb or /var/tmp/from_scwrl_565505042_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_565505042.pdb or /var/tmp/from_scwrl_565505042_b.pdb or /var/tmp/from_scwrl_565505042_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation karypis.srv_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_805950231.pdb -s /var/tmp/to_scwrl_805950231.seq -o /var/tmp/from_scwrl_805950231.pdb > /var/tmp/scwrl_805950231.log sh: /var/tmp/scwrl_805950231.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_805950231.pdb or /var/tmp/from_scwrl_805950231.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_805950231_b.pdb or decoys//var/tmp/from_scwrl_805950231_b.pdb.gz for input Trying /var/tmp/from_scwrl_805950231_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_805950231_b.pdb or /var/tmp/from_scwrl_805950231_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_805950231_a.pdb or decoys//var/tmp/from_scwrl_805950231_a.pdb.gz for input Trying /var/tmp/from_scwrl_805950231_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_805950231_a.pdb or /var/tmp/from_scwrl_805950231_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_805950231.pdb or /var/tmp/from_scwrl_805950231_b.pdb or /var/tmp/from_scwrl_805950231_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation karypis.srv_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1218601519.pdb -s /var/tmp/to_scwrl_1218601519.seq -o /var/tmp/from_scwrl_1218601519.pdb > /var/tmp/scwrl_1218601519.log sh: /var/tmp/scwrl_1218601519.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1218601519.pdb or /var/tmp/from_scwrl_1218601519.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1218601519_b.pdb or decoys//var/tmp/from_scwrl_1218601519_b.pdb.gz for input Trying /var/tmp/from_scwrl_1218601519_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1218601519_b.pdb or /var/tmp/from_scwrl_1218601519_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1218601519_a.pdb or decoys//var/tmp/from_scwrl_1218601519_a.pdb.gz for input Trying /var/tmp/from_scwrl_1218601519_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1218601519_a.pdb or /var/tmp/from_scwrl_1218601519_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1218601519.pdb or /var/tmp/from_scwrl_1218601519_b.pdb or /var/tmp/from_scwrl_1218601519_a.pdb Error: no new SCWRL conformation added # naming current conformation karypis.srv_TS5-scwrl # ReadConformPDB reading from PDB file servers/keasar-server_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation keasar-server_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_628763683.pdb -s /var/tmp/to_scwrl_628763683.seq -o /var/tmp/from_scwrl_628763683.pdb > /var/tmp/scwrl_628763683.log sh: /var/tmp/scwrl_628763683.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_628763683.pdb or /var/tmp/from_scwrl_628763683.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_628763683_b.pdb or decoys//var/tmp/from_scwrl_628763683_b.pdb.gz for input Trying /var/tmp/from_scwrl_628763683_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_628763683_b.pdb or /var/tmp/from_scwrl_628763683_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_628763683_a.pdb or decoys//var/tmp/from_scwrl_628763683_a.pdb.gz for input Trying /var/tmp/from_scwrl_628763683_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_628763683_a.pdb or /var/tmp/from_scwrl_628763683_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_628763683.pdb or /var/tmp/from_scwrl_628763683_b.pdb or /var/tmp/from_scwrl_628763683_a.pdb Error: no new SCWRL conformation added # naming current conformation keasar-server_TS1-scwrl # ReadConformPDB reading from PDB file servers/keasar-server_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation keasar-server_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_39980097.pdb -s /var/tmp/to_scwrl_39980097.seq -o /var/tmp/from_scwrl_39980097.pdb > /var/tmp/scwrl_39980097.log sh: /var/tmp/scwrl_39980097.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_39980097.pdb or /var/tmp/from_scwrl_39980097.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_39980097_b.pdb or decoys//var/tmp/from_scwrl_39980097_b.pdb.gz for input Trying /var/tmp/from_scwrl_39980097_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_39980097_b.pdb or /var/tmp/from_scwrl_39980097_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_39980097_a.pdb or decoys//var/tmp/from_scwrl_39980097_a.pdb.gz for input Trying /var/tmp/from_scwrl_39980097_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_39980097_a.pdb or /var/tmp/from_scwrl_39980097_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_39980097.pdb or /var/tmp/from_scwrl_39980097_b.pdb or /var/tmp/from_scwrl_39980097_a.pdb Error: no new SCWRL conformation added # naming current conformation keasar-server_TS2-scwrl # ReadConformPDB reading from PDB file servers/keasar-server_TS3.pdb.gz looking for model 1 # Found a chain break before 310 # copying to AlignedFragments data structure # naming current conformation keasar-server_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1444406585.pdb -s /var/tmp/to_scwrl_1444406585.seq -o /var/tmp/from_scwrl_1444406585.pdb > /var/tmp/scwrl_1444406585.log sh: /var/tmp/scwrl_1444406585.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1444406585.pdb or /var/tmp/from_scwrl_1444406585.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1444406585_b.pdb or decoys//var/tmp/from_scwrl_1444406585_b.pdb.gz for input Trying /var/tmp/from_scwrl_1444406585_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1444406585_b.pdb or /var/tmp/from_scwrl_1444406585_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1444406585_a.pdb or decoys//var/tmp/from_scwrl_1444406585_a.pdb.gz for input Trying /var/tmp/from_scwrl_1444406585_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1444406585_a.pdb or /var/tmp/from_scwrl_1444406585_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1444406585.pdb or /var/tmp/from_scwrl_1444406585_b.pdb or /var/tmp/from_scwrl_1444406585_a.pdb Error: no new SCWRL conformation added # naming current conformation keasar-server_TS3-scwrl # ReadConformPDB reading from PDB file servers/keasar-server_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation keasar-server_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_2018361922.pdb -s /var/tmp/to_scwrl_2018361922.seq -o /var/tmp/from_scwrl_2018361922.pdb > /var/tmp/scwrl_2018361922.log sh: /var/tmp/scwrl_2018361922.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_2018361922.pdb or /var/tmp/from_scwrl_2018361922.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2018361922_b.pdb or decoys//var/tmp/from_scwrl_2018361922_b.pdb.gz for input Trying /var/tmp/from_scwrl_2018361922_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_2018361922_b.pdb or /var/tmp/from_scwrl_2018361922_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_2018361922_a.pdb or decoys//var/tmp/from_scwrl_2018361922_a.pdb.gz for input Trying /var/tmp/from_scwrl_2018361922_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_2018361922_a.pdb or /var/tmp/from_scwrl_2018361922_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_2018361922.pdb or /var/tmp/from_scwrl_2018361922_b.pdb or /var/tmp/from_scwrl_2018361922_a.pdb Error: no new SCWRL conformation added # naming current conformation keasar-server_TS4-scwrl # ReadConformPDB reading from PDB file servers/keasar-server_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation keasar-server_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1424308035.pdb -s /var/tmp/to_scwrl_1424308035.seq -o /var/tmp/from_scwrl_1424308035.pdb > /var/tmp/scwrl_1424308035.log sh: /var/tmp/scwrl_1424308035.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1424308035.pdb or /var/tmp/from_scwrl_1424308035.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1424308035_b.pdb or decoys//var/tmp/from_scwrl_1424308035_b.pdb.gz for input Trying /var/tmp/from_scwrl_1424308035_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1424308035_b.pdb or /var/tmp/from_scwrl_1424308035_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1424308035_a.pdb or decoys//var/tmp/from_scwrl_1424308035_a.pdb.gz for input Trying /var/tmp/from_scwrl_1424308035_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1424308035_a.pdb or /var/tmp/from_scwrl_1424308035_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1424308035.pdb or /var/tmp/from_scwrl_1424308035_b.pdb or /var/tmp/from_scwrl_1424308035_a.pdb Error: no new SCWRL conformation added # 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 T0316 can't currently be optimized by undertaker # naming current conformation mGen-3D_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1804858952.pdb -s /var/tmp/to_scwrl_1804858952.seq -o /var/tmp/from_scwrl_1804858952.pdb > /var/tmp/scwrl_1804858952.log sh: /var/tmp/scwrl_1804858952.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1804858952.pdb or /var/tmp/from_scwrl_1804858952.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1804858952_b.pdb or decoys//var/tmp/from_scwrl_1804858952_b.pdb.gz for input Trying /var/tmp/from_scwrl_1804858952_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1804858952_b.pdb or /var/tmp/from_scwrl_1804858952_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1804858952_a.pdb or decoys//var/tmp/from_scwrl_1804858952_a.pdb.gz for input Trying /var/tmp/from_scwrl_1804858952_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1804858952_a.pdb or /var/tmp/from_scwrl_1804858952_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1804858952.pdb or /var/tmp/from_scwrl_1804858952_b.pdb or /var/tmp/from_scwrl_1804858952_a.pdb Error: no new SCWRL conformation added # naming current conformation mGen-3D_TS1-scwrl # ReadConformPDB reading from PDB file servers/nFOLD_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation nFOLD_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1920804227.pdb -s /var/tmp/to_scwrl_1920804227.seq -o /var/tmp/from_scwrl_1920804227.pdb > /var/tmp/scwrl_1920804227.log sh: /var/tmp/scwrl_1920804227.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1920804227.pdb or /var/tmp/from_scwrl_1920804227.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1920804227_b.pdb or decoys//var/tmp/from_scwrl_1920804227_b.pdb.gz for input Trying /var/tmp/from_scwrl_1920804227_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1920804227_b.pdb or /var/tmp/from_scwrl_1920804227_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1920804227_a.pdb or decoys//var/tmp/from_scwrl_1920804227_a.pdb.gz for input Trying /var/tmp/from_scwrl_1920804227_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1920804227_a.pdb or /var/tmp/from_scwrl_1920804227_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1920804227.pdb or /var/tmp/from_scwrl_1920804227_b.pdb or /var/tmp/from_scwrl_1920804227_a.pdb Error: no new SCWRL conformation added # naming current conformation nFOLD_TS1-scwrl # ReadConformPDB reading from PDB file servers/nFOLD_TS2.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation nFOLD_TS2 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_964998519.pdb -s /var/tmp/to_scwrl_964998519.seq -o /var/tmp/from_scwrl_964998519.pdb > /var/tmp/scwrl_964998519.log sh: /var/tmp/scwrl_964998519.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_964998519.pdb or /var/tmp/from_scwrl_964998519.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_964998519_b.pdb or decoys//var/tmp/from_scwrl_964998519_b.pdb.gz for input Trying /var/tmp/from_scwrl_964998519_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_964998519_b.pdb or /var/tmp/from_scwrl_964998519_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_964998519_a.pdb or decoys//var/tmp/from_scwrl_964998519_a.pdb.gz for input Trying /var/tmp/from_scwrl_964998519_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_964998519_a.pdb or /var/tmp/from_scwrl_964998519_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_964998519.pdb or /var/tmp/from_scwrl_964998519_b.pdb or /var/tmp/from_scwrl_964998519_a.pdb Error: no new SCWRL conformation added # naming current conformation nFOLD_TS2-scwrl # ReadConformPDB reading from PDB file servers/nFOLD_TS3.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation nFOLD_TS3 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1859364716.pdb -s /var/tmp/to_scwrl_1859364716.seq -o /var/tmp/from_scwrl_1859364716.pdb > /var/tmp/scwrl_1859364716.log sh: /var/tmp/scwrl_1859364716.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1859364716.pdb or /var/tmp/from_scwrl_1859364716.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1859364716_b.pdb or decoys//var/tmp/from_scwrl_1859364716_b.pdb.gz for input Trying /var/tmp/from_scwrl_1859364716_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1859364716_b.pdb or /var/tmp/from_scwrl_1859364716_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1859364716_a.pdb or decoys//var/tmp/from_scwrl_1859364716_a.pdb.gz for input Trying /var/tmp/from_scwrl_1859364716_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1859364716_a.pdb or /var/tmp/from_scwrl_1859364716_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1859364716.pdb or /var/tmp/from_scwrl_1859364716_b.pdb or /var/tmp/from_scwrl_1859364716_a.pdb Error: no new SCWRL conformation added # naming current conformation nFOLD_TS3-scwrl # ReadConformPDB reading from PDB file servers/nFOLD_TS4.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation nFOLD_TS4 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1097639754.pdb -s /var/tmp/to_scwrl_1097639754.seq -o /var/tmp/from_scwrl_1097639754.pdb > /var/tmp/scwrl_1097639754.log sh: /var/tmp/scwrl_1097639754.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1097639754.pdb or /var/tmp/from_scwrl_1097639754.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1097639754_b.pdb or decoys//var/tmp/from_scwrl_1097639754_b.pdb.gz for input Trying /var/tmp/from_scwrl_1097639754_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1097639754_b.pdb or /var/tmp/from_scwrl_1097639754_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1097639754_a.pdb or decoys//var/tmp/from_scwrl_1097639754_a.pdb.gz for input Trying /var/tmp/from_scwrl_1097639754_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1097639754_a.pdb or /var/tmp/from_scwrl_1097639754_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1097639754.pdb or /var/tmp/from_scwrl_1097639754_b.pdb or /var/tmp/from_scwrl_1097639754_a.pdb Error: no new SCWRL conformation added # naming current conformation nFOLD_TS4-scwrl # ReadConformPDB reading from PDB file servers/nFOLD_TS5.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation nFOLD_TS5 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_245638148.pdb -s /var/tmp/to_scwrl_245638148.seq -o /var/tmp/from_scwrl_245638148.pdb > /var/tmp/scwrl_245638148.log sh: /var/tmp/scwrl_245638148.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_245638148.pdb or /var/tmp/from_scwrl_245638148.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_245638148_b.pdb or decoys//var/tmp/from_scwrl_245638148_b.pdb.gz for input Trying /var/tmp/from_scwrl_245638148_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_245638148_b.pdb or /var/tmp/from_scwrl_245638148_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_245638148_a.pdb or decoys//var/tmp/from_scwrl_245638148_a.pdb.gz for input Trying /var/tmp/from_scwrl_245638148_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_245638148_a.pdb or /var/tmp/from_scwrl_245638148_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_245638148.pdb or /var/tmp/from_scwrl_245638148_b.pdb or /var/tmp/from_scwrl_245638148_a.pdb Error: no new SCWRL conformation added # naming current conformation nFOLD_TS5-scwrl # ReadConformPDB reading from PDB file servers/panther2_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation panther2_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_502558162.pdb -s /var/tmp/to_scwrl_502558162.seq -o /var/tmp/from_scwrl_502558162.pdb > /var/tmp/scwrl_502558162.log sh: /var/tmp/scwrl_502558162.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_502558162.pdb or /var/tmp/from_scwrl_502558162.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_502558162_b.pdb or decoys//var/tmp/from_scwrl_502558162_b.pdb.gz for input Trying /var/tmp/from_scwrl_502558162_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_502558162_b.pdb or /var/tmp/from_scwrl_502558162_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_502558162_a.pdb or decoys//var/tmp/from_scwrl_502558162_a.pdb.gz for input Trying /var/tmp/from_scwrl_502558162_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_502558162_a.pdb or /var/tmp/from_scwrl_502558162_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_502558162.pdb or /var/tmp/from_scwrl_502558162_b.pdb or /var/tmp/from_scwrl_502558162_a.pdb Error: no new SCWRL conformation added # naming current conformation panther2_TS1-scwrl # ReadConformPDB reading from PDB file servers/shub_TS1.pdb.gz looking for model 1 # WARNING: incomplete conformation T0316 can't currently be optimized by undertaker # naming current conformation shub_TS1 # request to SCWRL produces command: ulimit -t 336 ; scwrl3 -i /var/tmp/to_scwrl_1637481474.pdb -s /var/tmp/to_scwrl_1637481474.seq -o /var/tmp/from_scwrl_1637481474.pdb > /var/tmp/scwrl_1637481474.log sh: /var/tmp/scwrl_1637481474.log: No space left on device Error: Couldn't open file /var/tmp/from_scwrl_1637481474.pdb or /var/tmp/from_scwrl_1637481474.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1637481474_b.pdb or decoys//var/tmp/from_scwrl_1637481474_b.pdb.gz for input Trying /var/tmp/from_scwrl_1637481474_b.pdb Error: Couldn't open file /var/tmp/from_scwrl_1637481474_b.pdb or /var/tmp/from_scwrl_1637481474_b.pdb.gz for input Warning: Couldn't open file decoys//var/tmp/from_scwrl_1637481474_a.pdb or decoys//var/tmp/from_scwrl_1637481474_a.pdb.gz for input Trying /var/tmp/from_scwrl_1637481474_a.pdb Error: Couldn't open file /var/tmp/from_scwrl_1637481474_a.pdb or /var/tmp/from_scwrl_1637481474_a.pdb.gz for input Error: can't open any of /var/tmp/from_scwrl_1637481474.pdb or /var/tmp/from_scwrl_1637481474_b.pdb or /var/tmp/from_scwrl_1637481474_a.pdb Error: no new SCWRL conformation added # naming current conformation shub_TS1-scwrl # command:CPU_time= 95.904 sec, elapsed time= 106.958 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 111.542 real_cost = 358.277 panther2_TS1-scwrl costs 107.507 real_cost = 595.308 nFOLD_TS5-scwrl costs 101.705 real_cost = 570.601 nFOLD_TS4-scwrl costs 104.277 real_cost = 549.297 nFOLD_TS3-scwrl costs 102.895 real_cost = 532.937 nFOLD_TS2-scwrl costs 94.597 real_cost = 506.617 nFOLD_TS1-scwrl costs 93.651 real_cost = 501.327 mGen-3D_TS1-scwrl costs 89.022 real_cost = 511.388 keasar-server_TS5-scwrl costs 105.895 real_cost = 410.888 keasar-server_TS4-scwrl costs 105.895 real_cost = 410.888 keasar-server_TS3-scwrl costs 103.844 real_cost = 290.415 keasar-server_TS2-scwrl costs 106.842 real_cost = 385.230 keasar-server_TS1-scwrl costs 105.629 real_cost = 379.228 karypis.srv_TS5-scwrl costs 93.818 real_cost = 437.305 karypis.srv_TS4-scwrl costs 82.011 real_cost = 332.660 karypis.srv_TS3-scwrl costs 85.237 real_cost = 340.138 karypis.srv_TS2-scwrl costs 77.139 real_cost = 309.085 karypis.srv_TS1-scwrl costs 75.511 real_cost = 309.742 karypis.srv.4_TS5-scwrl costs 144.935 real_cost = 376.629 karypis.srv.4_TS4-scwrl costs 137.955 real_cost = 360.210 karypis.srv.4_TS3-scwrl costs 154.022 real_cost = 393.513 karypis.srv.4_TS2-scwrl costs 122.921 real_cost = 328.295 karypis.srv.4_TS1-scwrl costs 142.058 real_cost = 382.898 karypis.srv.2_TS5-scwrl costs 75.452 real_cost = 315.572 karypis.srv.2_TS4-scwrl costs 105.506 real_cost = 346.032 karypis.srv.2_TS3-scwrl costs 89.386 real_cost = 330.683 karypis.srv.2_TS2-scwrl costs 97.398 real_cost = 349.190 karypis.srv.2_TS1-scwrl costs 85.927 real_cost = 265.211 gtg_AL5-scwrl costs 124.594 real_cost = 672.566 gtg_AL4-scwrl costs 117.166 real_cost = 660.964 gtg_AL3-scwrl costs 120.769 real_cost = 680.560 gtg_AL2-scwrl costs 120.179 real_cost = 661.330 gtg_AL1-scwrl costs 115.680 real_cost = 644.160 forecast-s_AL5-scwrl costs 97.345 real_cost = 619.442 forecast-s_AL4-scwrl costs 90.957 real_cost = 592.286 forecast-s_AL3-scwrl costs 89.938 real_cost = 578.606 forecast-s_AL2-scwrl costs 102.826 real_cost = 642.867 forecast-s_AL1-scwrl costs 93.732 real_cost = 592.325 beautshotbase_TS1-scwrl costs 93.836 real_cost = 470.123 beautshot_TS1-scwrl costs 93.459 real_cost = 264.670 Zhang-Server_TS5-scwrl costs 105.457 real_cost = 203.563 Zhang-Server_TS4-scwrl costs 87.489 real_cost = 184.960 Zhang-Server_TS3-scwrl costs 87.680 real_cost = 188.339 Zhang-Server_TS2-scwrl costs 106.530 real_cost = 221.910 Zhang-Server_TS1-scwrl costs 81.413 real_cost = 204.014 UNI-EID_sfst_AL4-scwrl costs 96.156 real_cost = 632.882 UNI-EID_sfst_AL3-scwrl costs 92.868 real_cost = 593.530 UNI-EID_sfst_AL2-scwrl costs 98.085 real_cost = 604.492 UNI-EID_sfst_AL1-scwrl costs 103.575 real_cost = 604.733 UNI-EID_expm_TS1-scwrl costs 124.527 real_cost = 470.502 UNI-EID_bnmx_TS4-scwrl costs 100.323 real_cost = 623.429 UNI-EID_bnmx_TS3-scwrl costs 97.152 real_cost = 599.634 UNI-EID_bnmx_TS2-scwrl costs 101.101 real_cost = 630.577 UNI-EID_bnmx_TS1-scwrl costs 108.144 real_cost = 590.564 SPARKS2_TS5-scwrl costs 96.272 real_cost = 237.284 SPARKS2_TS4-scwrl costs 82.932 real_cost = 352.932 SPARKS2_TS3-scwrl costs 91.321 real_cost = 275.373 SPARKS2_TS2-scwrl costs 73.557 real_cost = 293.997 SPARKS2_TS1-scwrl costs 71.131 real_cost = 353.792 SP4_TS5-scwrl costs 80.706 real_cost = 348.894 SP4_TS4-scwrl costs 75.248 real_cost = 262.004 SP4_TS3-scwrl costs 94.842 real_cost = 256.809 SP4_TS2-scwrl costs 69.723 real_cost = 304.093 SP4_TS1-scwrl costs 71.802 real_cost = 355.031 SP3_TS5-scwrl costs 86.274 real_cost = 325.858 SP3_TS4-scwrl costs 92.934 real_cost = 242.524 SP3_TS3-scwrl costs 67.660 real_cost = 317.575 SP3_TS2-scwrl costs 75.481 real_cost = 266.031 SP3_TS1-scwrl costs 71.481 real_cost = 347.925 SAM_T06_server_TS5-scwrl costs 98.041 real_cost = 440.931 SAM_T06_server_TS4-scwrl costs 100.995 real_cost = 443.091 SAM_T06_server_TS3-scwrl costs 89.723 real_cost = 466.456 SAM_T06_server_TS2-scwrl costs 93.897 real_cost = 400.156 SAM_T06_server_TS1-scwrl costs 99.435 real_cost = 288.861 SAM-T99_AL5-scwrl costs 90.008 real_cost = 604.248 SAM-T99_AL4-scwrl costs 90.300 real_cost = 613.181 SAM-T99_AL3-scwrl costs 93.662 real_cost = 622.870 SAM-T99_AL2-scwrl costs 104.651 real_cost = 664.609 SAM-T99_AL1-scwrl costs 93.293 real_cost = 571.674 SAM-T02_AL5-scwrl costs 89.672 real_cost = 588.728 SAM-T02_AL4-scwrl costs 89.836 real_cost = 559.292 SAM-T02_AL3-scwrl costs 91.248 real_cost = 584.090 SAM-T02_AL2-scwrl costs 87.814 real_cost = 584.906 SAM-T02_AL1-scwrl costs 92.370 real_cost = 610.314 ROKKY_TS5-scwrl costs 76.010 real_cost = 462.082 ROKKY_TS4-scwrl costs 76.435 real_cost = 462.043 ROKKY_TS3-scwrl costs 78.855 real_cost = 456.181 ROKKY_TS2-scwrl costs 77.710 real_cost = 467.134 ROKKY_TS1-scwrl costs 75.279 real_cost = 454.123 ROBETTA_TS5-scwrl costs 71.889 real_cost = 246.538 ROBETTA_TS4-scwrl costs 87.193 real_cost = 234.381 ROBETTA_TS3-scwrl costs 73.827 real_cost = 245.763 ROBETTA_TS2-scwrl costs 85.692 real_cost = 228.991 ROBETTA_TS1-scwrl costs 83.241 real_cost = 231.977 RAPTOR_TS5-scwrl costs 83.364 real_cost = 234.897 RAPTOR_TS4-scwrl costs 89.216 real_cost = 243.573 RAPTOR_TS3-scwrl costs 83.024 real_cost = 228.625 RAPTOR_TS2-scwrl costs 90.287 real_cost = 234.101 RAPTOR_TS1-scwrl costs 81.533 real_cost = 258.659 RAPTORESS_TS5-scwrl costs 86.535 real_cost = 242.252 RAPTORESS_TS4-scwrl costs 99.553 real_cost = 266.936 RAPTORESS_TS3-scwrl costs 86.094 real_cost = 247.253 RAPTORESS_TS2-scwrl costs 95.164 real_cost = 234.386 RAPTORESS_TS1-scwrl costs 95.126 real_cost = 280.690 RAPTOR-ACE_TS5-scwrl costs 80.549 real_cost = 234.806 RAPTOR-ACE_TS4-scwrl costs 95.985 real_cost = 265.398 RAPTOR-ACE_TS3-scwrl costs 72.521 real_cost = 334.861 RAPTOR-ACE_TS2-scwrl costs 80.142 real_cost = 285.835 RAPTOR-ACE_TS1-scwrl costs 92.754 real_cost = 235.685 Pmodeller6_TS5-scwrl costs 86.699 real_cost = 255.787 Pmodeller6_TS4-scwrl costs 82.466 real_cost = 275.886 Pmodeller6_TS3-scwrl costs 88.191 real_cost = 280.761 Pmodeller6_TS2-scwrl costs 85.256 real_cost = 253.889 Pmodeller6_TS1-scwrl costs 83.177 real_cost = 268.915 Phyre-2_TS5-scwrl costs 84.361 real_cost = 211.588 Phyre-2_TS4-scwrl costs 94.977 real_cost = 232.609 Phyre-2_TS3-scwrl costs 100.103 real_cost = 236.358 Phyre-2_TS2-scwrl costs 93.813 real_cost = 239.020 Phyre-2_TS1-scwrl costs 87.245 real_cost = 265.032 Phyre-1_TS1-scwrl costs 97.972 real_cost = 543.045 Pcons6_TS5-scwrl costs 82.419 real_cost = 229.550 Pcons6_TS4-scwrl costs 87.112 real_cost = 255.973 Pcons6_TS3-scwrl costs 78.719 real_cost = 263.365 Pcons6_TS2-scwrl costs 78.441 real_cost = 268.247 Pcons6_TS1-scwrl costs 86.822 real_cost = 255.389 PROTINFO_TS5-scwrl costs 103.659 real_cost = 251.099 PROTINFO_TS4-scwrl costs 104.897 real_cost = 259.705 PROTINFO_TS3-scwrl costs 103.431 real_cost = 257.563 PROTINFO_TS2-scwrl costs 96.029 real_cost = 323.530 PROTINFO_TS1-scwrl costs 102.833 real_cost = 250.306 PROTINFO-AB_TS5-scwrl costs 94.061 real_cost = 251.767 PROTINFO-AB_TS4-scwrl costs 94.092 real_cost = 239.243 PROTINFO-AB_TS3-scwrl costs 97.018 real_cost = 236.813 PROTINFO-AB_TS2-scwrl costs 94.338 real_cost = 256.423 PROTINFO-AB_TS1-scwrl costs 94.338 real_cost = 256.423 POMYSL_TS4-scwrl costs 107.873 real_cost = 694.147 POMYSL_TS3-scwrl costs 112.137 real_cost = 690.336 POMYSL_TS2-scwrl costs 109.347 real_cost = 695.114 POMYSL_TS1-scwrl costs 111.851 real_cost = 688.655 NN_PUT_lab_TS1-scwrl costs 93.651 real_cost = 501.327 MetaTasser_TS5-scwrl costs 113.753 real_cost = 204.709 MetaTasser_TS4-scwrl costs 111.440 real_cost = 220.346 MetaTasser_TS3-scwrl costs 98.563 real_cost = 206.064 MetaTasser_TS2-scwrl costs 102.710 real_cost = 215.510 MetaTasser_TS1-scwrl costs 112.980 real_cost = 230.788 Ma-OPUS-server_TS5-scwrl costs 92.484 real_cost = 361.071 Ma-OPUS-server_TS4-scwrl costs 84.713 real_cost = 233.576 Ma-OPUS-server_TS3-scwrl costs 83.810 real_cost = 243.671 Ma-OPUS-server_TS2-scwrl costs 91.892 real_cost = 220.242 Ma-OPUS-server_TS1-scwrl costs 83.572 real_cost = 226.395 LOOPP_TS5-scwrl costs 84.403 real_cost = 360.866 LOOPP_TS4-scwrl costs 98.218 real_cost = 358.607 LOOPP_TS3-scwrl costs 82.560 real_cost = 310.753 LOOPP_TS2-scwrl costs 93.315 real_cost = 362.831 LOOPP_TS1-scwrl costs 79.000 real_cost = 297.043 Huber-Torda-Server_TS5-scwrl costs 104.986 real_cost = 735.673 Huber-Torda-Server_TS4-scwrl costs 109.149 real_cost = 726.231 Huber-Torda-Server_TS3-scwrl costs 103.922 real_cost = 708.027 Huber-Torda-Server_TS2-scwrl costs 105.325 real_cost = 689.724 Huber-Torda-Server_TS1-scwrl costs 102.080 real_cost = 704.670 HHpred3_TS1-scwrl costs 78.427 real_cost = 258.439 HHpred2_TS1-scwrl costs 78.427 real_cost = 258.439 HHpred1_TS1-scwrl costs 79.506 real_cost = 245.828 GeneSilicoMetaServer_TS5-scwrl costs 92.135 real_cost = 245.866 GeneSilicoMetaServer_TS4-scwrl costs 95.186 real_cost = 422.670 GeneSilicoMetaServer_TS3-scwrl costs 95.846 real_cost = 409.840 GeneSilicoMetaServer_TS2-scwrl costs 88.624 real_cost = 247.412 GeneSilicoMetaServer_TS1-scwrl costs 95.696 real_cost = 338.213 FUNCTION_TS5-scwrl costs 111.624 real_cost = 264.650 FUNCTION_TS4-scwrl costs 105.225 real_cost = 322.382 FUNCTION_TS3-scwrl costs 91.305 real_cost = 289.051 FUNCTION_TS2-scwrl costs 94.394 real_cost = 271.939 FUNCTION_TS1-scwrl costs 91.365 real_cost = 433.534 FUGUE_AL5-scwrl costs 92.293 real_cost = 616.718 FUGUE_AL4-scwrl costs 102.283 real_cost = 597.867 FUGUE_AL3-scwrl costs 109.508 real_cost = 721.528 FUGUE_AL2-scwrl costs 91.728 real_cost = 676.582 FUGUE_AL1-scwrl costs 91.555 real_cost = 609.932 FUGMOD_TS5-scwrl costs 86.859 real_cost = 291.446 FUGMOD_TS4-scwrl costs 94.561 real_cost = 268.708 FUGMOD_TS3-scwrl costs 108.083 real_cost = 552.091 FUGMOD_TS2-scwrl costs 94.881 real_cost = 540.358 FUGMOD_TS1-scwrl costs 93.698 real_cost = 286.369 FPSOLVER-SERVER_TS5-scwrl costs 125.955 real_cost = 350.360 FPSOLVER-SERVER_TS4-scwrl costs 121.980 real_cost = 366.322 FPSOLVER-SERVER_TS3-scwrl costs 120.379 real_cost = 359.693 FPSOLVER-SERVER_TS2-scwrl costs 128.181 real_cost = 369.256 FPSOLVER-SERVER_TS1-scwrl costs 128.140 real_cost = 368.842 FORTE2_AL5-scwrl costs 108.396 real_cost = 683.223 FORTE2_AL4-scwrl costs 104.126 real_cost = 653.923 FORTE2_AL3-scwrl costs 93.057 real_cost = 561.632 FORTE2_AL2-scwrl costs 106.006 real_cost = 593.526 FORTE2_AL1-scwrl costs 93.024 real_cost = 560.787 FORTE1_AL5-scwrl costs 105.445 real_cost = 670.612 FORTE1_AL4-scwrl costs 106.337 real_cost = 657.066 FORTE1_AL3-scwrl costs 93.057 real_cost = 561.632 FORTE1_AL2-scwrl costs 106.006 real_cost = 593.526 FORTE1_AL1-scwrl costs 93.024 real_cost = 560.787 FOLDpro_TS5-scwrl costs 115.155 real_cost = 305.893 FOLDpro_TS4-scwrl costs 121.273 real_cost = 358.736 FOLDpro_TS3-scwrl costs 87.238 real_cost = 232.692 FOLDpro_TS2-scwrl costs 99.100 real_cost = 303.845 FOLDpro_TS1-scwrl costs 90.577 real_cost = 305.490 FAMS_TS5-scwrl costs 102.779 real_cost = 253.973 FAMS_TS4-scwrl costs 91.365 real_cost = 433.534 FAMS_TS3-scwrl costs 89.549 real_cost = 456.338 FAMS_TS2-scwrl costs 96.521 real_cost = 252.331 FAMS_TS1-scwrl costs 90.393 real_cost = 256.810 FAMSD_TS5-scwrl costs 109.572 real_cost = 271.591 FAMSD_TS4-scwrl costs 103.199 real_cost = 431.879 FAMSD_TS3-scwrl costs 89.549 real_cost = 456.338 FAMSD_TS2-scwrl costs 97.438 real_cost = 349.508 FAMSD_TS1-scwrl costs 87.938 real_cost = 259.611 Distill_TS5-scwrl costs 234.653 real_cost = 788.714 Distill_TS4-scwrl costs 231.916 real_cost = 779.125 Distill_TS3-scwrl costs 233.417 real_cost = 782.844 Distill_TS2-scwrl costs 234.284 real_cost = 774.320 Distill_TS1-scwrl costs 233.902 real_cost = 764.488 CaspIta-FOX_TS5-scwrl costs 115.142 real_cost = 535.054 CaspIta-FOX_TS4-scwrl costs 114.192 real_cost = 457.977 CaspIta-FOX_TS3-scwrl costs 84.943 real_cost = 426.894 CaspIta-FOX_TS2-scwrl costs 94.482 real_cost = 304.647 CaspIta-FOX_TS1-scwrl costs 85.407 real_cost = 413.495 CPHmodels_TS1-scwrl costs 96.847 real_cost = 661.866 CIRCLE_TS5-scwrl costs 81.542 real_cost = 227.684 CIRCLE_TS4-scwrl costs 94.637 real_cost = 430.232 CIRCLE_TS3-scwrl costs 93.232 real_cost = 439.516 CIRCLE_TS2-scwrl costs 94.396 real_cost = 462.488 CIRCLE_TS1-scwrl costs 86.526 real_cost = 236.935 Bilab-ENABLE_TS3-scwrl costs 96.358 real_cost = 269.310 Bilab-ENABLE_TS2-scwrl costs 83.105 real_cost = 278.240 Bilab-ENABLE_TS1-scwrl costs 105.700 real_cost = 342.363 BayesHH_TS1-scwrl costs 77.170 real_cost = 312.020 ABIpro_TS5-scwrl costs 79.338 real_cost = 309.045 ABIpro_TS4-scwrl costs 87.018 real_cost = 303.901 ABIpro_TS3-scwrl costs 84.091 real_cost = 318.497 ABIpro_TS2-scwrl costs 80.373 real_cost = 304.730 ABIpro_TS1-scwrl costs 92.248 real_cost = 317.290 3Dpro_TS5-scwrl costs 125.533 real_cost = 356.377 3Dpro_TS4-scwrl costs 120.092 real_cost = 351.149 3Dpro_TS3-scwrl costs 90.577 real_cost = 305.490 3Dpro_TS2-scwrl costs 87.041 real_cost = 240.379 3Dpro_TS1-scwrl costs 87.238 real_cost = 232.692 3D-JIGSAW_TS5-scwrl costs 97.542 real_cost = 441.201 3D-JIGSAW_TS4-scwrl costs 111.858 real_cost = 466.283 3D-JIGSAW_TS3-scwrl costs 90.763 real_cost = 559.328 3D-JIGSAW_TS2-scwrl costs 90.911 real_cost = 562.333 3D-JIGSAW_TS1-scwrl costs 94.292 real_cost = 560.477 3D-JIGSAW_RECOM_TS5-scwrl costs 88.854 real_cost = 490.616 3D-JIGSAW_RECOM_TS4-scwrl costs 88.854 real_cost = 490.616 3D-JIGSAW_RECOM_TS3-scwrl costs 89.030 real_cost = 489.710 3D-JIGSAW_RECOM_TS2-scwrl costs 88.221 real_cost = 486.413 3D-JIGSAW_RECOM_TS1-scwrl costs 86.948 real_cost = 487.811 3D-JIGSAW_POPULUS_TS5-scwrl costs 87.135 real_cost = 492.568 3D-JIGSAW_POPULUS_TS4-scwrl costs 96.772 real_cost = 513.977 3D-JIGSAW_POPULUS_TS3-scwrl costs 89.714 real_cost = 492.407 3D-JIGSAW_POPULUS_TS2-scwrl costs 90.101 real_cost = 494.343 3D-JIGSAW_POPULUS_TS1-scwrl costs 89.388 real_cost = 475.936 make-chimera.pdb.gz costs 87.428 real_cost = 264.228 chimera1.pdb.gz costs 87.724 real_cost = 254.050 T0316.try9-opt2.repack-nonPC.pdb.gz costs 95.776 real_cost = 233.354 T0316.try9-opt2.pdb.gz costs 95.776 real_cost = 232.908 T0316.try9-opt2.gromacs0.pdb.gz costs 83.429 real_cost = 233.854 T0316.try9-opt1.pdb.gz costs 94.428 real_cost = 233.438 T0316.try9-opt1-scwrl.pdb.gz costs 94.428 real_cost = 231.577 T0316.try8-opt2.repack-nonPC.pdb.gz costs 87.096 real_cost = 256.863 T0316.try8-opt2.pdb.gz costs 87.096 real_cost = 257.609 T0316.try8-opt2.gromacs0.pdb.gz costs 70.373 real_cost = 257.691 T0316.try8-opt1.pdb.gz costs 85.494 real_cost = 257.641 T0316.try8-opt1-scwrl.pdb.gz costs 85.494 real_cost = 257.214 T0316.try7-opt2.repack-nonPC.pdb.gz costs 93.510 real_cost = 254.410 T0316.try7-opt2.pdb.gz costs 93.510 real_cost = 255.710 T0316.try7-opt2.gromacs0.pdb.gz costs 79.664 real_cost = 256.728 T0316.try7-opt1.pdb.gz costs 82.412 real_cost = 253.894 T0316.try7-opt1-scwrl.pdb.gz costs 82.412 real_cost = 253.361 T0316.try6-opt2.repack-nonPC.pdb.gz costs 90.461 real_cost = 273.242 T0316.try6-opt2.pdb.gz costs 90.461 real_cost = 273.678 T0316.try6-opt2.gromacs0.pdb.gz costs 74.171 real_cost = 273.238 T0316.try6-opt1.pdb.gz costs 87.391 real_cost = 275.661 T0316.try6-opt1-scwrl.pdb.gz costs 87.391 real_cost = 273.750 T0316.try5-opt2.repack-nonPC.pdb.gz costs 94.427 real_cost = 256.641 T0316.try5-opt2.pdb.gz costs 94.427 real_cost = 258.435 T0316.try5-opt2.gromacs0.pdb.gz costs 84.501 real_cost = 256.426 T0316.try5-opt1.pdb.gz costs 82.100 real_cost = 247.590 T0316.try5-opt1-scwrl.pdb.gz costs 82.100 real_cost = 248.141 T0316.try4-opt2.repack-nonPC.pdb.gz costs 85.687 real_cost = 265.873 T0316.try4-opt2.pdb.gz costs 85.687 real_cost = 265.739 T0316.try4-opt2.gromacs0.pdb.gz costs 73.792 real_cost = 269.183 T0316.try4-opt1.pdb.gz costs 76.171 real_cost = 268.670 T0316.try4-opt1-scwrl.pdb.gz costs 76.171 real_cost = 269.134 T0316.try3-opt2.repack-nonPC.pdb.gz costs 85.216 real_cost = 285.927 T0316.try3-opt2.pdb.gz costs 85.216 real_cost = 286.282 T0316.try3-opt2.gromacs0.pdb.gz costs 70.327 real_cost = 287.245 T0316.try3-opt1.pdb.gz costs 79.283 real_cost = 288.947 T0316.try3-opt1-scwrl.pdb.gz costs 79.283 real_cost = 289.570 T0316.try21-opt2.repack-nonPC.pdb.gz costs 92.107 real_cost = 256.982 T0316.try21-opt2.pdb.gz costs 92.107 real_cost = 254.701 T0316.try21-opt2.gromacs0.pdb.gz costs 74.184 real_cost = 255.312 T0316.try21-opt1.pdb.gz costs 90.672 real_cost = 254.616 T0316.try21-opt1-scwrl.pdb.gz costs 90.672 real_cost = 254.604 T0316.try20-opt2.repack-nonPC.pdb.gz costs 90.610 real_cost = 272.065 T0316.try20-opt2.pdb.gz costs 90.610 real_cost = 272.658 T0316.try20-opt2.gromacs0.pdb.gz costs 73.405 real_cost = 275.997 T0316.try20-opt1.pdb.gz costs 89.584 real_cost = 273.624 T0316.try20-opt1-scwrl.pdb.gz costs 89.584 real_cost = 272.977 T0316.try2-opt2.repack-nonPC.pdb.gz costs 97.908 real_cost = 258.164 T0316.try2-opt2.pdb.gz costs 97.908 real_cost = 255.794 T0316.try2-opt2.gromacs0.pdb.gz costs 84.339 real_cost = 257.906 T0316.try2-opt2-M1-A183-try6-opt2-A130-I373.pdb.gz costs 96.867 real_cost = 266.416 T0316.try2-opt1.pdb.gz costs 87.310 real_cost = 257.380 T0316.try2-opt1-scwrl.pdb.gz costs 87.310 real_cost = 256.965 T0316.try19-opt2.repack-nonPC.pdb.gz costs 90.965 real_cost = 255.525 T0316.try19-opt2.pdb.gz costs 90.965 real_cost = 253.881 T0316.try19-opt2.gromacs0.pdb.gz costs 74.724 real_cost = 254.509 T0316.try19-opt1.pdb.gz costs 87.400 real_cost = 252.025 T0316.try19-opt1-scwrl.pdb.gz costs 87.400 real_cost = 252.503 T0316.try18-opt2.repack-nonPC.pdb.gz costs 91.380 real_cost = 274.979 T0316.try18-opt2.pdb.gz costs 91.380 real_cost = 274.401 T0316.try18-opt2.gromacs0.pdb.gz costs 75.138 real_cost = 278.050 T0316.try18-opt1.pdb.gz costs 90.010 real_cost = 273.536 T0316.try18-opt1-scwrl.pdb.gz costs 90.010 real_cost = 273.570 T0316.try17-opt2.repack-nonPC.pdb.gz costs 88.171 real_cost = 285.688 T0316.try17-opt2.pdb.gz costs 88.171 real_cost = 285.114 T0316.try17-opt2.gromacs0.pdb.gz costs 77.949 real_cost = 288.943 T0316.try17-opt1.pdb.gz costs 82.799 real_cost = 289.560 T0316.try17-opt1-scwrl.pdb.gz costs 82.799 real_cost = 291.219 T0316.try16-opt2.repack-nonPC.pdb.gz costs 99.815 real_cost = 238.803 T0316.try16-opt2.pdb.gz costs 99.815 real_cost = 238.351 T0316.try16-opt2.gromacs0.pdb.gz costs 84.767 real_cost = 240.572 T0316.try16-opt1.pdb.gz costs 88.035 real_cost = 240.585 T0316.try16-opt1-scwrl.pdb.gz costs 88.035 real_cost = 240.815 T0316.try15-opt2.repack-nonPC.pdb.gz costs 97.956 real_cost = 253.932 T0316.try15-opt2.pdb.gz costs 97.956 real_cost = 256.171 T0316.try15-opt2.gromacs0.pdb.gz costs 80.052 real_cost = 253.324 T0316.try15-opt1.pdb.gz costs 81.867 real_cost = 249.399 T0316.try15-opt1-scwrl.pdb.gz costs 81.867 real_cost = 248.855 T0316.try14-opt2.repack-nonPC.pdb.gz costs 88.094 real_cost = 273.200 T0316.try14-opt2.pdb.gz costs 88.094 real_cost = 273.810 T0316.try14-opt2.gromacs0.pdb.gz costs 72.480 real_cost = 274.308 T0316.try14-opt1.pdb.gz costs 88.534 real_cost = 274.146 T0316.try14-opt1-scwrl.pdb.gz costs 88.534 real_cost = 272.117 T0316.try13-opt2.repack-nonPC.pdb.gz costs 92.235 real_cost = 235.131 T0316.try13-opt2.pdb.gz costs 92.235 real_cost = 234.583 T0316.try13-opt2.gromacs0.pdb.gz costs 82.795 real_cost = 233.012 T0316.try13-opt1.pdb.gz costs 91.794 real_cost = 234.617 T0316.try13-opt1-scwrl.pdb.gz costs 91.794 real_cost = 233.356 T0316.try12-opt2.repack-nonPC.pdb.gz costs 96.038 real_cost = 254.029 T0316.try12-opt2.pdb.gz costs 96.038 real_cost = 252.677 T0316.try12-opt2.gromacs0.pdb.gz costs 79.472 real_cost = 252.913 T0316.try12-opt1.pdb.gz costs 94.385 real_cost = 252.217 T0316.try12-opt1-scwrl.pdb.gz costs 94.385 real_cost = 253.739 T0316.try11-opt2.repack-nonPC.pdb.gz costs 86.531 real_cost = 219.604 T0316.try11-opt2.pdb.gz costs 86.531 real_cost = 219.437 T0316.try11-opt2.gromacs0.pdb.gz costs 74.439 real_cost = 221.155 T0316.try11-opt1.pdb.gz costs 81.910 real_cost = 221.070 T0316.try11-opt1-scwrl.pdb.gz costs 81.910 real_cost = 222.792 T0316.try10-opt2.repack-nonPC.pdb.gz costs 90.206 real_cost = 274.304 T0316.try10-opt2.pdb.gz costs 90.206 real_cost = 274.431 T0316.try10-opt2.gromacs0.pdb.gz costs 73.356 real_cost = 272.245 T0316.try10-opt1.pdb.gz costs 90.528 real_cost = 274.639 T0316.try10-opt1-scwrl.pdb.gz costs 90.528 real_cost = 273.263 T0316.try1-opt2.repack-nonPC.pdb.gz costs 92.656 real_cost = 263.003 T0316.try1-opt2.pdb.gz costs 92.656 real_cost = 263.268 T0316.try1-opt2.gromacs0.pdb.gz costs 81.845 real_cost = 263.750 T0316.try1-opt1.pdb.gz costs 86.972 real_cost = 266.679 T0316.try1-opt1-scwrl.pdb.gz costs 86.972 real_cost = 265.529 T0316.M1-A183-try2-opt2-D122-K269-try1-opt2-A130-I373-try4-opt2.pdb.gz costs 90.866 real_cost = 245.536 T0316.M1-A183-try2-opt2-D122-K269-try1-opt2-A130-I373-try4-opt2-proteinshop.pdb.gz costs 93.380 real_cost = 259.780 ../model5.ts-submitted costs 85.136 real_cost = 219.432 ../model4.ts-submitted costs 95.776 real_cost = 233.424 ../model3.ts-submitted costs 88.208 real_cost = 273.137 ../model2.ts-submitted costs 87.096 real_cost = 257.607 ../model1.ts-submitted costs 91.962 real_cost = 254.955 align5 costs 93.600 real_cost = 410.577 align4 costs 98.673 real_cost = 488.528 align3 costs 96.524 real_cost = 434.827 align2 costs 89.866 real_cost = 453.685 align1 costs 89.472 real_cost = 388.557 T0316.try1-opt2.pdb costs 92.656 real_cost = 263.268 model5-scwrl costs 85.136 real_cost = 219.432 model4-scwrl costs 95.776 real_cost = 233.424 model3-scwrl costs 88.208 real_cost = 273.137 model2-scwrl costs 87.096 real_cost = 257.607 model1-scwrl costs 91.962 real_cost = 254.955 2hmaA costs 50.132 real_cost = -882.400 # command:CPU_time= 2669.234 sec, elapsed time= 2684.539 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/T0316'