From mailer@bialko.llnl.gov Fri Jul 26 15:27:18 2002 Date: Fri, 26 Jul 2002 15:27:12 -0700 (PDT) From: Automatic Reply To: karplus@bray.cse.ucsc.edu Subject: SAM-T02-human T0129 X-SpamBouncer: 1.4 (10/07/01) X-SBPass: NoBounce X-SBClass: OK # # Protein Structure Prediction Center, LLNL, Livermore, CA # Verification system Fri Jul 26 15:00:20 PDT 2002 by Adam Zemla # # The PIN number of your submission is: PIN_123526_15892 # (PIN number is not an ACCESSION CODE) # Thank you for your submission. Your prediction has been accepted with an ACCESSION CODE: T0129SS001_1 Current information on models submitted in prediction T0129SS001 MODEL_INDEX PIN CODE DATE E-mail T0129SS001_1 PIN_123526_15892 4069-6308-1312 07/26/02 15:00:20 karplus@bray.cse.ucsc.edu PLEASE NOTE: Submission of a duplicate prediction (same target, format, model index) will REPLACE an existing submission (ACCESSION CODE), provided it is received before the target has expired. The current status of models accepted for target T0129 MODEL_INDEX PIN CODE DATE E-mail T0129SS001_1 PIN_123526_15892 4069-6308-1312 07/26/02 15:00:20 karplus@bray.cse.ucsc.edu For more information on accepted models submitted to CASP5 see: http://PredictionCenter.llnl.gov/casp5/models/casp5-models.html Please check below if the verified data of your submission is correct. # Reading prediction format SS PFRMAT SS TARGET T0129 AUTHOR 4069-6308-1312 # Reading MODEL 1 # Reading prediction format SS (DONE) # Checking the SS prediction MODEL 1 # Checking the SS prediction MODEL 1 (DONE) # MODEL index: 1 # Total number of residues in model: 182 # Number of residues with nonzero confidence: 182 # Number of METHOD records: 82 # No errors. ################################ # # # SUBMISSION # # # ################################ # # # BEGIN # # # ################################ PFRMAT SS TARGET T0129 AUTHOR 4069-6308-1312 METHOD This file is the result of combining several RDB files, specifically METHOD T0129.t2k.dssp-ebghstl.rdb (weight 1.53986) METHOD T0129.t2k.stride-ebghtl.rdb (weight 1.24869) METHOD T0129.t2k.str.rdb (weight 1.53983) METHOD T0129.t2k.alpha.rdb (weight 0.659012) METHOD These files were combined by translating their predictions into EHL METHOD predictions with tables generated by compare-real, and then combining METHOD those predictions with weights proportional to their mutual information METHOD with the EHL alphabet. The comments from the individual files follow. METHOD METHOD Comments from T0129.t2k.dssp-ebghstl.rdb METHOD ============================================ METHOD TARGET T0129 METHOD Using neural net t2k-5740-IDaaHr-5-15-7-15-9-15-13-ebghstl-seeded.net METHOD This is a 4-layer network, with METHOD window units METHOD 5 15 METHOD 7 15 METHOD 9 15 METHOD 13 7 (1 EBGHSTL ) METHOD The input amino acid frequencies were determined from METHOD alignment T0129.t2k-thin90.a2m.gz METHOD with weighted counts, using HenikoffWeight(-1 bits/column, 1) METHOD Counts were regularized to probabilities using METHOD /projects/compbio/lib/recode3.20comp METHOD Total sequence weight for alignment was 6 METHOD METHOD ============================================ METHOD Comments from T0129.t2k.stride-ebghtl.rdb METHOD ============================================ METHOD TARGET T0129 METHOD Using neural net t2k-5651-IDaaHr-5-15-7-15-9-15-13-ebghtl-seeded.net METHOD This is a 4-layer network, with METHOD window units METHOD 5 15 METHOD 7 15 METHOD 9 15 METHOD 13 6 (1 EBGHTL ) METHOD The input amino acid frequencies were determined from METHOD alignment T0129.t2k-thin90.a2m.gz METHOD with weighted counts, using HenikoffWeight(-1 bits/column, 1) METHOD Counts were regularized to probabilities using METHOD /projects/compbio/lib/recode3.20comp METHOD Total sequence weight for alignment was 6 METHOD METHOD ============================================ METHOD Comments from T0129.t2k.str.rdb METHOD ============================================ METHOD TARGET T0129 METHOD Using neural net t2k-5651-IDaaHr-5-15-7-15-9-15-13-str-seeded.net METHOD This is a 4-layer network, with METHOD window units METHOD 5 15 METHOD 7 15 METHOD 9 15 METHOD 13 13 (1 str ) METHOD The input amino acid frequencies were determined from METHOD alignment T0129.t2k-thin90.a2m.gz METHOD with weighted counts, using HenikoffWeight(-1 bits/column, 1) METHOD Counts were regularized to probabilities using METHOD /projects/compbio/lib/recode3.20comp METHOD Total sequence weight for alignment was 6 METHOD METHOD ============================================ METHOD Comments from T0129.t2k.alpha.rdb METHOD ============================================ METHOD TARGET T0129 METHOD Using neural net t2k-5651-IDaaHr-5-15-7-15-9-15-13-alpha-seeded.net METHOD This is a 4-layer network, with METHOD window units METHOD 5 15 METHOD 7 15 METHOD 9 15 METHOD 13 11 (1 ABCDEFGHIST ) METHOD The input amino acid frequencies were determined from METHOD alignment T0129.t2k-thin90.a2m.gz METHOD with weighted counts, using HenikoffWeight(-1 bits/column, 1) METHOD Counts were regularized to probabilities using METHOD /projects/compbio/lib/recode3.20comp METHOD Total sequence weight for alignment was 6 METHOD METHOD ============================================ MODEL 1 M C 0.90 L C 0.76 I C 0.66 S C 0.62 H H 0.49 S H 0.79 D H 0.86 L H 0.91 N H 0.92 Q H 0.91 Q H 0.91 L H 0.88 K H 0.84 S H 0.76 A H 0.57 G C 0.74 I C 0.78 G C 0.80 F C 0.86 N C 0.87 A H 0.91 T H 0.93 E H 0.93 L H 0.92 H H 0.87 G H 0.80 F H 0.81 L H 0.76 S H 0.68 G C 0.46 L H 0.39 L C 0.37 C C 0.55 G C 0.78 G C 0.86 L C 0.79 K C 0.80 D C 0.54 Q H 0.64 S H 0.75 W H 0.90 L H 0.92 P H 0.94 L H 0.94 L H 0.94 Y H 0.93 Q H 0.90 F H 0.80 S H 0.50 N C 0.66 D C 0.74 N C 0.80 H C 0.78 A C 0.72 Y C 0.73 P H 0.60 T H 0.81 G H 0.84 L H 0.87 V H 0.88 Q H 0.89 P H 0.91 V H 0.94 T H 0.95 E H 0.94 L H 0.95 Y H 0.95 E H 0.94 Q H 0.93 I H 0.92 S H 0.91 Q H 0.88 T H 0.83 L H 0.69 S H 0.55 D C 0.62 V C 0.77 E C 0.84 G C 0.68 F E 0.69 T E 0.88 F E 0.91 E E 0.91 L E 0.88 G E 0.79 L C 0.55 T C 0.80 E C 0.87 D C 0.91 E C 0.82 N C 0.73 V H 0.49 F H 0.61 T H 0.65 Q H 0.79 A H 0.87 D H 0.90 S H 0.91 L H 0.95 S H 0.95 D H 0.95 W H 0.95 A H 0.95 N H 0.93 Q H 0.92 F H 0.90 L H 0.85 L H 0.77 G H 0.62 I C 0.47 G C 0.62 L C 0.58 A C 0.64 Q C 0.57 P H 0.51 E H 0.50 L H 0.58 A H 0.50 K C 0.49 E C 0.47 K C 0.48 G H 0.47 E H 0.61 I H 0.88 G H 0.91 E H 0.92 A H 0.93 V H 0.94 D H 0.94 D H 0.91 L H 0.94 Q H 0.95 D H 0.94 I H 0.93 C H 0.89 Q H 0.79 L H 0.50 G C 0.83 Y C 0.87 D C 0.85 E H 0.53 D C 0.50 D C 0.51 N C 0.65 E H 0.85 E H 0.88 E H 0.89 L H 0.91 A H 0.92 E H 0.92 A H 0.92 L H 0.94 E H 0.95 E H 0.95 I H 0.96 I H 0.96 E H 0.96 Y H 0.96 V H 0.96 R H 0.96 T H 0.96 I H 0.96 A H 0.96 M H 0.96 L H 0.95 F H 0.92 Y H 0.85 S H 0.74 H H 0.58 F C 0.65 N C 0.85 E C 0.89 G C 0.88 E C 0.86 I C 0.85 E C 0.85 S C 0.83 K C 0.87 P C 0.84 V C 0.76 L C 0.80 H C 0.92 END ################################ # # # END # # # ################################ From mailer@bialko.llnl.gov Mon Aug 26 10:18:19 2002 Date: Mon, 26 Aug 2002 10:18:13 -0700 (PDT) From: Automatic Reply To: karplus@cse.ucsc.edu X-SpamBouncer: 1.4 (10/07/01) X-SBPass: NoBounce X-SBClass: OK # # Protein Structure Prediction Center, LLNL, Livermore, CA # Verification system Mon Aug 26 09:50:29 PDT 2002 by Adam Zemla # # The PIN number of your submission is: PIN_739324_34603 # (PIN number is not an ACCESSION CODE) # Thank you for your submission. Your prediction has been accepted with an ACCESSION CODE: T0129TS001_1 Current information on models submitted in prediction T0129TS001 MODEL_INDEX PIN CODE DATE E-mail T0129TS001_1 PIN_739324_34603 4069-6308-1312 08/26/02 09:50:29 karplus@cse.ucsc.edu PLEASE NOTE: Submission of a duplicate prediction (same target, format, model index) will REPLACE an existing submission (ACCESSION CODE), provided it is received before the target has expired. The current status of models accepted for target T0129 MODEL_INDEX PIN CODE DATE E-mail T0129TS001_1 PIN_739324_34603 4069-6308-1312 08/26/02 09:50:29 karplus@cse.ucsc.edu T0129SS001_1 PIN_123526_15892 4069-6308-1312 07/26/02 15:00:20 karplus@bray.cse.ucsc.edu For more information on accepted models submitted to CASP5 see: http://PredictionCenter.llnl.gov/casp5/models/casp5-models.html Please check below if the verified data of your submission is correct. # Reading prediction format TS PFRMAT TS TARGET T0129 AUTHOR 4069-6308-1312 # Reading MODEL 1 PARENT N/A # Reading prediction format TS (DONE) # Checking the TS prediction MODEL 1 # Checking the TS prediction MODEL 1 (DONE) # MODEL index: 1 # Target name: T0129 # Total number of residues in target: 182 # Total number of residues in model: 182 # Total number of atoms in model: 1430 # Number of atoms with 1.0 occupancy: 1430 # Number of fragments in model: 1 # Number of METHOD records: 101 # No errors. ################################ # # # SUBMISSION # # # ################################ # # # BEGIN # # # ################################ PFRMAT TS TARGET T0129 AUTHOR 4069-6308-1312 METHOD The SAM-T02 human predictions start with the same method as the METHOD SAM-T02 server: METHOD METHOD Use the SAM-T2K method for finding homologs of the target and METHOD aligning them. METHOD METHOD Make local structure predictions using neural nets and the METHOD multiple alignment. We currently have 5 local-structure METHOD alphabets: METHOD DSSP METHOD STRIDE METHOD STR an extended version of DSSP that splits the beta strands METHOD into multiple classes (parallel/antiparallel/mixed, METHOD edge/center) METHOD ALPHA an discretization of the alpha torsion angle: METHOD CA(i-i), CA(i), CA(i+1), CA(i+2) METHOD DSSP_EHL2 CASP's collapse of the DSSP alphabet METHOD METHOD DSSP_EHL2 is not predicted directly by a neural net, but is METHOD computed as a weighted average of the other 4 networks (each METHOD probability vector output is multiplied by conditional METHOD probability matrix P(E|letter) P(H|letter) P(L|letter)). The METHOD weights for the averaging are the mutual information between the METHOD local structure alphabet and the DSSP_EHL2 alphabet in a large METHOD training set. METHOD METHOD METHOD We make four 2-track HMMs (1.0 amino acid + 0.3 local structure) METHOD and use them to score a template library of about 6200 templates. METHOD We also used a single-track HMM to score not just the template METHOD library, but a non-redundant copy of the entire PDB. METHOD METHOD [Difference from server: the web server did not include the ALPHA METHOD alphabet in either the DSSP_EHL2 computation or the 2-track HMMS.] METHOD METHOD One-track HMMs built from the template library multiple alignments METHOD were used to score the target sequence. METHOD METHOD All the logs of e-values were combined in a weighted average (with METHOD rather arbitrary weights, since we did not have time to METHOD optimize them), and the best templates ranked. METHOD METHOD Alignments of the target to the top templates were made using METHOD several different alignment methods (all using the SAM hmmscore METHOD program). METHOD METHOD After the large set of alignments were made the "human" methods and METHOD the server diverge significantly. The server just picks the METHOD best-scoring templates (after removing redundancy) and reports the METHOD local posterior-decoding alignments made with the 2-track AA+STR METHOD target HMM. METHOD METHOD The hand method used SAM's "fragfinder" program and the 2-track AA+STR METHOD HMM to find short fragments (9 residues long) for each position in the METHOD sequence (6 fragments were kept for each position). METHOD METHOD Then the "undertaker" program (named because it optimizes burial) is METHOD used to try to combine the alignments and the fragments into a METHOD consistent 3D model. No single alignment or parent template was used, METHOD though in many cases one had much more influence than the others. The METHOD alignment scores were not passed to undertaker, but were used only to METHOD pike the set of alignments and fragments that undertaker would see. METHOD METHOD A genetic algorithm with about 16 different operators were used to METHOD optimize a score function. The score function was hand-tweaked for METHOD each target (mainly by adding constraints to keep beta sheets METHOD together, but also by adjusting what terms were included in the score METHOD function and what weights were used). Undertaker was undergoing METHOD extensive modification during CASP season, so may have had quite METHOD different features available for different targets. METHOD METHOD Bower and Dunbrack's SCWRL was run on some of the intermediate METHOD conformations generated by undertaker, but the final conformation was METHOD chosen entirely by the undertaker score function. METHOD METHOD Optimization was generally done in many passes, with hand inspection METHOD of the best conformation after each pass, followed (often) by tweaking METHOD the score function to move the conformation in a direction we desired. METHOD METHOD In a few cases, when we started getting a decent structure that did METHOD not correspond well to our input alignments, we submitted the METHOD structure to VAST to get structure-structure alignments, to try to METHOD find some other possible templates to use as a base. METHOD METHOD In some cases, when several conformations had good parts, different METHOD conformations were manually cut-and-pasted, with undertaker run to try METHOD to smooth out the transitions. METHOD METHOD Because undertaker does not (yet) handle multimers, we often added METHOD "scaffolding" constraints by hand to try to retain structure in METHOD dimerization interfaces. This is a crude hack that we hope to get rid METHOD of when we have multimers implemented. METHOD METHOD Because undertaker does not (yet) have a hydrogen-bond scoring METHOD function, we often had to add constraints to hold beta sheets METHOD together. In some cases where the register was not obvious, we had to METHOD guess or try several different registers. METHOD METHOD In some cases, when we got desperate for initial starting points, we METHOD threw the Robetta ab-initio models into the undertaker pool, and METHOD optimized from them as well as the ones undertaker started with. MODEL 1 PARENT N/A ATOM 1 N MET 1 9.353 -10.375 3.380 1.00 0.00 ATOM 2 CA MET 1 8.730 -11.112 2.327 1.00 0.00 ATOM 3 CB MET 1 9.639 -11.304 1.093 1.00 0.00 ATOM 4 CG MET 1 10.469 -12.572 1.277 1.00 0.00 ATOM 5 SD MET 1 12.190 -12.596 1.764 1.00 0.00 ATOM 6 CE MET 1 12.179 -11.426 3.158 1.00 0.00 ATOM 7 O MET 1 8.056 -13.343 2.228 1.00 0.00 ATOM 8 C MET 1 8.468 -12.451 2.978 1.00 0.00 ATOM 9 N LEU 2 8.666 -12.561 4.313 1.00 0.00 ATOM 10 CA LEU 2 8.361 -13.799 5.029 1.00 0.00 ATOM 11 CB LEU 2 9.569 -14.622 5.481 1.00 0.00 ATOM 12 CG LEU 2 10.584 -15.017 4.413 1.00 0.00 ATOM 13 CD1 LEU 2 11.838 -15.565 5.119 1.00 0.00 ATOM 14 CD2 LEU 2 9.986 -15.953 3.359 1.00 0.00 ATOM 15 O LEU 2 7.373 -12.384 6.636 1.00 0.00 ATOM 16 C LEU 2 7.408 -13.517 6.196 1.00 0.00 ATOM 17 N ILE 3 6.640 -14.507 6.685 1.00 0.00 ATOM 18 CA ILE 3 5.700 -14.307 7.827 1.00 0.00 ATOM 19 CB ILE 3 5.787 -15.475 8.902 1.00 0.00 ATOM 20 CG1 ILE 3 5.944 -16.853 8.262 1.00 0.00 ATOM 21 CG2 ILE 3 4.596 -15.479 9.864 1.00 0.00 ATOM 22 CD1 ILE 3 4.678 -17.419 7.674 1.00 0.00 ATOM 23 O ILE 3 5.931 -12.744 9.706 1.00 0.00 ATOM 24 C ILE 3 6.357 -13.731 9.077 1.00 0.00 ATOM 25 N SER 4 7.497 -14.340 9.441 1.00 0.00 ATOM 26 CA SER 4 8.249 -13.847 10.565 1.00 0.00 ATOM 27 CB SER 4 9.521 -14.676 10.762 1.00 0.00 ATOM 28 OG SER 4 9.209 -16.007 11.135 1.00 0.00 ATOM 29 O SER 4 8.547 -11.496 11.234 1.00 0.00 ATOM 30 C SER 4 8.676 -12.392 10.384 1.00 0.00 ATOM 31 N HIS 5 9.237 -12.134 9.204 1.00 0.00 ATOM 32 CA HIS 5 9.723 -10.789 8.893 1.00 0.00 ATOM 33 CB HIS 5 10.622 -10.816 7.656 1.00 0.00 ATOM 34 CG HIS 5 11.912 -11.549 7.865 1.00 0.00 ATOM 35 CD2 HIS 5 13.203 -11.229 8.457 1.00 0.00 ATOM 36 ND1 HIS 5 12.100 -12.852 7.461 1.00 0.00 ATOM 37 CE1 HIS 5 13.350 -13.235 7.784 1.00 0.00 ATOM 38 NE2 HIS 5 14.016 -12.264 8.380 1.00 0.00 ATOM 39 O HIS 5 8.775 -8.622 8.337 1.00 0.00 ATOM 40 C HIS 5 8.563 -9.811 8.605 1.00 0.00 ATOM 41 N SER 6 7.339 -10.332 8.677 1.00 0.00 ATOM 42 CA SER 6 6.148 -9.522 8.487 1.00 0.00 ATOM 43 CB SER 6 4.947 -10.408 8.151 1.00 0.00 ATOM 44 OG SER 6 5.143 -11.084 6.919 1.00 0.00 ATOM 45 O SER 6 5.076 -7.809 9.790 1.00 0.00 ATOM 46 C SER 6 5.867 -8.757 9.782 1.00 0.00 ATOM 47 N ASP 7 6.495 -9.208 10.870 1.00 0.00 ATOM 48 CA ASP 7 6.340 -8.541 12.179 1.00 0.00 ATOM 49 CB ASP 7 7.118 -9.289 13.260 1.00 0.00 ATOM 50 CG ASP 7 6.476 -10.611 13.631 1.00 0.00 ATOM 51 OD1 ASP 7 6.937 -11.244 14.605 1.00 0.00 ATOM 52 OD2 ASP 7 5.511 -11.016 12.948 1.00 0.00 ATOM 53 O ASP 7 6.311 -6.188 12.702 1.00 0.00 ATOM 54 C ASP 7 6.868 -7.095 12.100 1.00 0.00 ATOM 55 N LEU 8 7.981 -6.907 11.402 1.00 0.00 ATOM 56 CA LEU 8 8.547 -5.563 11.224 1.00 0.00 ATOM 57 CB LEU 8 9.854 -5.631 10.435 1.00 0.00 ATOM 58 CG LEU 8 11.054 -6.239 11.163 1.00 0.00 ATOM 59 CD1 LEU 8 12.248 -6.361 10.228 1.00 0.00 ATOM 60 CD2 LEU 8 11.463 -5.370 12.340 1.00 0.00 ATOM 61 O LEU 8 7.265 -3.581 10.807 1.00 0.00 ATOM 62 C LEU 8 7.534 -4.721 10.461 1.00 0.00 ATOM 63 N ASN 9 6.954 -5.333 9.432 1.00 0.00 ATOM 64 CA ASN 9 5.979 -4.648 8.594 1.00 0.00 ATOM 65 CB ASN 9 5.478 -5.578 7.486 1.00 0.00 ATOM 66 CG ASN 9 6.508 -5.793 6.395 1.00 0.00 ATOM 67 ND2 ASN 9 7.716 -5.284 6.616 1.00 0.00 ATOM 68 OD1 ASN 9 6.221 -6.408 5.369 1.00 0.00 ATOM 69 O ASN 9 4.292 -3.101 9.329 1.00 0.00 ATOM 70 C ASN 9 4.794 -4.215 9.453 1.00 0.00 ATOM 71 N GLN 10 4.356 -5.122 10.332 1.00 0.00 ATOM 72 CA GLN 10 3.245 -4.811 11.205 1.00 0.00 ATOM 73 CB GLN 10 3.358 -6.000 12.379 1.00 0.00 ATOM 74 CG GLN 10 2.191 -6.684 12.993 1.00 0.00 ATOM 75 CD GLN 10 2.622 -7.689 14.054 1.00 0.00 ATOM 76 OE1 GLN 10 3.652 -8.364 13.911 1.00 0.00 ATOM 77 NE2 GLN 10 1.832 -7.799 15.115 1.00 0.00 ATOM 78 O GLN 10 2.815 -2.857 12.478 1.00 0.00 ATOM 79 C GLN 10 3.621 -3.726 12.200 1.00 0.00 ATOM 80 N GLN 11 4.838 -3.774 12.731 1.00 0.00 ATOM 81 CA GLN 11 5.279 -2.775 13.697 1.00 0.00 ATOM 82 CB GLN 11 6.641 -3.157 14.277 1.00 0.00 ATOM 83 CG GLN 11 6.613 -4.387 15.171 1.00 0.00 ATOM 84 CD GLN 11 7.990 -4.775 15.674 1.00 0.00 ATOM 85 OE1 GLN 11 8.989 -4.134 15.337 1.00 0.00 ATOM 86 NE2 GLN 11 8.049 -5.826 16.483 1.00 0.00 ATOM 87 O GLN 11 5.012 -0.401 13.605 1.00 0.00 ATOM 88 C GLN 11 5.405 -1.403 13.041 1.00 0.00 ATOM 89 N LEU 12 5.932 -1.382 11.827 1.00 0.00 ATOM 90 CA LEU 12 6.109 -0.155 11.095 1.00 0.00 ATOM 91 CB LEU 12 6.847 -0.415 9.784 1.00 0.00 ATOM 92 CG LEU 12 8.331 -0.773 9.899 1.00 0.00 ATOM 93 CD1 LEU 12 8.907 -1.126 8.536 1.00 0.00 ATOM 94 CD2 LEU 12 9.124 0.399 10.459 1.00 0.00 ATOM 95 O LEU 12 4.503 1.624 11.050 1.00 0.00 ATOM 96 C LEU 12 4.729 0.441 10.791 1.00 0.00 ATOM 97 N LYS 13 3.785 -0.379 10.335 1.00 0.00 ATOM 98 CA LYS 13 2.452 0.099 9.978 1.00 0.00 ATOM 99 CB LYS 13 1.573 -1.340 9.788 1.00 0.00 ATOM 100 CG LYS 13 0.252 -1.272 9.037 1.00 0.00 ATOM 101 CD LYS 13 -0.772 -2.272 9.560 1.00 0.00 ATOM 102 CE LYS 13 -2.127 -2.042 8.902 1.00 0.00 ATOM 103 NZ LYS 13 -3.229 -2.814 9.544 1.00 0.00 ATOM 104 O LYS 13 1.003 1.596 11.165 1.00 0.00 ATOM 105 C LYS 13 1.670 0.566 11.208 1.00 0.00 ATOM 106 N SER 14 1.771 -0.195 12.298 1.00 0.00 ATOM 107 CA SER 14 1.094 0.125 13.552 1.00 0.00 ATOM 108 CB SER 14 1.253 -1.093 14.508 1.00 0.00 ATOM 109 OG SER 14 0.672 -0.869 15.774 1.00 0.00 ATOM 110 O SER 14 0.752 2.207 14.640 1.00 0.00 ATOM 111 C SER 14 1.565 1.415 14.178 1.00 0.00 ATOM 112 N ALA 15 2.877 1.632 14.206 1.00 0.00 ATOM 113 CA ALA 15 3.453 2.842 14.767 1.00 0.00 ATOM 114 CB ALA 15 4.904 2.612 15.150 1.00 0.00 ATOM 115 O ALA 15 4.121 5.025 14.050 1.00 0.00 ATOM 116 C ALA 15 3.430 4.037 13.817 1.00 0.00 ATOM 117 N GLY 16 2.643 3.934 12.748 1.00 0.00 ATOM 118 CA GLY 16 2.499 5.020 11.792 1.00 0.00 ATOM 119 O GLY 16 3.801 6.519 10.472 1.00 0.00 ATOM 120 C GLY 16 3.686 5.377 10.919 1.00 0.00 ATOM 121 N ILE 17 4.561 4.415 10.650 1.00 0.00 ATOM 122 CA ILE 17 5.730 4.640 9.811 1.00 0.00 ATOM 123 CB ILE 17 7.009 4.322 10.611 1.00 0.00 ATOM 124 CG1 ILE 17 7.071 5.235 11.834 1.00 0.00 ATOM 125 CG2 ILE 17 8.248 4.521 9.697 1.00 0.00 ATOM 126 CD1 ILE 17 7.957 4.693 12.938 1.00 0.00 ATOM 127 O ILE 17 5.512 2.417 8.936 1.00 0.00 ATOM 128 C ILE 17 5.648 3.618 8.684 1.00 0.00 ATOM 129 N GLY 18 5.726 4.103 7.450 1.00 0.00 ATOM 130 CA GLY 18 5.624 3.217 6.316 1.00 0.00 ATOM 131 O GLY 18 8.019 3.130 6.513 1.00 0.00 ATOM 132 C GLY 18 7.010 2.757 5.905 1.00 0.00 ATOM 133 N PHE 19 4.378 2.271 4.449 1.00 0.00 ATOM 134 CA PHE 19 5.077 1.132 3.873 1.00 0.00 ATOM 135 CB PHE 19 4.015 0.316 3.342 1.00 0.00 ATOM 136 CG PHE 19 4.055 -0.776 4.376 1.00 0.00 ATOM 137 CD1 PHE 19 3.035 -0.922 5.313 1.00 0.00 ATOM 138 CD2 PHE 19 5.149 -1.629 4.442 1.00 0.00 ATOM 139 CE1 PHE 19 3.106 -1.904 6.302 1.00 0.00 ATOM 140 CE2 PHE 19 5.231 -2.614 5.422 1.00 0.00 ATOM 141 CZ PHE 19 4.212 -2.750 6.352 1.00 0.00 ATOM 142 O PHE 19 4.777 2.240 1.745 1.00 0.00 ATOM 143 C PHE 19 5.481 1.493 2.432 1.00 0.00 ATOM 144 N ASN 20 6.636 0.998 1.999 1.00 0.00 ATOM 145 CA ASN 20 7.119 1.255 0.648 1.00 0.00 ATOM 146 CB ASN 20 8.681 1.162 0.613 1.00 0.00 ATOM 147 CG ASN 20 9.331 2.303 1.390 1.00 0.00 ATOM 148 ND2 ASN 20 10.261 2.002 2.278 1.00 0.00 ATOM 149 OD1 ASN 20 8.909 3.462 1.205 1.00 0.00 ATOM 150 O ASN 20 5.887 -0.741 0.074 1.00 0.00 ATOM 151 C ASN 20 6.431 0.299 -0.332 1.00 0.00 ATOM 152 N ALA 21 6.425 0.670 -1.607 1.00 0.00 ATOM 153 CA ALA 21 5.813 -0.175 -2.629 1.00 0.00 ATOM 154 CB ALA 21 6.499 0.502 -3.964 1.00 0.00 ATOM 155 O ALA 21 5.808 -2.575 -2.816 1.00 0.00 ATOM 156 C ALA 21 6.485 -1.545 -2.717 1.00 0.00 ATOM 157 N THR 22 7.821 -1.551 -2.670 1.00 0.00 ATOM 158 CA THR 22 8.579 -2.791 -2.749 1.00 0.00 ATOM 159 CB THR 22 10.091 -2.520 -2.849 1.00 0.00 ATOM 160 CG2 THR 22 10.865 -3.830 -2.890 1.00 0.00 ATOM 161 OG1 THR 22 10.371 -1.779 -4.041 1.00 0.00 ATOM 162 O THR 22 8.110 -4.883 -1.672 1.00 0.00 ATOM 163 C THR 22 8.366 -3.682 -1.532 1.00 0.00 ATOM 164 N GLU 23 8.468 -3.103 -0.333 1.00 0.00 ATOM 165 CA GLU 23 8.275 -3.910 0.872 1.00 0.00 ATOM 166 CB GLU 23 8.501 -3.065 2.127 1.00 0.00 ATOM 167 CG GLU 23 9.947 -2.646 2.340 1.00 0.00 ATOM 168 CD GLU 23 10.125 -1.767 3.561 1.00 0.00 ATOM 169 OE1 GLU 23 9.111 -1.439 4.211 1.00 0.00 ATOM 170 OE2 GLU 23 11.281 -1.401 3.867 1.00 0.00 ATOM 171 O GLU 23 6.726 -5.676 1.445 1.00 0.00 ATOM 172 C GLU 23 6.883 -4.515 1.009 1.00 0.00 ATOM 173 N LEU 24 5.879 -3.742 0.648 1.00 0.00 ATOM 174 CA LEU 24 4.524 -4.241 0.608 1.00 0.00 ATOM 175 CB LEU 24 3.547 -3.120 0.250 1.00 0.00 ATOM 176 CG LEU 24 2.070 -3.501 0.192 1.00 0.00 ATOM 177 CD1 LEU 24 1.576 -3.953 1.557 1.00 0.00 ATOM 178 CD2 LEU 24 1.225 -2.317 -0.249 1.00 0.00 ATOM 179 O LEU 24 3.859 -6.437 -0.167 1.00 0.00 ATOM 180 C LEU 24 4.368 -5.358 -0.442 1.00 0.00 ATOM 181 N HIS 25 4.821 -5.079 -1.640 1.00 0.00 ATOM 182 CA HIS 25 4.744 -6.060 -2.746 1.00 0.00 ATOM 183 CB HIS 25 5.423 -5.508 -4.001 1.00 0.00 ATOM 184 CG HIS 25 5.394 -6.446 -5.165 1.00 0.00 ATOM 185 CD2 HIS 25 6.323 -7.403 -5.754 1.00 0.00 ATOM 186 ND1 HIS 25 4.303 -6.567 -5.998 1.00 0.00 ATOM 187 CE1 HIS 25 4.574 -7.480 -6.945 1.00 0.00 ATOM 188 NE2 HIS 25 5.784 -7.986 -6.805 1.00 0.00 ATOM 189 O HIS 25 4.807 -8.466 -2.635 1.00 0.00 ATOM 190 C HIS 25 5.407 -7.377 -2.433 1.00 0.00 ATOM 191 N GLY 26 7.048 -7.418 -2.111 1.00 0.00 ATOM 192 CA GLY 26 7.835 -8.544 -1.638 1.00 0.00 ATOM 193 O GLY 26 7.001 -10.676 -0.879 1.00 0.00 ATOM 194 C GLY 26 6.959 -9.445 -0.760 1.00 0.00 ATOM 195 N PHE 27 6.132 -8.826 0.088 1.00 0.00 ATOM 196 CA PHE 27 5.245 -9.557 0.994 1.00 0.00 ATOM 197 CB PHE 27 4.484 -8.585 1.901 1.00 0.00 ATOM 198 CG PHE 27 3.507 -9.256 2.823 1.00 0.00 ATOM 199 CD1 PHE 27 3.943 -9.896 3.969 1.00 0.00 ATOM 200 CD2 PHE 27 2.151 -9.248 2.544 1.00 0.00 ATOM 201 CE1 PHE 27 3.044 -10.513 4.819 1.00 0.00 ATOM 202 CE2 PHE 27 1.254 -9.867 3.394 1.00 0.00 ATOM 203 CZ PHE 27 1.694 -10.497 4.528 1.00 0.00 ATOM 204 O PHE 27 4.116 -11.612 0.449 1.00 0.00 ATOM 205 C PHE 27 4.208 -10.393 0.254 1.00 0.00 ATOM 206 N LEU 28 3.443 -9.712 -0.609 1.00 0.00 ATOM 207 CA LEU 28 2.402 -10.417 -1.353 1.00 0.00 ATOM 208 CB LEU 28 2.025 -9.401 -2.616 1.00 0.00 ATOM 209 CG LEU 28 0.641 -8.946 -3.073 1.00 0.00 ATOM 210 CD1 LEU 28 -0.103 -8.189 -1.982 1.00 0.00 ATOM 211 CD2 LEU 28 0.757 -8.072 -4.319 1.00 0.00 ATOM 212 O LEU 28 2.409 -12.528 -2.491 1.00 0.00 ATOM 213 C LEU 28 2.985 -11.475 -2.248 1.00 0.00 ATOM 214 N SER 29 4.122 -11.159 -2.829 1.00 0.00 ATOM 215 CA SER 29 4.771 -12.107 -3.704 1.00 0.00 ATOM 216 CB SER 29 6.064 -11.518 -4.270 1.00 0.00 ATOM 217 OG SER 29 5.792 -10.417 -5.118 1.00 0.00 ATOM 218 O SER 29 4.938 -14.488 -3.408 1.00 0.00 ATOM 219 C SER 29 5.100 -13.370 -2.914 1.00 0.00 ATOM 220 N GLY 30 5.582 -13.197 -1.693 1.00 0.00 ATOM 221 CA GLY 30 5.946 -14.371 -0.905 1.00 0.00 ATOM 222 O GLY 30 4.824 -16.440 -0.525 1.00 0.00 ATOM 223 C GLY 30 4.755 -15.211 -0.517 1.00 0.00 ATOM 224 N LEU 31 3.689 -14.511 -0.123 1.00 0.00 ATOM 225 CA LEU 31 2.448 -15.153 0.269 1.00 0.00 ATOM 226 CB LEU 31 1.335 -14.212 0.457 1.00 0.00 ATOM 227 CG LEU 31 1.377 -13.390 1.748 1.00 0.00 ATOM 228 CD1 LEU 31 0.320 -12.302 1.697 1.00 0.00 ATOM 229 CD2 LEU 31 1.171 -14.305 2.944 1.00 0.00 ATOM 230 O LEU 31 1.544 -17.023 -0.773 1.00 0.00 ATOM 231 C LEU 31 1.894 -15.883 -0.905 1.00 0.00 ATOM 232 N LEU 32 1.891 -15.187 -2.049 1.00 0.00 ATOM 233 CA LEU 32 1.440 -15.769 -3.314 1.00 0.00 ATOM 234 CB LEU 32 1.404 -14.700 -4.407 1.00 0.00 ATOM 235 CG LEU 32 0.309 -13.639 -4.282 1.00 0.00 ATOM 236 CD1 LEU 32 0.465 -12.574 -5.359 1.00 0.00 ATOM 237 CD2 LEU 32 -1.069 -14.264 -4.430 1.00 0.00 ATOM 238 O LEU 32 1.877 -17.915 -4.264 1.00 0.00 ATOM 239 C LEU 32 2.359 -16.886 -3.793 1.00 0.00 ATOM 240 N CYS 33 3.666 -16.708 -3.647 1.00 0.00 ATOM 241 CA CYS 33 4.584 -17.746 -4.101 1.00 0.00 ATOM 242 CB CYS 33 5.950 -17.142 -4.436 1.00 0.00 ATOM 243 SG CYS 33 5.947 -16.030 -5.861 1.00 0.00 ATOM 244 O CYS 33 5.621 -19.795 -3.371 1.00 0.00 ATOM 245 C CYS 33 4.852 -18.867 -3.088 1.00 0.00 ATOM 246 N GLY 34 4.253 -18.774 -1.902 1.00 0.00 ATOM 247 CA GLY 34 4.417 -19.809 -0.899 1.00 0.00 ATOM 248 O GLY 34 5.619 -20.616 0.992 1.00 0.00 ATOM 249 C GLY 34 5.506 -19.713 0.157 1.00 0.00 ATOM 250 N GLY 35 6.304 -18.651 0.149 1.00 0.00 ATOM 251 CA GLY 35 7.358 -18.506 1.150 1.00 0.00 ATOM 252 O GLY 35 7.605 -18.064 3.505 1.00 0.00 ATOM 253 C GLY 35 6.877 -17.994 2.507 1.00 0.00 ATOM 254 N LEU 36 5.669 -17.447 2.518 1.00 0.00 ATOM 255 CA LEU 36 5.047 -16.958 3.735 1.00 0.00 ATOM 256 CB LEU 36 4.622 -15.496 3.594 1.00 0.00 ATOM 257 CG LEU 36 3.996 -14.807 4.817 1.00 0.00 ATOM 258 CD1 LEU 36 4.922 -14.840 6.036 1.00 0.00 ATOM 259 CD2 LEU 36 3.670 -13.383 4.457 1.00 0.00 ATOM 260 O LEU 36 2.837 -17.775 3.233 1.00 0.00 ATOM 261 C LEU 36 3.832 -17.867 3.956 1.00 0.00 ATOM 262 N LYS 37 3.934 -18.804 4.915 1.00 0.00 ATOM 263 CA LYS 37 2.843 -19.739 5.224 1.00 0.00 ATOM 264 CB LYS 37 3.260 -20.693 6.350 1.00 0.00 ATOM 265 CG LYS 37 4.368 -21.658 5.962 1.00 0.00 ATOM 266 CD LYS 37 4.721 -22.582 7.118 1.00 0.00 ATOM 267 CE LYS 37 5.829 -23.548 6.735 1.00 0.00 ATOM 268 NZ LYS 37 6.195 -24.452 7.860 1.00 0.00 ATOM 269 O LYS 37 1.582 -17.918 6.136 1.00 0.00 ATOM 270 C LYS 37 1.562 -19.060 5.681 1.00 0.00 ATOM 271 N ASP 38 0.440 -19.757 5.509 1.00 0.00 ATOM 272 CA ASP 38 -0.861 -19.249 5.904 1.00 0.00 ATOM 273 CB ASP 38 -1.943 -20.304 5.677 1.00 0.00 ATOM 274 CG ASP 38 -2.246 -20.521 4.208 1.00 0.00 ATOM 275 OD1 ASP 38 -3.215 -21.249 3.901 1.00 0.00 ATOM 276 OD2 ASP 38 -1.521 -19.960 3.360 1.00 0.00 ATOM 277 O ASP 38 -1.554 -17.829 7.692 1.00 0.00 ATOM 278 C ASP 38 -0.939 -18.847 7.376 1.00 0.00 ATOM 279 N GLN 39 -0.288 -19.606 8.264 1.00 0.00 ATOM 280 CA GLN 39 -0.318 -19.293 9.699 1.00 0.00 ATOM 281 CB GLN 39 0.833 -20.493 10.311 1.00 0.00 ATOM 282 CG GLN 39 1.067 -21.787 9.583 1.00 0.00 ATOM 283 CD GLN 39 -0.034 -22.774 9.904 1.00 0.00 ATOM 284 OE1 GLN 39 -0.489 -23.395 8.949 1.00 0.00 ATOM 285 NE2 GLN 39 -0.378 -22.951 11.165 1.00 0.00 ATOM 286 O GLN 39 -0.063 -17.378 11.112 1.00 0.00 ATOM 287 C GLN 39 0.271 -17.936 10.065 1.00 0.00 ATOM 288 N SER 40 1.147 -17.408 9.217 1.00 0.00 ATOM 289 CA SER 40 1.723 -16.087 9.454 1.00 0.00 ATOM 290 CB SER 40 3.199 -16.467 8.559 1.00 0.00 ATOM 291 OG SER 40 2.802 -16.179 7.230 1.00 0.00 ATOM 292 O SER 40 0.733 -13.910 9.325 1.00 0.00 ATOM 293 C SER 40 0.841 -15.026 8.816 1.00 0.00 ATOM 294 N TRP 41 0.190 -15.383 7.708 1.00 0.00 ATOM 295 CA TRP 41 -0.695 -14.456 7.005 1.00 0.00 ATOM 296 CB TRP 41 -1.040 -14.993 5.616 1.00 0.00 ATOM 297 CG TRP 41 -1.935 -14.088 4.827 1.00 0.00 ATOM 298 CD1 TRP 41 -1.552 -13.026 4.057 1.00 0.00 ATOM 299 CD2 TRP 41 -3.362 -14.162 4.731 1.00 0.00 ATOM 300 CE2 TRP 41 -3.777 -13.113 3.886 1.00 0.00 ATOM 301 CE3 TRP 41 -4.330 -15.010 5.277 1.00 0.00 ATOM 302 NE1 TRP 41 -2.652 -12.434 3.487 1.00 0.00 ATOM 303 CZ2 TRP 41 -5.118 -12.891 3.573 1.00 0.00 ATOM 304 CZ3 TRP 41 -5.658 -14.785 4.965 1.00 0.00 ATOM 305 CH2 TRP 41 -6.042 -13.738 4.121 1.00 0.00 ATOM 306 O TRP 41 -2.580 -13.169 7.754 1.00 0.00 ATOM 307 C TRP 41 -1.997 -14.252 7.781 1.00 0.00 ATOM 308 N LEU 42 -2.481 -15.322 8.415 1.00 0.00 ATOM 309 CA LEU 42 -3.714 -15.256 9.209 1.00 0.00 ATOM 310 CB LEU 42 -4.123 -16.654 9.677 1.00 0.00 ATOM 311 CG LEU 42 -4.639 -17.605 8.595 1.00 0.00 ATOM 312 CD1 LEU 42 -4.888 -18.991 9.174 1.00 0.00 ATOM 313 CD2 LEU 42 -5.946 -17.095 8.009 1.00 0.00 ATOM 314 O LEU 42 -4.378 -13.592 10.800 1.00 0.00 ATOM 315 C LEU 42 -3.499 -14.373 10.437 1.00 0.00 ATOM 316 N PRO 43 -2.327 -14.489 11.062 1.00 0.00 ATOM 317 CA PRO 43 -1.988 -13.670 12.226 1.00 0.00 ATOM 318 CB PRO 43 -0.696 -14.154 12.741 1.00 0.00 ATOM 319 CG PRO 43 -0.789 -15.614 12.469 1.00 0.00 ATOM 320 CD PRO 43 -1.388 -15.702 11.089 1.00 0.00 ATOM 321 O PRO 43 -2.509 -11.339 12.490 1.00 0.00 ATOM 322 C PRO 43 -1.941 -12.191 11.809 1.00 0.00 ATOM 323 N LEU 44 -1.296 -11.911 10.664 1.00 0.00 ATOM 324 CA LEU 44 -1.227 -10.525 10.193 1.00 0.00 ATOM 325 CB LEU 44 -0.380 -10.432 8.920 1.00 0.00 ATOM 326 CG LEU 44 1.125 -10.644 9.092 1.00 0.00 ATOM 327 CD1 LEU 44 1.823 -10.651 7.741 1.00 0.00 ATOM 328 CD2 LEU 44 1.732 -9.535 9.934 1.00 0.00 ATOM 329 O LEU 44 -2.942 -8.831 10.146 1.00 0.00 ATOM 330 C LEU 44 -2.618 -10.001 9.882 1.00 0.00 ATOM 331 N LEU 45 -3.463 -10.829 9.334 1.00 0.00 ATOM 332 CA LEU 45 -4.824 -10.375 9.005 1.00 0.00 ATOM 333 CB LEU 45 -5.577 -11.457 8.225 1.00 0.00 ATOM 334 CG LEU 45 -6.989 -11.095 7.757 1.00 0.00 ATOM 335 CD1 LEU 45 -6.949 -9.936 6.773 1.00 0.00 ATOM 336 CD2 LEU 45 -7.646 -12.281 7.068 1.00 0.00 ATOM 337 O LEU 45 -6.360 -9.095 10.366 1.00 0.00 ATOM 338 C LEU 45 -5.610 -10.066 10.290 1.00 0.00 ATOM 339 N TYR 46 -5.413 -10.899 11.297 1.00 0.00 ATOM 340 CA TYR 46 -6.068 -10.721 12.601 1.00 0.00 ATOM 341 CB TYR 46 -5.663 -11.840 13.563 1.00 0.00 ATOM 342 CG TYR 46 -6.259 -11.706 14.944 1.00 0.00 ATOM 343 CD1 TYR 46 -7.580 -12.061 15.186 1.00 0.00 ATOM 344 CD2 TYR 46 -5.500 -11.229 16.005 1.00 0.00 ATOM 345 CE1 TYR 46 -8.135 -11.944 16.445 1.00 0.00 ATOM 346 CE2 TYR 46 -6.037 -11.104 17.271 1.00 0.00 ATOM 347 CZ TYR 46 -7.366 -11.467 17.487 1.00 0.00 ATOM 348 OH TYR 46 -7.914 -11.349 18.743 1.00 0.00 ATOM 349 O TYR 46 -6.514 -8.615 13.699 1.00 0.00 ATOM 350 C TYR 46 -5.672 -9.375 13.226 1.00 0.00 ATOM 351 N GLN 47 -4.370 -9.115 13.233 1.00 0.00 ATOM 352 CA GLN 47 -3.793 -7.887 13.769 1.00 0.00 ATOM 353 CB GLN 47 -2.271 -7.910 13.639 1.00 0.00 ATOM 354 CG GLN 47 -1.583 -8.911 14.553 1.00 0.00 ATOM 355 CD GLN 47 -1.828 -8.622 16.020 1.00 0.00 ATOM 356 OE1 GLN 47 -1.564 -7.520 16.500 1.00 0.00 ATOM 357 NE2 GLN 47 -2.334 -9.618 16.741 1.00 0.00 ATOM 358 O GLN 47 -4.688 -5.671 13.676 1.00 0.00 ATOM 359 C GLN 47 -4.302 -6.647 13.038 1.00 0.00 ATOM 360 N PHE 48 -4.301 -6.668 11.717 1.00 0.00 ATOM 361 CA PHE 48 -4.772 -5.553 10.893 1.00 0.00 ATOM 362 CB PHE 48 -4.687 -5.908 9.408 1.00 0.00 ATOM 363 CG PHE 48 -3.288 -5.903 8.861 1.00 0.00 ATOM 364 CD1 PHE 48 -2.253 -5.322 9.577 1.00 0.00 ATOM 365 CD2 PHE 48 -3.002 -6.475 7.636 1.00 0.00 ATOM 366 CE1 PHE 48 -0.966 -5.317 9.075 1.00 0.00 ATOM 367 CE2 PHE 48 -1.717 -6.469 7.134 1.00 0.00 ATOM 368 CZ PHE 48 -0.699 -5.893 7.848 1.00 0.00 ATOM 369 O PHE 48 -6.617 -4.061 11.357 1.00 0.00 ATOM 370 C PHE 48 -6.225 -5.227 11.235 1.00 0.00 ATOM 371 N SER 49 -6.968 -6.303 11.357 1.00 0.00 ATOM 372 CA SER 49 -8.402 -6.252 11.675 1.00 0.00 ATOM 373 CB SER 49 -8.989 -7.662 11.728 1.00 0.00 ATOM 374 OG SER 49 -8.961 -8.277 10.452 1.00 0.00 ATOM 375 O SER 49 -9.182 -4.501 13.134 1.00 0.00 ATOM 376 C SER 49 -8.579 -5.579 13.039 1.00 0.00 ATOM 377 N ASN 50 -8.029 -6.230 14.046 1.00 0.00 ATOM 378 CA ASN 50 -8.097 -5.745 15.432 1.00 0.00 ATOM 379 CB ASN 50 -7.184 -6.577 16.335 1.00 0.00 ATOM 380 CG ASN 50 -7.298 -6.186 17.795 1.00 0.00 ATOM 381 ND2 ASN 50 -6.183 -5.758 18.380 1.00 0.00 ATOM 382 OD1 ASN 50 -8.372 -6.265 18.388 1.00 0.00 ATOM 383 O ASN 50 -8.247 -3.509 16.277 1.00 0.00 ATOM 384 C ASN 50 -7.656 -4.295 15.507 1.00 0.00 ATOM 385 N ASP 51 -6.648 -3.940 14.731 1.00 0.00 ATOM 386 CA ASP 51 -6.141 -2.570 14.709 1.00 0.00 ATOM 387 CB ASP 51 -4.904 -2.384 15.558 1.00 0.00 ATOM 388 CG ASP 51 -5.243 -2.106 17.022 1.00 0.00 ATOM 389 OD1 ASP 51 -6.431 -2.082 17.343 1.00 0.00 ATOM 390 OD2 ASP 51 -4.267 -1.904 17.768 1.00 0.00 ATOM 391 O ASP 51 -5.276 -3.230 12.574 1.00 0.00 ATOM 392 C ASP 51 -5.510 -2.298 13.342 1.00 0.00 ATOM 393 N ASN 52 -5.318 -1.023 13.007 1.00 0.00 ATOM 394 CA ASN 52 -4.663 -0.667 11.763 1.00 0.00 ATOM 395 CB ASN 52 -5.511 0.329 11.010 1.00 0.00 ATOM 396 CG ASN 52 -6.780 -0.433 10.616 1.00 0.00 ATOM 397 ND2 ASN 52 -7.933 0.081 11.002 1.00 0.00 ATOM 398 OD1 ASN 52 -6.668 -1.486 9.993 1.00 0.00 ATOM 399 O ASN 52 -3.417 0.723 13.253 1.00 0.00 ATOM 400 C ASN 52 -3.573 0.345 12.093 1.00 0.00 ATOM 401 N HIS 53 -2.824 0.789 11.083 1.00 0.00 ATOM 402 CA HIS 53 -1.720 1.723 11.327 1.00 0.00 ATOM 403 CB HIS 53 -0.543 1.377 10.451 1.00 0.00 ATOM 404 CG HIS 53 -0.771 1.525 9.003 1.00 0.00 ATOM 405 CD2 HIS 53 -1.887 1.632 8.246 1.00 0.00 ATOM 406 ND1 HIS 53 0.284 1.574 8.091 1.00 0.00 ATOM 407 CE1 HIS 53 -0.210 1.692 6.902 1.00 0.00 ATOM 408 NE2 HIS 53 -1.528 1.766 6.949 1.00 0.00 ATOM 409 O HIS 53 -1.309 4.119 11.322 1.00 0.00 ATOM 410 C HIS 53 -2.122 3.186 11.209 1.00 0.00 ATOM 411 N ALA 54 -3.406 3.441 10.946 1.00 0.00 ATOM 412 CA ALA 54 -3.878 4.805 10.736 1.00 0.00 ATOM 413 CB ALA 54 -5.251 4.805 10.050 1.00 0.00 ATOM 414 O ALA 54 -4.447 4.817 13.047 1.00 0.00 ATOM 415 C ALA 54 -4.178 5.506 12.059 1.00 0.00 ATOM 416 N TYR 55 -4.132 6.826 12.028 1.00 0.00 ATOM 417 CA TYR 55 -4.619 7.762 13.020 1.00 0.00 ATOM 418 CB TYR 55 -3.653 8.943 13.310 1.00 0.00 ATOM 419 CG TYR 55 -2.221 8.576 13.594 1.00 0.00 ATOM 420 CD1 TYR 55 -1.832 7.296 14.021 1.00 0.00 ATOM 421 CD2 TYR 55 -1.240 9.542 13.448 1.00 0.00 ATOM 422 CE1 TYR 55 -0.490 6.976 14.260 1.00 0.00 ATOM 423 CE2 TYR 55 0.135 9.258 13.696 1.00 0.00 ATOM 424 CZ TYR 55 0.474 7.967 14.096 1.00 0.00 ATOM 425 OH TYR 55 1.816 7.716 14.314 1.00 0.00 ATOM 426 O TYR 55 -6.125 8.752 11.493 1.00 0.00 ATOM 427 C TYR 55 -6.007 8.267 12.627 1.00 0.00 ATOM 428 N PRO 56 -6.975 8.128 13.548 1.00 0.00 ATOM 429 CA PRO 56 -8.301 8.691 13.292 1.00 0.00 ATOM 430 CB PRO 56 -9.158 8.145 14.438 1.00 0.00 ATOM 431 CG PRO 56 -8.193 7.909 15.549 1.00 0.00 ATOM 432 CD PRO 56 -6.968 7.311 14.913 1.00 0.00 ATOM 433 O PRO 56 -9.417 10.736 12.893 1.00 0.00 ATOM 434 C PRO 56 -8.374 10.200 13.279 1.00 0.00 ATOM 435 N THR 57 -7.317 10.909 13.634 1.00 0.00 ATOM 436 CA THR 57 -7.291 12.356 13.524 1.00 0.00 ATOM 437 CB THR 57 -6.302 12.982 14.525 1.00 0.00 ATOM 438 CG2 THR 57 -6.679 12.606 15.949 1.00 0.00 ATOM 439 OG1 THR 57 -4.978 12.504 14.256 1.00 0.00 ATOM 440 O THR 57 -6.937 14.051 11.937 1.00 0.00 ATOM 441 C THR 57 -6.875 12.848 12.159 1.00 0.00 ATOM 442 N GLY 58 -6.238 11.989 11.331 1.00 0.00 ATOM 443 CA GLY 58 -5.892 12.369 9.982 1.00 0.00 ATOM 444 O GLY 58 -7.292 10.628 9.194 1.00 0.00 ATOM 445 C GLY 58 -6.399 11.415 8.936 1.00 0.00 ATOM 446 N LEU 59 -5.722 10.961 7.740 1.00 0.00 ATOM 447 CA LEU 59 -6.318 10.254 6.612 1.00 0.00 ATOM 448 CB LEU 59 -5.361 10.251 5.417 1.00 0.00 ATOM 449 CG LEU 59 -5.072 11.608 4.778 1.00 0.00 ATOM 450 CD1 LEU 59 -4.015 11.477 3.693 1.00 0.00 ATOM 451 CD2 LEU 59 -6.330 12.189 4.150 1.00 0.00 ATOM 452 O LEU 59 -7.302 8.146 6.162 1.00 0.00 ATOM 453 C LEU 59 -6.638 8.809 6.947 1.00 0.00 ATOM 454 N VAL 60 -6.195 8.360 8.126 1.00 0.00 ATOM 455 CA VAL 60 -6.468 6.997 8.596 1.00 0.00 ATOM 456 CB VAL 60 -4.945 6.644 9.457 1.00 0.00 ATOM 457 CG1 VAL 60 -3.729 7.447 8.991 1.00 0.00 ATOM 458 CG2 VAL 60 -5.385 7.078 10.880 1.00 0.00 ATOM 459 O VAL 60 -8.159 5.913 9.809 1.00 0.00 ATOM 460 C VAL 60 -7.920 6.850 9.043 1.00 0.00 ATOM 461 N GLN 61 -8.600 7.979 9.208 1.00 0.00 ATOM 462 CA GLN 61 -9.968 7.983 9.736 1.00 0.00 ATOM 463 CB GLN 61 -10.528 9.408 9.762 1.00 0.00 ATOM 464 CG GLN 61 -11.917 9.517 10.367 1.00 0.00 ATOM 465 CD GLN 61 -12.412 10.948 10.434 1.00 0.00 ATOM 466 OE1 GLN 61 -11.721 11.876 10.010 1.00 0.00 ATOM 467 NE2 GLN 61 -13.614 11.134 10.966 1.00 0.00 ATOM 468 O GLN 61 -12.012 6.907 9.347 1.00 0.00 ATOM 469 C GLN 61 -10.895 7.128 8.882 1.00 0.00 ATOM 470 N PRO 62 -10.758 7.303 7.553 1.00 0.00 ATOM 471 CA PRO 62 -11.615 6.512 6.675 1.00 0.00 ATOM 472 CB PRO 62 -11.617 7.292 5.358 1.00 0.00 ATOM 473 CG PRO 62 -10.303 8.000 5.343 1.00 0.00 ATOM 474 CD PRO 62 -10.084 8.501 6.741 1.00 0.00 ATOM 475 O PRO 62 -9.814 4.903 6.936 1.00 0.00 ATOM 476 C PRO 62 -10.973 5.104 6.543 1.00 0.00 ATOM 477 N VAL 63 -9.417 5.498 7.383 1.00 0.00 ATOM 478 CA VAL 63 -8.292 4.583 7.571 1.00 0.00 ATOM 479 CB VAL 63 -7.135 5.139 8.320 1.00 0.00 ATOM 480 CG1 VAL 63 -6.054 4.097 8.664 1.00 0.00 ATOM 481 CG2 VAL 63 -6.474 6.286 7.527 1.00 0.00 ATOM 482 O VAL 63 -8.393 2.230 8.033 1.00 0.00 ATOM 483 C VAL 63 -8.671 3.368 8.414 1.00 0.00 ATOM 484 N THR 64 -9.314 3.618 9.566 1.00 0.00 ATOM 485 CA THR 64 -9.690 2.488 10.415 1.00 0.00 ATOM 486 CB THR 64 -10.413 2.928 11.694 1.00 0.00 ATOM 487 CG2 THR 64 -10.752 1.705 12.544 1.00 0.00 ATOM 488 OG1 THR 64 -9.578 3.779 12.491 1.00 0.00 ATOM 489 O THR 64 -10.426 0.329 9.666 1.00 0.00 ATOM 490 C THR 64 -10.608 1.550 9.635 1.00 0.00 ATOM 491 N GLU 65 -11.599 2.085 8.925 1.00 0.00 ATOM 492 CA GLU 65 -12.501 1.235 8.158 1.00 0.00 ATOM 493 CB GLU 65 -13.683 2.055 7.639 1.00 0.00 ATOM 494 CG GLU 65 -14.693 1.272 6.802 1.00 0.00 ATOM 495 CD GLU 65 -15.277 0.076 7.537 1.00 0.00 ATOM 496 OE1 GLU 65 -15.611 0.212 8.733 1.00 0.00 ATOM 497 OE2 GLU 65 -15.420 -0.999 6.914 1.00 0.00 ATOM 498 O GLU 65 -11.920 -0.542 6.669 1.00 0.00 ATOM 499 C GLU 65 -11.734 0.628 6.991 1.00 0.00 ATOM 500 N LEU 66 -10.859 1.413 6.364 1.00 0.00 ATOM 501 CA LEU 66 -10.066 0.896 5.259 1.00 0.00 ATOM 502 CB LEU 66 -9.138 2.020 4.721 1.00 0.00 ATOM 503 CG LEU 66 -8.303 1.714 3.475 1.00 0.00 ATOM 504 CD1 LEU 66 -9.217 1.479 2.288 1.00 0.00 ATOM 505 CD2 LEU 66 -7.353 2.874 3.200 1.00 0.00 ATOM 506 O LEU 66 -9.140 -1.306 5.036 1.00 0.00 ATOM 507 C LEU 66 -9.247 -0.302 5.733 1.00 0.00 ATOM 508 N TYR 67 -10.270 -2.018 4.727 1.00 0.00 ATOM 509 CA TYR 67 -9.754 -3.387 4.685 1.00 0.00 ATOM 510 CB TYR 67 -8.425 -3.549 5.287 1.00 0.00 ATOM 511 CG TYR 67 -7.398 -2.737 4.537 1.00 0.00 ATOM 512 CD1 TYR 67 -7.332 -2.782 3.143 1.00 0.00 ATOM 513 CD2 TYR 67 -6.540 -1.868 5.207 1.00 0.00 ATOM 514 CE1 TYR 67 -6.445 -1.978 2.435 1.00 0.00 ATOM 515 CE2 TYR 67 -5.647 -1.056 4.507 1.00 0.00 ATOM 516 CZ TYR 67 -5.607 -1.112 3.124 1.00 0.00 ATOM 517 OH TYR 67 -4.755 -0.284 2.429 1.00 0.00 ATOM 518 O TYR 67 -11.001 -5.414 4.946 1.00 0.00 ATOM 519 C TYR 67 -10.738 -4.293 5.389 1.00 0.00 ATOM 520 N GLU 68 -11.384 -3.835 6.433 1.00 0.00 ATOM 521 CA GLU 68 -12.480 -4.592 7.047 1.00 0.00 ATOM 522 CB GLU 68 -12.995 -3.878 8.297 1.00 0.00 ATOM 523 CG GLU 68 -14.111 -4.613 9.020 1.00 0.00 ATOM 524 CD GLU 68 -14.558 -3.899 10.280 1.00 0.00 ATOM 525 OE1 GLU 68 -13.997 -2.825 10.586 1.00 0.00 ATOM 526 OE2 GLU 68 -15.470 -4.414 10.961 1.00 0.00 ATOM 527 O GLU 68 -14.224 -5.895 6.000 1.00 0.00 ATOM 528 C GLU 68 -13.684 -4.773 6.091 1.00 0.00 ATOM 529 N GLN 69 -14.116 -3.689 5.401 1.00 0.00 ATOM 530 CA GLN 69 -15.191 -3.821 4.427 1.00 0.00 ATOM 531 CB GLN 69 -15.568 -2.488 3.868 1.00 0.00 ATOM 532 CG GLN 69 -16.270 -2.542 2.534 1.00 0.00 ATOM 533 CD GLN 69 -16.926 -1.229 2.163 1.00 0.00 ATOM 534 OE1 GLN 69 -16.661 -0.186 2.785 1.00 0.00 ATOM 535 NE2 GLN 69 -17.803 -1.266 1.151 1.00 0.00 ATOM 536 O GLN 69 -15.618 -5.365 2.625 1.00 0.00 ATOM 537 C GLN 69 -14.792 -4.652 3.216 1.00 0.00 ATOM 538 N ILE 70 -13.526 -4.538 2.802 1.00 0.00 ATOM 539 CA ILE 70 -13.069 -5.297 1.638 1.00 0.00 ATOM 540 CB ILE 70 -11.729 -4.751 1.104 1.00 0.00 ATOM 541 CG1 ILE 70 -11.798 -3.341 0.550 1.00 0.00 ATOM 542 CG2 ILE 70 -11.141 -5.712 0.088 1.00 0.00 ATOM 543 CD1 ILE 70 -10.486 -2.600 0.410 1.00 0.00 ATOM 544 O ILE 70 -13.475 -7.647 1.279 1.00 0.00 ATOM 545 C ILE 70 -12.991 -6.774 2.033 1.00 0.00 ATOM 546 N SER 71 -12.381 -7.045 3.181 1.00 0.00 ATOM 547 CA SER 71 -12.361 -8.437 3.677 1.00 0.00 ATOM 548 CB SER 71 -11.511 -8.541 4.945 1.00 0.00 ATOM 549 OG SER 71 -10.149 -8.266 4.670 1.00 0.00 ATOM 550 O SER 71 -14.085 -10.063 3.613 1.00 0.00 ATOM 551 C SER 71 -13.780 -8.907 4.006 1.00 0.00 ATOM 552 N GLN 72 -14.636 -8.079 4.598 1.00 0.00 ATOM 553 CA GLN 72 -16.005 -8.485 4.879 1.00 0.00 ATOM 554 CB GLN 72 -16.748 -7.384 5.642 1.00 0.00 ATOM 555 CG GLN 72 -18.177 -7.741 6.011 1.00 0.00 ATOM 556 CD GLN 72 -18.856 -6.653 6.822 1.00 0.00 ATOM 557 OE1 GLN 72 -18.263 -5.611 7.102 1.00 0.00 ATOM 558 NE2 GLN 72 -20.106 -6.895 7.202 1.00 0.00 ATOM 559 O GLN 72 -17.413 -9.780 3.432 1.00 0.00 ATOM 560 C GLN 72 -16.743 -8.757 3.578 1.00 0.00 ATOM 561 N THR 73 -16.620 -7.871 2.562 1.00 0.00 ATOM 562 CA THR 73 -17.289 -8.052 1.285 1.00 0.00 ATOM 563 CB THR 73 -17.263 -6.758 0.448 1.00 0.00 ATOM 564 CG2 THR 73 -17.938 -6.982 -0.895 1.00 0.00 ATOM 565 OG1 THR 73 -17.961 -5.720 1.148 1.00 0.00 ATOM 566 O THR 73 -17.282 -9.964 -0.165 1.00 0.00 ATOM 567 C THR 73 -16.619 -9.141 0.467 1.00 0.00 ATOM 568 N LEU 74 -15.278 -9.172 0.493 1.00 0.00 ATOM 569 CA LEU 74 -14.544 -10.138 -0.308 1.00 0.00 ATOM 570 CB LEU 74 -13.776 -9.390 -1.432 1.00 0.00 ATOM 571 CG LEU 74 -14.554 -8.429 -2.277 1.00 0.00 ATOM 572 CD1 LEU 74 -13.610 -7.712 -3.273 1.00 0.00 ATOM 573 CD2 LEU 74 -15.666 -9.129 -2.978 1.00 0.00 ATOM 574 O LEU 74 -13.189 -10.807 1.552 1.00 0.00 ATOM 575 C LEU 74 -13.938 -11.161 0.652 1.00 0.00 ATOM 576 N SER 75 -14.271 -12.437 0.473 1.00 0.00 ATOM 577 CA SER 75 -13.746 -13.496 1.327 1.00 0.00 ATOM 578 CB SER 75 -14.722 -14.671 1.388 1.00 0.00 ATOM 579 OG SER 75 -14.854 -15.291 0.121 1.00 0.00 ATOM 580 O SER 75 -11.606 -14.578 1.498 1.00 0.00 ATOM 581 C SER 75 -12.407 -13.997 0.774 1.00 0.00 ATOM 582 N ASP 76 -12.179 -13.743 -0.518 1.00 0.00 ATOM 583 CA ASP 76 -10.956 -14.175 -1.193 1.00 0.00 ATOM 584 CB ASP 76 -11.000 -14.539 -2.487 1.00 0.00 ATOM 585 CG ASP 76 -9.698 -14.707 -3.212 1.00 0.00 ATOM 586 OD1 ASP 76 -8.621 -14.389 -2.681 1.00 0.00 ATOM 587 OD2 ASP 76 -9.765 -15.185 -4.377 1.00 0.00 ATOM 588 O ASP 76 -9.436 -12.568 -0.279 1.00 0.00 ATOM 589 C ASP 76 -9.654 -13.749 -0.516 1.00 0.00 ATOM 590 N VAL 77 -8.782 -14.719 -0.261 1.00 0.00 ATOM 591 CA VAL 77 -7.483 -14.480 0.366 1.00 0.00 ATOM 592 CB VAL 77 -7.595 -14.577 1.925 1.00 0.00 ATOM 593 CG1 VAL 77 -8.023 -15.968 2.318 1.00 0.00 ATOM 594 CG2 VAL 77 -6.268 -14.204 2.602 1.00 0.00 ATOM 595 O VAL 77 -6.637 -16.597 -0.408 1.00 0.00 ATOM 596 C VAL 77 -6.444 -15.383 -0.295 1.00 0.00 ATOM 597 N GLU 78 -4.936 -15.194 -1.322 1.00 0.00 ATOM 598 CA GLU 78 -3.941 -15.832 -0.457 1.00 0.00 ATOM 599 CB GLU 78 -2.776 -16.372 -1.288 1.00 0.00 ATOM 600 CG GLU 78 -3.150 -17.524 -2.207 1.00 0.00 ATOM 601 CD GLU 78 -1.982 -17.996 -3.054 1.00 0.00 ATOM 602 OE1 GLU 78 -0.896 -17.391 -2.957 1.00 0.00 ATOM 603 OE2 GLU 78 -2.156 -18.976 -3.809 1.00 0.00 ATOM 604 O GLU 78 -2.430 -15.241 1.234 1.00 0.00 ATOM 605 C GLU 78 -3.379 -14.842 0.559 1.00 0.00 ATOM 606 N GLY 79 -3.397 -13.564 0.204 1.00 0.00 ATOM 607 CA GLY 79 -2.853 -12.514 1.071 1.00 0.00 ATOM 608 O GLY 79 -4.442 -11.154 0.012 1.00 0.00 ATOM 609 C GLY 79 -3.432 -11.148 0.714 1.00 0.00 ATOM 610 N PHE 80 -3.335 -10.209 1.639 1.00 0.00 ATOM 611 CA PHE 80 -3.870 -8.853 1.451 1.00 0.00 ATOM 612 CB PHE 80 -5.047 -8.606 2.399 1.00 0.00 ATOM 613 CG PHE 80 -6.142 -9.644 2.313 1.00 0.00 ATOM 614 CD1 PHE 80 -6.456 -10.263 1.107 1.00 0.00 ATOM 615 CD2 PHE 80 -6.878 -9.985 3.446 1.00 0.00 ATOM 616 CE1 PHE 80 -7.490 -11.201 1.029 1.00 0.00 ATOM 617 CE2 PHE 80 -7.913 -10.923 3.375 1.00 0.00 ATOM 618 CZ PHE 80 -8.217 -11.529 2.162 1.00 0.00 ATOM 619 O PHE 80 -2.029 -7.977 2.726 1.00 0.00 ATOM 620 C PHE 80 -2.774 -7.832 1.753 1.00 0.00 ATOM 621 N THR 81 -2.676 -6.793 0.927 1.00 0.00 ATOM 622 CA THR 81 -1.701 -5.730 1.162 1.00 0.00 ATOM 623 CB THR 81 -0.628 -5.733 -0.018 1.00 0.00 ATOM 624 CG2 THR 81 -0.132 -7.141 -0.348 1.00 0.00 ATOM 625 OG1 THR 81 -1.284 -5.182 -1.166 1.00 0.00 ATOM 626 O THR 81 -3.317 -3.971 0.948 1.00 0.00 ATOM 627 C THR 81 -2.552 -4.583 1.695 1.00 0.00 ATOM 628 N PHE 82 -2.457 -4.323 2.992 1.00 0.00 ATOM 629 CA PHE 82 -3.253 -3.292 3.648 1.00 0.00 ATOM 630 CB PHE 82 -3.791 -3.769 4.991 1.00 0.00 ATOM 631 CG PHE 82 -4.902 -4.771 4.879 1.00 0.00 ATOM 632 CD1 PHE 82 -5.649 -4.899 3.706 1.00 0.00 ATOM 633 CD2 PHE 82 -5.228 -5.568 5.974 1.00 0.00 ATOM 634 CE1 PHE 82 -6.706 -5.804 3.625 1.00 0.00 ATOM 635 CE2 PHE 82 -6.285 -6.482 5.908 1.00 0.00 ATOM 636 CZ PHE 82 -7.028 -6.599 4.726 1.00 0.00 ATOM 637 O PHE 82 -1.214 -2.347 4.448 1.00 0.00 ATOM 638 C PHE 82 -2.246 -2.159 3.806 1.00 0.00 ATOM 639 N GLU 83 -2.210 -0.127 3.055 1.00 0.00 ATOM 640 CA GLU 83 -1.823 0.681 4.211 1.00 0.00 ATOM 641 CB GLU 83 -0.534 1.451 3.920 1.00 0.00 ATOM 642 CG GLU 83 0.681 0.565 3.691 1.00 0.00 ATOM 643 CD GLU 83 0.766 0.046 2.269 1.00 0.00 ATOM 644 OE1 GLU 83 -0.122 0.392 1.459 1.00 0.00 ATOM 645 OE2 GLU 83 1.718 -0.700 1.964 1.00 0.00 ATOM 646 O GLU 83 -3.967 1.739 3.731 1.00 0.00 ATOM 647 C GLU 83 -2.976 1.665 4.483 1.00 0.00 ATOM 648 N LEU 84 -2.924 2.319 5.631 1.00 0.00 ATOM 649 CA LEU 84 -3.987 3.236 6.042 1.00 0.00 ATOM 650 CB LEU 84 -4.286 3.033 7.555 1.00 0.00 ATOM 651 CG LEU 84 -4.532 1.592 8.021 1.00 0.00 ATOM 652 CD1 LEU 84 -5.013 1.605 9.449 1.00 0.00 ATOM 653 CD2 LEU 84 -5.544 0.901 7.128 1.00 0.00 ATOM 654 O LEU 84 -5.018 5.299 5.260 1.00 0.00 ATOM 655 C LEU 84 -4.000 4.561 5.254 1.00 0.00 ATOM 656 N GLY 85 -2.881 4.888 4.598 1.00 0.00 ATOM 657 CA GLY 85 -2.813 6.128 3.836 1.00 0.00 ATOM 658 O GLY 85 -2.499 8.484 4.192 1.00 0.00 ATOM 659 C GLY 85 -2.225 7.323 4.580 1.00 0.00 ATOM 660 N LEU 86 -1.421 7.052 5.615 1.00 0.00 ATOM 661 CA LEU 86 -0.889 8.114 6.478 1.00 0.00 ATOM 662 CB LEU 86 -0.370 7.525 7.792 1.00 0.00 ATOM 663 CG LEU 86 0.109 8.532 8.842 1.00 0.00 ATOM 664 CD1 LEU 86 -1.036 9.419 9.299 1.00 0.00 ATOM 665 CD2 LEU 86 0.669 7.810 10.059 1.00 0.00 ATOM 666 O LEU 86 1.182 8.289 5.343 1.00 0.00 ATOM 667 C LEU 86 0.271 8.915 5.896 1.00 0.00 ATOM 668 N THR 87 0.169 10.199 6.121 1.00 0.00 ATOM 669 CA THR 87 1.220 11.131 5.697 1.00 0.00 ATOM 670 CB THR 87 0.634 12.341 4.950 1.00 0.00 ATOM 671 CG2 THR 87 -0.050 11.894 3.667 1.00 0.00 ATOM 672 OG1 THR 87 -0.326 13.002 5.782 1.00 0.00 ATOM 673 O THR 87 1.333 12.174 7.799 1.00 0.00 ATOM 674 C THR 87 1.998 11.663 6.898 1.00 0.00 ATOM 675 N GLU 88 3.085 10.976 7.248 1.00 0.00 ATOM 676 CA GLU 88 3.904 11.365 8.396 1.00 0.00 ATOM 677 CB GLU 88 4.039 9.983 9.246 1.00 0.00 ATOM 678 CG GLU 88 2.889 9.687 10.212 1.00 0.00 ATOM 679 CD GLU 88 2.956 10.522 11.492 1.00 0.00 ATOM 680 OE1 GLU 88 3.784 10.202 12.427 1.00 0.00 ATOM 681 OE2 GLU 88 2.183 11.545 11.635 1.00 0.00 ATOM 682 O GLU 88 5.673 12.852 8.810 1.00 0.00 ATOM 683 C GLU 88 4.676 12.651 8.114 1.00 0.00 ATOM 684 N ASP 89 4.716 13.043 6.843 1.00 0.00 ATOM 685 CA ASP 89 5.377 14.289 6.443 1.00 0.00 ATOM 686 CB ASP 89 6.184 14.475 5.462 1.00 0.00 ATOM 687 CG ASP 89 7.555 14.522 6.098 1.00 0.00 ATOM 688 OD1 ASP 89 7.634 14.592 7.342 1.00 0.00 ATOM 689 OD2 ASP 89 8.558 14.502 5.353 1.00 0.00 ATOM 690 O ASP 89 3.203 15.111 6.118 1.00 0.00 ATOM 691 C ASP 89 4.374 15.434 6.327 1.00 0.00 ATOM 692 N GLU 90 4.596 16.488 7.107 1.00 0.00 ATOM 693 CA GLU 90 3.667 17.622 7.154 1.00 0.00 ATOM 694 CB GLU 90 4.205 18.722 8.070 1.00 0.00 ATOM 695 CG GLU 90 3.283 19.922 8.211 1.00 0.00 ATOM 696 CD GLU 90 3.831 20.966 9.164 1.00 0.00 ATOM 697 OE1 GLU 90 4.930 20.751 9.715 1.00 0.00 ATOM 698 OE2 GLU 90 3.156 21.999 9.362 1.00 0.00 ATOM 699 O GLU 90 2.539 19.039 5.663 1.00 0.00 ATOM 700 C GLU 90 3.459 18.220 5.765 1.00 0.00 ATOM 701 N ASN 91 4.582 18.423 5.011 1.00 0.00 ATOM 702 CA ASN 91 4.411 18.981 3.675 1.00 0.00 ATOM 703 CB ASN 91 5.721 19.531 3.112 1.00 0.00 ATOM 704 CG ASN 91 6.049 20.883 3.760 1.00 0.00 ATOM 705 ND2 ASN 91 6.626 21.747 2.934 1.00 0.00 ATOM 706 OD1 ASN 91 5.786 21.172 4.937 1.00 0.00 ATOM 707 O ASN 91 3.023 18.362 1.799 1.00 0.00 ATOM 708 C ASN 91 3.783 17.992 2.711 1.00 0.00 ATOM 709 N VAL 92 4.052 16.691 2.877 1.00 0.00 ATOM 710 CA VAL 92 3.426 15.677 2.027 1.00 0.00 ATOM 711 CB VAL 92 3.995 14.284 2.276 1.00 0.00 ATOM 712 CG1 VAL 92 3.654 13.753 3.656 1.00 0.00 ATOM 713 CG2 VAL 92 3.442 13.315 1.230 1.00 0.00 ATOM 714 O VAL 92 1.177 15.581 1.223 1.00 0.00 ATOM 715 C VAL 92 1.908 15.726 2.195 1.00 0.00 ATOM 716 N PHE 93 1.410 15.901 3.416 1.00 0.00 ATOM 717 CA PHE 93 -0.035 15.987 3.608 1.00 0.00 ATOM 718 CB PHE 93 -0.206 16.176 5.180 1.00 0.00 ATOM 719 CG PHE 93 -1.643 16.183 5.693 1.00 0.00 ATOM 720 CD1 PHE 93 -2.270 14.993 5.977 1.00 0.00 ATOM 721 CD2 PHE 93 -2.258 17.400 5.892 1.00 0.00 ATOM 722 CE1 PHE 93 -3.592 15.047 6.473 1.00 0.00 ATOM 723 CE2 PHE 93 -3.584 17.444 6.348 1.00 0.00 ATOM 724 CZ PHE 93 -4.219 16.270 6.656 1.00 0.00 ATOM 725 O PHE 93 -1.886 16.760 2.346 1.00 0.00 ATOM 726 C PHE 93 -0.745 17.002 2.739 1.00 0.00 ATOM 727 N THR 94 -0.079 18.119 2.405 1.00 0.00 ATOM 728 CA THR 94 -0.734 19.147 1.582 1.00 0.00 ATOM 729 CB THR 94 0.095 20.445 1.539 1.00 0.00 ATOM 730 CG2 THR 94 0.279 21.008 2.939 1.00 0.00 ATOM 731 OG1 THR 94 1.386 20.172 0.978 1.00 0.00 ATOM 732 O THR 94 -1.651 19.386 -0.610 1.00 0.00 ATOM 733 C THR 94 -0.936 18.705 0.131 1.00 0.00 ATOM 734 N GLN 95 -0.327 17.578 -0.243 1.00 0.00 ATOM 735 CA GLN 95 -0.469 17.028 -1.597 1.00 0.00 ATOM 736 CB GLN 95 0.878 16.507 -2.106 1.00 0.00 ATOM 737 CG GLN 95 1.943 17.583 -2.250 1.00 0.00 ATOM 738 CD GLN 95 3.281 17.024 -2.692 1.00 0.00 ATOM 739 OE1 GLN 95 3.431 15.815 -2.874 1.00 0.00 ATOM 740 NE2 GLN 95 4.259 17.903 -2.869 1.00 0.00 ATOM 741 O GLN 95 -1.762 15.302 -2.694 1.00 0.00 ATOM 742 C GLN 95 -1.465 15.859 -1.624 1.00 0.00 ATOM 743 N ALA 96 -1.992 15.484 -0.459 1.00 0.00 ATOM 744 CA ALA 96 -2.917 14.360 -0.390 1.00 0.00 ATOM 745 CB ALA 96 -3.332 14.099 1.050 1.00 0.00 ATOM 746 O ALA 96 -4.652 13.783 -1.989 1.00 0.00 ATOM 747 C ALA 96 -4.190 14.641 -1.212 1.00 0.00 ATOM 748 N ASP 97 -4.743 15.861 -1.117 1.00 0.00 ATOM 749 CA ASP 97 -5.933 16.218 -1.886 1.00 0.00 ATOM 750 CB ASP 97 -6.345 17.662 -1.593 1.00 0.00 ATOM 751 CG ASP 97 -6.940 17.828 -0.208 1.00 0.00 ATOM 752 OD1 ASP 97 -7.448 18.929 0.092 1.00 0.00 ATOM 753 OD2 ASP 97 -6.895 16.858 0.578 1.00 0.00 ATOM 754 O ASP 97 -6.476 15.554 -4.122 1.00 0.00 ATOM 755 C ASP 97 -5.656 16.088 -3.383 1.00 0.00 ATOM 756 N SER 98 -4.503 16.583 -3.818 1.00 0.00 ATOM 757 CA SER 98 -4.112 16.525 -5.218 1.00 0.00 ATOM 758 CB SER 98 -2.778 17.238 -5.435 1.00 0.00 ATOM 759 OG SER 98 -2.894 18.628 -5.189 1.00 0.00 ATOM 760 O SER 98 -4.595 14.688 -6.684 1.00 0.00 ATOM 761 C SER 98 -3.956 15.093 -5.714 1.00 0.00 ATOM 762 N LEU 99 -3.097 14.337 -5.033 1.00 0.00 ATOM 763 CA LEU 99 -2.856 12.948 -5.412 1.00 0.00 ATOM 764 CB LEU 99 -1.653 12.393 -4.608 1.00 0.00 ATOM 765 CG LEU 99 -0.381 13.251 -4.747 1.00 0.00 ATOM 766 CD1 LEU 99 0.772 12.582 -4.009 1.00 0.00 ATOM 767 CD2 LEU 99 -0.021 13.441 -6.218 1.00 0.00 ATOM 768 O LEU 99 -4.342 11.202 -6.124 1.00 0.00 ATOM 769 C LEU 99 -4.105 12.065 -5.282 1.00 0.00 ATOM 770 N SER 100 -4.893 12.264 -4.236 1.00 0.00 ATOM 771 CA SER 100 -6.105 11.475 -4.029 1.00 0.00 ATOM 772 CB SER 100 -6.771 11.854 -2.703 1.00 0.00 ATOM 773 OG SER 100 -7.259 13.184 -2.739 1.00 0.00 ATOM 774 O SER 100 -8.089 10.862 -5.229 1.00 0.00 ATOM 775 C SER 100 -7.162 11.665 -5.120 1.00 0.00 ATOM 776 N ASP 101 -7.025 12.728 -5.920 1.00 0.00 ATOM 777 CA ASP 101 -7.982 12.982 -7.004 1.00 0.00 ATOM 778 CB ASP 101 -7.657 14.303 -7.705 1.00 0.00 ATOM 779 CG ASP 101 -8.766 14.754 -8.638 1.00 0.00 ATOM 780 OD1 ASP 101 -9.903 14.944 -8.159 1.00 0.00 ATOM 781 OD2 ASP 101 -8.495 14.916 -9.846 1.00 0.00 ATOM 782 O ASP 101 -8.948 11.584 -8.694 1.00 0.00 ATOM 783 C ASP 101 -7.942 11.865 -8.052 1.00 0.00 ATOM 784 N TRP 102 -6.747 11.277 -8.235 1.00 0.00 ATOM 785 CA TRP 102 -6.592 10.291 -9.284 1.00 0.00 ATOM 786 CB TRP 102 -5.072 10.137 -9.640 1.00 0.00 ATOM 787 CG TRP 102 -4.468 11.401 -10.177 1.00 0.00 ATOM 788 CD1 TRP 102 -4.349 12.601 -9.507 1.00 0.00 ATOM 789 CD2 TRP 102 -3.946 11.623 -11.480 1.00 0.00 ATOM 790 CE2 TRP 102 -3.511 12.979 -11.542 1.00 0.00 ATOM 791 CE3 TRP 102 -3.799 10.791 -12.599 1.00 0.00 ATOM 792 NE1 TRP 102 -3.763 13.557 -10.307 1.00 0.00 ATOM 793 CZ2 TRP 102 -2.923 13.538 -12.668 1.00 0.00 ATOM 794 CZ3 TRP 102 -3.213 11.361 -13.731 1.00 0.00 ATOM 795 CH2 TRP 102 -2.764 12.688 -13.759 1.00 0.00 ATOM 796 O TRP 102 -6.721 7.915 -9.667 1.00 0.00 ATOM 797 C TRP 102 -6.676 8.822 -8.841 1.00 0.00 ATOM 798 N ALA 103 -6.645 8.610 -7.537 1.00 0.00 ATOM 799 CA ALA 103 -6.709 7.276 -6.984 1.00 0.00 ATOM 800 CB ALA 103 -6.417 7.305 -5.491 1.00 0.00 ATOM 801 O ALA 103 -8.192 5.489 -7.549 1.00 0.00 ATOM 802 C ALA 103 -8.092 6.657 -7.184 1.00 0.00 ATOM 803 N ASN 104 -9.164 7.411 -6.959 1.00 0.00 ATOM 804 CA ASN 104 -10.505 6.889 -7.225 1.00 0.00 ATOM 805 CB ASN 104 -11.569 7.924 -6.855 1.00 0.00 ATOM 806 CG ASN 104 -11.743 8.071 -5.358 1.00 0.00 ATOM 807 ND2 ASN 104 -10.879 7.414 -4.593 1.00 0.00 ATOM 808 OD1 ASN 104 -12.646 8.767 -4.893 1.00 0.00 ATOM 809 O ASN 104 -11.235 5.519 -9.050 1.00 0.00 ATOM 810 C ASN 104 -10.655 6.543 -8.710 1.00 0.00 ATOM 811 N GLN 105 -10.171 7.405 -9.596 1.00 0.00 ATOM 812 CA GLN 105 -10.294 7.166 -11.020 1.00 0.00 ATOM 813 CB GLN 105 -9.769 8.365 -11.813 1.00 0.00 ATOM 814 CG GLN 105 -10.626 9.616 -11.685 1.00 0.00 ATOM 815 CD GLN 105 -10.039 10.802 -12.425 1.00 0.00 ATOM 816 OE1 GLN 105 -8.969 10.703 -13.027 1.00 0.00 ATOM 817 NE2 GLN 105 -10.742 11.927 -12.386 1.00 0.00 ATOM 818 O GLN 105 -9.970 5.115 -12.230 1.00 0.00 ATOM 819 C GLN 105 -9.492 5.932 -11.432 1.00 0.00 ATOM 820 N PHE 106 -8.309 5.750 -10.877 1.00 0.00 ATOM 821 CA PHE 106 -7.489 4.579 -11.172 1.00 0.00 ATOM 822 CB PHE 106 -6.180 4.628 -10.381 1.00 0.00 ATOM 823 CG PHE 106 -5.187 5.620 -10.915 1.00 0.00 ATOM 824 CD1 PHE 106 -5.066 6.875 -10.346 1.00 0.00 ATOM 825 CD2 PHE 106 -4.370 5.295 -11.984 1.00 0.00 ATOM 826 CE1 PHE 106 -4.152 7.787 -10.837 1.00 0.00 ATOM 827 CE2 PHE 106 -3.457 6.209 -12.475 1.00 0.00 ATOM 828 CZ PHE 106 -3.345 7.448 -11.907 1.00 0.00 ATOM 829 O PHE 106 -8.311 2.350 -11.584 1.00 0.00 ATOM 830 C PHE 106 -8.235 3.293 -10.796 1.00 0.00 ATOM 831 N LEU 107 -8.833 3.306 -9.614 1.00 0.00 ATOM 832 CA LEU 107 -9.579 2.148 -9.139 1.00 0.00 ATOM 833 CB LEU 107 -10.181 2.428 -7.759 1.00 0.00 ATOM 834 CG LEU 107 -10.976 1.286 -7.122 1.00 0.00 ATOM 835 CD1 LEU 107 -10.080 0.087 -6.862 1.00 0.00 ATOM 836 CD2 LEU 107 -11.582 1.727 -5.797 1.00 0.00 ATOM 837 O LEU 107 -10.893 0.656 -10.528 1.00 0.00 ATOM 838 C LEU 107 -10.719 1.802 -10.099 1.00 0.00 ATOM 839 N LEU 108 -11.543 2.809 -10.444 1.00 0.00 ATOM 840 CA LEU 108 -12.704 2.567 -11.299 1.00 0.00 ATOM 841 CB LEU 108 -13.565 3.826 -11.402 1.00 0.00 ATOM 842 CG LEU 108 -14.327 4.233 -10.139 1.00 0.00 ATOM 843 CD1 LEU 108 -15.037 5.562 -10.341 1.00 0.00 ATOM 844 CD2 LEU 108 -15.372 3.185 -9.781 1.00 0.00 ATOM 845 O LEU 108 -12.784 1.264 -13.332 1.00 0.00 ATOM 846 C LEU 108 -12.227 2.175 -12.692 1.00 0.00 ATOM 847 N GLY 109 -11.143 2.779 -13.144 1.00 0.00 ATOM 848 CA GLY 109 -10.624 2.369 -14.483 1.00 0.00 ATOM 849 O GLY 109 -8.914 1.311 -13.149 1.00 0.00 ATOM 850 C GLY 109 -9.443 1.414 -14.270 1.00 0.00 ATOM 851 N ILE 110 -8.963 0.849 -15.399 1.00 0.00 ATOM 852 CA ILE 110 -7.716 0.071 -15.356 1.00 0.00 ATOM 853 CB ILE 110 -8.126 -1.485 -15.519 1.00 0.00 ATOM 854 CG1 ILE 110 -9.232 -1.811 -14.504 1.00 0.00 ATOM 855 CG2 ILE 110 -6.905 -2.397 -15.392 1.00 0.00 ATOM 856 CD1 ILE 110 -9.816 -3.217 -14.632 1.00 0.00 ATOM 857 O ILE 110 -5.414 0.339 -16.162 1.00 0.00 ATOM 858 C ILE 110 -6.581 0.783 -16.091 1.00 0.00 ATOM 859 N GLY 111 -6.860 1.980 -16.615 1.00 0.00 ATOM 860 CA GLY 111 -5.862 2.830 -17.243 1.00 0.00 ATOM 861 O GLY 111 -7.631 4.442 -17.273 1.00 0.00 ATOM 862 C GLY 111 -6.425 4.253 -17.425 1.00 0.00 ATOM 863 N LEU 112 -5.540 5.150 -17.758 1.00 0.00 ATOM 864 CA LEU 112 -5.875 6.551 -18.046 1.00 0.00 ATOM 865 CB LEU 112 -6.178 7.256 -16.729 1.00 0.00 ATOM 866 CG LEU 112 -7.437 6.763 -16.008 1.00 0.00 ATOM 867 CD1 LEU 112 -7.519 7.324 -14.564 1.00 0.00 ATOM 868 CD2 LEU 112 -8.706 7.106 -16.771 1.00 0.00 ATOM 869 O LEU 112 -3.527 6.978 -18.537 1.00 0.00 ATOM 870 C LEU 112 -4.720 7.140 -18.834 1.00 0.00 ATOM 871 N ALA 113 -5.074 7.991 -19.795 1.00 0.00 ATOM 872 CA ALA 113 -4.093 8.691 -20.614 1.00 0.00 ATOM 873 CB ALA 113 -4.798 9.427 -21.755 1.00 0.00 ATOM 874 O ALA 113 -2.061 9.726 -19.869 1.00 0.00 ATOM 875 C ALA 113 -3.285 9.673 -19.770 1.00 0.00 ATOM 876 N GLN 114 -3.979 10.447 -18.947 1.00 0.00 ATOM 877 CA GLN 114 -3.325 11.418 -18.083 1.00 0.00 ATOM 878 CB GLN 114 -4.549 11.744 -16.919 1.00 0.00 ATOM 879 CG GLN 114 -6.013 11.740 -17.325 1.00 0.00 ATOM 880 CD GLN 114 -6.409 13.030 -17.980 1.00 0.00 ATOM 881 OE1 GLN 114 -6.775 13.997 -17.301 1.00 0.00 ATOM 882 NE2 GLN 114 -6.354 13.068 -19.305 1.00 0.00 ATOM 883 O GLN 114 -1.209 11.135 -16.981 1.00 0.00 ATOM 884 C GLN 114 -2.357 10.714 -17.133 1.00 0.00 ATOM 885 N PRO 115 -2.795 9.644 -16.505 1.00 0.00 ATOM 886 CA PRO 115 -1.980 8.866 -15.548 1.00 0.00 ATOM 887 CB PRO 115 -2.908 7.701 -15.186 1.00 0.00 ATOM 888 CG PRO 115 -4.290 8.232 -15.335 1.00 0.00 ATOM 889 CD PRO 115 -4.218 9.179 -16.546 1.00 0.00 ATOM 890 O PRO 115 0.281 8.143 -15.461 1.00 0.00 ATOM 891 C PRO 115 -0.697 8.326 -16.201 1.00 0.00 ATOM 892 N GLU 116 -0.688 8.125 -17.517 1.00 0.00 ATOM 893 CA GLU 116 0.558 7.666 -18.163 1.00 0.00 ATOM 894 CB GLU 116 0.231 7.001 -19.500 1.00 0.00 ATOM 895 CG GLU 116 -0.585 5.716 -19.312 1.00 0.00 ATOM 896 CD GLU 116 0.097 4.684 -18.432 1.00 0.00 ATOM 897 OE1 GLU 116 1.227 4.235 -18.736 1.00 0.00 ATOM 898 OE2 GLU 116 -0.473 4.338 -17.369 1.00 0.00 ATOM 899 O GLU 116 2.840 8.298 -18.247 1.00 0.00 ATOM 900 C GLU 116 1.655 8.700 -18.297 1.00 0.00 ATOM 901 N LEU 117 1.350 9.958 -18.527 1.00 0.00 ATOM 902 CA LEU 117 2.380 10.982 -18.674 1.00 0.00 ATOM 903 CB LEU 117 1.682 12.402 -18.670 1.00 0.00 ATOM 904 CG LEU 117 0.708 12.717 -19.822 1.00 0.00 ATOM 905 CD1 LEU 117 0.407 14.204 -19.972 1.00 0.00 ATOM 906 CD2 LEU 117 1.381 12.148 -21.063 1.00 0.00 ATOM 907 O LEU 117 4.589 11.079 -17.627 1.00 0.00 ATOM 908 C LEU 117 3.364 10.990 -17.493 1.00 0.00 ATOM 909 N ALA 118 2.812 10.947 -16.293 1.00 0.00 ATOM 910 CA ALA 118 3.626 11.011 -15.098 1.00 0.00 ATOM 911 CB ALA 118 2.710 11.165 -13.890 1.00 0.00 ATOM 912 O ALA 118 5.674 9.936 -14.586 1.00 0.00 ATOM 913 C ALA 118 4.513 9.776 -14.958 1.00 0.00 ATOM 914 N LYS 119 4.057 8.553 -15.272 1.00 0.00 ATOM 915 CA LYS 119 4.945 7.412 -15.271 1.00 0.00 ATOM 916 CB LYS 119 4.316 6.063 -15.601 1.00 0.00 ATOM 917 CG LYS 119 3.665 5.460 -14.348 1.00 0.00 ATOM 918 CD LYS 119 2.624 4.424 -14.686 1.00 0.00 ATOM 919 CE LYS 119 3.237 3.120 -15.148 1.00 0.00 ATOM 920 NZ LYS 119 2.383 2.015 -14.588 1.00 0.00 ATOM 921 O LYS 119 7.147 7.251 -16.224 1.00 0.00 ATOM 922 C LYS 119 5.960 7.521 -16.391 1.00 0.00 ATOM 923 N GLU 120 5.587 7.929 -17.590 1.00 0.00 ATOM 924 CA GLU 120 6.565 8.049 -18.655 1.00 0.00 ATOM 925 CB GLU 120 5.865 8.253 -19.994 1.00 0.00 ATOM 926 CG GLU 120 5.143 7.009 -20.466 1.00 0.00 ATOM 927 CD GLU 120 6.079 5.795 -20.540 1.00 0.00 ATOM 928 OE1 GLU 120 7.294 5.975 -20.788 1.00 0.00 ATOM 929 OE2 GLU 120 5.605 4.654 -20.352 1.00 0.00 ATOM 930 O GLU 120 8.624 9.215 -18.932 1.00 0.00 ATOM 931 C GLU 120 7.539 9.198 -18.378 1.00 0.00 ATOM 932 N LYS 121 7.172 10.172 -17.558 1.00 0.00 ATOM 933 CA LYS 121 8.013 11.300 -17.195 1.00 0.00 ATOM 934 CB LYS 121 7.157 12.495 -16.785 1.00 0.00 ATOM 935 CG LYS 121 6.420 13.333 -17.742 1.00 0.00 ATOM 936 CD LYS 121 6.209 12.926 -19.136 1.00 0.00 ATOM 937 CE LYS 121 5.176 13.718 -19.913 1.00 0.00 ATOM 938 NZ LYS 121 4.411 12.710 -20.732 1.00 0.00 ATOM 939 O LYS 121 9.677 11.999 -15.623 1.00 0.00 ATOM 940 C LYS 121 8.970 11.058 -16.043 1.00 0.00 ATOM 941 N GLY 122 8.985 9.843 -15.499 1.00 0.00 ATOM 942 CA GLY 122 9.867 9.541 -14.392 1.00 0.00 ATOM 943 O GLY 122 10.032 9.582 -12.027 1.00 0.00 ATOM 944 C GLY 122 9.285 9.464 -13.000 1.00 0.00 ATOM 945 N GLU 123 7.973 9.337 -12.861 1.00 0.00 ATOM 946 CA GLU 123 7.358 9.228 -11.552 1.00 0.00 ATOM 947 CB GLU 123 5.957 8.497 -11.930 1.00 0.00 ATOM 948 CG GLU 123 4.666 8.896 -11.277 1.00 0.00 ATOM 949 CD GLU 123 3.571 7.879 -11.495 1.00 0.00 ATOM 950 OE1 GLU 123 3.426 7.416 -12.626 1.00 0.00 ATOM 951 OE2 GLU 123 2.881 7.548 -10.524 1.00 0.00 ATOM 952 O GLU 123 8.190 8.105 -9.599 1.00 0.00 ATOM 953 C GLU 123 7.836 8.016 -10.777 1.00 0.00 ATOM 954 N ILE 124 7.819 6.859 -11.438 1.00 0.00 ATOM 955 CA ILE 124 8.271 5.628 -10.780 1.00 0.00 ATOM 956 CB ILE 124 7.844 4.410 -11.635 1.00 0.00 ATOM 957 CG1 ILE 124 6.317 4.285 -11.590 1.00 0.00 ATOM 958 CG2 ILE 124 8.528 3.150 -11.134 1.00 0.00 ATOM 959 CD1 ILE 124 5.725 3.108 -12.358 1.00 0.00 ATOM 960 O ILE 124 10.258 5.343 -9.416 1.00 0.00 ATOM 961 C ILE 124 9.771 5.673 -10.505 1.00 0.00 ATOM 962 N GLY 125 10.548 6.060 -11.527 1.00 0.00 ATOM 963 CA GLY 125 11.997 6.149 -11.335 1.00 0.00 ATOM 964 O GLY 125 13.252 7.015 -9.494 1.00 0.00 ATOM 965 C GLY 125 12.313 7.206 -10.278 1.00 0.00 ATOM 966 N GLU 126 11.571 8.304 -10.227 1.00 0.00 ATOM 967 CA GLU 126 11.806 9.309 -9.183 1.00 0.00 ATOM 968 CB GLU 126 10.963 10.566 -9.372 1.00 0.00 ATOM 969 CG GLU 126 11.389 11.294 -10.648 1.00 0.00 ATOM 970 CD GLU 126 10.403 12.215 -11.320 1.00 0.00 ATOM 971 OE1 GLU 126 10.843 13.302 -11.779 1.00 0.00 ATOM 972 OE2 GLU 126 9.191 11.918 -11.442 1.00 0.00 ATOM 973 O GLU 126 12.234 9.098 -6.824 1.00 0.00 ATOM 974 C GLU 126 11.551 8.713 -7.787 1.00 0.00 ATOM 975 N ALA 127 10.602 7.811 -7.694 1.00 0.00 ATOM 976 CA ALA 127 10.267 7.182 -6.408 1.00 0.00 ATOM 977 CB ALA 127 8.914 6.517 -6.482 1.00 0.00 ATOM 978 O ALA 127 11.759 6.186 -4.864 1.00 0.00 ATOM 979 C ALA 127 11.366 6.191 -6.022 1.00 0.00 ATOM 980 N VAL 128 11.914 5.424 -6.956 1.00 0.00 ATOM 981 CA VAL 128 13.019 4.525 -6.642 1.00 0.00 ATOM 982 CB VAL 128 13.315 3.585 -7.836 1.00 0.00 ATOM 983 CG1 VAL 128 14.620 2.858 -7.638 1.00 0.00 ATOM 984 CG2 VAL 128 12.160 2.611 -7.975 1.00 0.00 ATOM 985 O VAL 128 14.885 5.025 -5.223 1.00 0.00 ATOM 986 C VAL 128 14.239 5.316 -6.232 1.00 0.00 ATOM 987 N ASP 129 14.604 6.325 -7.043 1.00 0.00 ATOM 988 CA ASP 129 15.751 7.151 -6.662 1.00 0.00 ATOM 989 CB ASP 129 15.907 8.271 -7.688 1.00 0.00 ATOM 990 CG ASP 129 16.329 7.855 -9.061 1.00 0.00 ATOM 991 OD1 ASP 129 16.852 6.732 -9.225 1.00 0.00 ATOM 992 OD2 ASP 129 16.154 8.641 -10.018 1.00 0.00 ATOM 993 O ASP 129 16.580 7.870 -4.492 1.00 0.00 ATOM 994 C ASP 129 15.640 7.776 -5.276 1.00 0.00 ATOM 995 N ASP 130 14.460 8.280 -4.972 1.00 0.00 ATOM 996 CA ASP 130 14.283 8.970 -3.678 1.00 0.00 ATOM 997 CB ASP 130 12.932 9.677 -3.651 1.00 0.00 ATOM 998 CG ASP 130 12.853 10.948 -4.468 1.00 0.00 ATOM 999 OD1 ASP 130 13.903 11.432 -4.942 1.00 0.00 ATOM 1000 OD2 ASP 130 11.729 11.508 -4.634 1.00 0.00 ATOM 1001 O ASP 130 15.039 8.324 -1.496 1.00 0.00 ATOM 1002 C ASP 130 14.434 8.006 -2.516 1.00 0.00 ATOM 1003 N LEU 131 13.849 6.813 -2.637 1.00 0.00 ATOM 1004 CA LEU 131 13.994 5.830 -1.576 1.00 0.00 ATOM 1005 CB LEU 131 13.143 4.585 -1.848 1.00 0.00 ATOM 1006 CG LEU 131 13.180 3.556 -0.706 1.00 0.00 ATOM 1007 CD1 LEU 131 12.696 4.196 0.596 1.00 0.00 ATOM 1008 CD2 LEU 131 12.317 2.350 -1.062 1.00 0.00 ATOM 1009 O LEU 131 15.946 5.397 -0.257 1.00 0.00 ATOM 1010 C LEU 131 15.454 5.425 -1.387 1.00 0.00 ATOM 1011 N GLN 132 16.163 5.112 -2.461 1.00 0.00 ATOM 1012 CA GLN 132 17.559 4.720 -2.349 1.00 0.00 ATOM 1013 CB GLN 132 18.049 4.071 -3.637 1.00 0.00 ATOM 1014 CG GLN 132 17.353 2.723 -3.882 1.00 0.00 ATOM 1015 CD GLN 132 17.628 2.146 -5.252 1.00 0.00 ATOM 1016 OE1 GLN 132 17.849 2.800 -6.276 1.00 0.00 ATOM 1017 NE2 GLN 132 17.616 0.801 -5.370 1.00 0.00 ATOM 1018 O GLN 132 19.342 5.812 -1.199 1.00 0.00 ATOM 1019 C GLN 132 18.399 5.944 -1.968 1.00 0.00 ATOM 1020 N ASP 133 18.021 7.559 -2.507 1.00 0.00 ATOM 1021 CA ASP 133 18.521 8.796 -1.933 1.00 0.00 ATOM 1022 CB ASP 133 17.827 10.003 -2.571 1.00 0.00 ATOM 1023 CG ASP 133 18.266 10.238 -4.002 1.00 0.00 ATOM 1024 OD1 ASP 133 17.915 11.295 -4.566 1.00 0.00 ATOM 1025 OD2 ASP 133 18.963 9.366 -4.560 1.00 0.00 ATOM 1026 O ASP 133 19.118 9.158 0.368 1.00 0.00 ATOM 1027 C ASP 133 18.249 8.799 -0.429 1.00 0.00 ATOM 1028 N ILE 134 17.054 8.377 -0.031 1.00 0.00 ATOM 1029 CA ILE 134 16.653 8.307 1.369 1.00 0.00 ATOM 1030 CB ILE 134 15.200 7.777 1.464 1.00 0.00 ATOM 1031 CG1 ILE 134 14.216 8.856 1.014 1.00 0.00 ATOM 1032 CG2 ILE 134 14.881 7.262 2.872 1.00 0.00 ATOM 1033 CD1 ILE 134 12.828 8.337 0.751 1.00 0.00 ATOM 1034 O ILE 134 18.021 7.614 3.211 1.00 0.00 ATOM 1035 C ILE 134 17.599 7.355 2.093 1.00 0.00 ATOM 1036 N CYS 135 17.929 6.250 1.447 1.00 0.00 ATOM 1037 CA CYS 135 18.837 5.261 2.020 1.00 0.00 ATOM 1038 CB CYS 135 18.890 3.996 1.133 1.00 0.00 ATOM 1039 SG CYS 135 17.344 3.046 1.033 1.00 0.00 ATOM 1040 O CYS 135 20.858 5.582 3.300 1.00 0.00 ATOM 1041 C CYS 135 20.251 5.825 2.246 1.00 0.00 ATOM 1042 N GLN 136 20.738 6.493 0.659 1.00 0.00 ATOM 1043 CA GLN 136 21.783 7.498 0.880 1.00 0.00 ATOM 1044 CB GLN 136 21.755 8.551 -0.231 1.00 0.00 ATOM 1045 CG GLN 136 22.858 9.595 -0.124 1.00 0.00 ATOM 1046 CD GLN 136 22.839 10.580 -1.274 1.00 0.00 ATOM 1047 OE1 GLN 136 21.985 10.501 -2.159 1.00 0.00 ATOM 1048 NE2 GLN 136 23.780 11.515 -1.267 1.00 0.00 ATOM 1049 O GLN 136 22.531 8.427 2.955 1.00 0.00 ATOM 1050 C GLN 136 21.573 8.197 2.212 1.00 0.00 ATOM 1051 N LEU 137 20.320 8.552 2.498 1.00 0.00 ATOM 1052 CA LEU 137 19.967 9.256 3.727 1.00 0.00 ATOM 1053 CB LEU 137 18.302 8.957 3.877 1.00 0.00 ATOM 1054 CG LEU 137 17.336 9.864 4.646 1.00 0.00 ATOM 1055 CD1 LEU 137 16.994 11.073 3.797 1.00 0.00 ATOM 1056 CD2 LEU 137 16.065 9.094 5.006 1.00 0.00 ATOM 1057 O LEU 137 20.721 9.042 5.970 1.00 0.00 ATOM 1058 C LEU 137 20.220 8.485 4.998 1.00 0.00 ATOM 1059 N GLY 138 19.871 7.224 5.029 1.00 0.00 ATOM 1060 CA GLY 138 20.067 6.414 6.221 1.00 0.00 ATOM 1061 O GLY 138 19.503 7.045 8.447 1.00 0.00 ATOM 1062 C GLY 138 19.128 6.960 7.289 1.00 0.00 ATOM 1063 N TYR 139 17.908 7.361 6.860 1.00 0.00 ATOM 1064 CA TYR 139 16.976 7.967 7.820 1.00 0.00 ATOM 1065 CB TYR 139 15.656 8.430 7.115 1.00 0.00 ATOM 1066 CG TYR 139 15.071 7.304 6.252 1.00 0.00 ATOM 1067 CD1 TYR 139 14.207 6.371 6.783 1.00 0.00 ATOM 1068 CD2 TYR 139 15.393 7.177 4.893 1.00 0.00 ATOM 1069 CE1 TYR 139 13.712 5.375 5.969 1.00 0.00 ATOM 1070 CE2 TYR 139 14.902 6.126 4.123 1.00 0.00 ATOM 1071 CZ TYR 139 14.035 5.214 4.663 1.00 0.00 ATOM 1072 OH TYR 139 13.542 4.160 3.947 1.00 0.00 ATOM 1073 O TYR 139 16.814 5.763 8.611 1.00 0.00 ATOM 1074 C TYR 139 16.437 6.922 8.793 1.00 0.00 ATOM 1075 N ASP 140 16.253 7.327 10.047 1.00 0.00 ATOM 1076 CA ASP 140 15.751 6.421 11.082 1.00 0.00 ATOM 1077 CB ASP 140 15.826 7.087 12.457 1.00 0.00 ATOM 1078 CG ASP 140 17.250 7.244 12.953 1.00 0.00 ATOM 1079 OD1 ASP 140 17.435 7.674 14.111 1.00 0.00 ATOM 1080 OD2 ASP 140 18.184 6.938 12.182 1.00 0.00 ATOM 1081 O ASP 140 13.690 6.733 10.013 1.00 0.00 ATOM 1082 C ASP 140 14.296 6.034 10.821 1.00 0.00 ATOM 1083 N GLU 141 14.025 4.728 10.849 1.00 0.00 ATOM 1084 CA GLU 141 12.661 4.236 10.676 1.00 0.00 ATOM 1085 CB GLU 141 12.628 2.710 10.761 1.00 0.00 ATOM 1086 CG GLU 141 13.278 2.007 9.581 1.00 0.00 ATOM 1087 CD GLU 141 13.276 0.498 9.727 1.00 0.00 ATOM 1088 OE1 GLU 141 12.809 0.002 10.774 1.00 0.00 ATOM 1089 OE2 GLU 141 13.739 -0.190 8.790 1.00 0.00 ATOM 1090 O GLU 141 10.588 5.221 11.518 1.00 0.00 ATOM 1091 C GLU 141 11.703 4.756 11.719 1.00 0.00 ATOM 1092 N ASP 142 12.180 4.713 12.965 1.00 0.00 ATOM 1093 CA ASP 142 11.416 5.150 14.110 1.00 0.00 ATOM 1094 CB ASP 142 12.132 4.806 15.421 1.00 0.00 ATOM 1095 CG ASP 142 12.116 3.336 15.740 1.00 0.00 ATOM 1096 OD1 ASP 142 11.249 2.566 15.286 1.00 0.00 ATOM 1097 OD2 ASP 142 13.035 2.901 16.475 1.00 0.00 ATOM 1098 O ASP 142 10.084 7.173 14.315 1.00 0.00 ATOM 1099 C ASP 142 11.210 6.682 14.034 1.00 0.00 ATOM 1100 N ASP 143 12.181 7.490 13.664 1.00 0.00 ATOM 1101 CA ASP 143 12.070 8.913 13.541 1.00 0.00 ATOM 1102 CB ASP 143 13.455 9.548 13.397 1.00 0.00 ATOM 1103 CG ASP 143 14.252 9.503 14.686 1.00 0.00 ATOM 1104 OD1 ASP 143 15.341 10.112 14.731 1.00 0.00 ATOM 1105 OD2 ASP 143 13.786 8.861 15.650 1.00 0.00 ATOM 1106 O ASP 143 10.833 10.446 12.240 1.00 0.00 ATOM 1107 C ASP 143 11.248 9.318 12.318 1.00 0.00 ATOM 1108 N ASN 144 11.486 8.624 11.131 1.00 0.00 ATOM 1109 CA ASN 144 10.678 9.053 9.998 1.00 0.00 ATOM 1110 CB ASN 144 11.462 10.037 9.123 1.00 0.00 ATOM 1111 CG ASN 144 10.625 10.606 7.995 1.00 0.00 ATOM 1112 ND2 ASN 144 10.289 11.889 8.099 1.00 0.00 ATOM 1113 OD1 ASN 144 10.284 9.903 7.045 1.00 0.00 ATOM 1114 O ASN 144 11.078 7.362 8.345 1.00 0.00 ATOM 1115 C ASN 144 10.284 7.852 9.146 1.00 0.00 ATOM 1116 N GLU 145 9.049 7.385 9.341 1.00 0.00 ATOM 1117 CA GLU 145 8.539 6.222 8.587 1.00 0.00 ATOM 1118 CB GLU 145 7.521 5.635 9.945 1.00 0.00 ATOM 1119 CG GLU 145 7.952 5.904 11.382 1.00 0.00 ATOM 1120 CD GLU 145 7.894 7.348 11.798 1.00 0.00 ATOM 1121 OE1 GLU 145 7.149 8.127 11.241 1.00 0.00 ATOM 1122 OE2 GLU 145 8.635 7.757 12.663 1.00 0.00 ATOM 1123 O GLU 145 7.668 5.815 6.432 1.00 0.00 ATOM 1124 C GLU 145 7.858 6.666 7.295 1.00 0.00 ATOM 1125 N GLU 146 8.757 9.541 5.758 1.00 0.00 ATOM 1126 CA GLU 146 7.317 9.685 5.665 1.00 0.00 ATOM 1127 CB GLU 146 6.755 10.424 6.875 1.00 0.00 ATOM 1128 CG GLU 146 7.016 9.648 8.151 1.00 0.00 ATOM 1129 CD GLU 146 7.206 10.523 9.315 1.00 0.00 ATOM 1130 OE1 GLU 146 7.002 11.742 9.205 1.00 0.00 ATOM 1131 OE2 GLU 146 7.580 9.973 10.353 1.00 0.00 ATOM 1132 O GLU 146 5.990 9.877 3.666 1.00 0.00 ATOM 1133 C GLU 146 6.890 10.354 4.345 1.00 0.00 ATOM 1134 N GLU 147 7.562 11.433 3.969 1.00 0.00 ATOM 1135 CA GLU 147 7.213 12.138 2.734 1.00 0.00 ATOM 1136 CB GLU 147 7.902 13.502 2.683 1.00 0.00 ATOM 1137 CG GLU 147 7.532 14.338 1.468 1.00 0.00 ATOM 1138 CD GLU 147 8.195 15.704 1.476 1.00 0.00 ATOM 1139 OE1 GLU 147 8.943 15.992 2.433 1.00 0.00 ATOM 1140 OE2 GLU 147 7.964 16.481 0.529 1.00 0.00 ATOM 1141 O GLU 147 6.933 11.205 0.525 1.00 0.00 ATOM 1142 C GLU 147 7.660 11.311 1.517 1.00 0.00 ATOM 1143 N LEU 148 8.857 10.739 1.620 1.00 0.00 ATOM 1144 CA LEU 148 9.432 9.951 0.526 1.00 0.00 ATOM 1145 CB LEU 148 10.994 10.069 0.756 1.00 0.00 ATOM 1146 CG LEU 148 11.632 11.458 0.610 1.00 0.00 ATOM 1147 CD1 LEU 148 13.072 11.448 1.070 1.00 0.00 ATOM 1148 CD2 LEU 148 11.540 11.943 -0.833 1.00 0.00 ATOM 1149 O LEU 148 8.926 8.025 -0.714 1.00 0.00 ATOM 1150 C LEU 148 8.638 8.666 0.300 1.00 0.00 ATOM 1151 N ALA 149 8.291 7.990 1.384 1.00 0.00 ATOM 1152 CA ALA 149 7.513 6.750 1.306 1.00 0.00 ATOM 1153 CB ALA 149 7.359 6.133 2.688 1.00 0.00 ATOM 1154 O ALA 149 5.347 6.054 0.739 1.00 0.00 ATOM 1155 C ALA 149 6.118 7.014 0.744 1.00 0.00 ATOM 1156 N GLU 150 5.607 8.217 0.981 1.00 0.00 ATOM 1157 CA GLU 150 4.288 8.608 0.474 1.00 0.00 ATOM 1158 CB GLU 150 3.960 10.045 0.886 1.00 0.00 ATOM 1159 CG GLU 150 2.589 10.523 0.437 1.00 0.00 ATOM 1160 CD GLU 150 1.459 9.807 1.151 1.00 0.00 ATOM 1161 OE1 GLU 150 1.741 9.088 2.134 1.00 0.00 ATOM 1162 OE2 GLU 150 0.296 9.964 0.727 1.00 0.00 ATOM 1163 O GLU 150 3.133 8.693 -1.563 1.00 0.00 ATOM 1164 C GLU 150 4.237 8.528 -1.051 1.00 0.00 ATOM 1165 N ALA 151 5.334 9.080 -1.684 1.00 0.00 ATOM 1166 CA ALA 151 5.554 8.934 -3.123 1.00 0.00 ATOM 1167 CB ALA 151 6.721 9.803 -3.570 1.00 0.00 ATOM 1168 O ALA 151 5.360 6.985 -4.496 1.00 0.00 ATOM 1169 C ALA 151 5.872 7.490 -3.494 1.00 0.00 ATOM 1170 N LEU 152 6.705 6.821 -2.697 1.00 0.00 ATOM 1171 CA LEU 152 7.010 5.415 -2.971 1.00 0.00 ATOM 1172 CB LEU 152 7.741 4.737 -1.919 1.00 0.00 ATOM 1173 CG LEU 152 9.264 4.776 -2.076 1.00 0.00 ATOM 1174 CD1 LEU 152 9.727 6.041 -2.769 1.00 0.00 ATOM 1175 CD2 LEU 152 9.919 4.627 -0.714 1.00 0.00 ATOM 1176 O LEU 152 5.509 3.725 -3.778 1.00 0.00 ATOM 1177 C LEU 152 5.745 4.562 -2.902 1.00 0.00 ATOM 1178 N GLU 153 4.936 4.775 -1.846 1.00 0.00 ATOM 1179 CA GLU 153 3.731 3.970 -1.698 1.00 0.00 ATOM 1180 CB GLU 153 2.835 4.832 -0.536 1.00 0.00 ATOM 1181 CG GLU 153 2.169 4.142 0.644 1.00 0.00 ATOM 1182 CD GLU 153 1.590 5.124 1.651 1.00 0.00 ATOM 1183 OE1 GLU 153 2.277 6.113 1.988 1.00 0.00 ATOM 1184 OE2 GLU 153 0.455 4.897 2.118 1.00 0.00 ATOM 1185 O GLU 153 2.125 3.271 -3.342 1.00 0.00 ATOM 1186 C GLU 153 2.777 4.183 -2.849 1.00 0.00 ATOM 1187 N GLU 154 2.705 5.445 -3.275 1.00 0.00 ATOM 1188 CA GLU 154 1.642 5.717 -4.250 1.00 0.00 ATOM 1189 CB GLU 154 1.185 7.180 -4.146 1.00 0.00 ATOM 1190 CG GLU 154 0.326 7.473 -2.901 1.00 0.00 ATOM 1191 CD GLU 154 -0.040 8.974 -2.950 1.00 0.00 ATOM 1192 OE1 GLU 154 0.860 9.776 -2.734 1.00 0.00 ATOM 1193 OE2 GLU 154 -1.177 9.339 -3.412 1.00 0.00 ATOM 1194 O GLU 154 1.316 4.920 -6.533 1.00 0.00 ATOM 1195 C GLU 154 2.074 5.261 -5.628 1.00 0.00 ATOM 1196 N ILE 155 3.372 5.222 -5.833 1.00 0.00 ATOM 1197 CA ILE 155 3.875 4.688 -7.091 1.00 0.00 ATOM 1198 CB ILE 155 5.389 4.914 -7.230 1.00 0.00 ATOM 1199 CG1 ILE 155 5.667 6.399 -7.416 1.00 0.00 ATOM 1200 CG2 ILE 155 5.960 4.094 -8.377 1.00 0.00 ATOM 1201 CD1 ILE 155 7.140 6.734 -7.510 1.00 0.00 ATOM 1202 O ILE 155 3.099 2.711 -8.178 1.00 0.00 ATOM 1203 C ILE 155 3.567 3.198 -7.146 1.00 0.00 ATOM 1204 N ILE 156 3.503 2.403 -5.950 1.00 0.00 ATOM 1205 CA ILE 156 3.126 0.987 -5.789 1.00 0.00 ATOM 1206 CB ILE 156 3.611 0.426 -4.439 1.00 0.00 ATOM 1207 CG1 ILE 156 3.524 -1.101 -4.435 1.00 0.00 ATOM 1208 CG2 ILE 156 2.757 0.961 -3.300 1.00 0.00 ATOM 1209 CD1 ILE 156 4.481 -1.770 -5.398 1.00 0.00 ATOM 1210 O ILE 156 1.121 -0.061 -6.528 1.00 0.00 ATOM 1211 C ILE 156 1.635 0.852 -5.845 1.00 0.00 ATOM 1212 N GLU 157 0.872 1.738 -5.221 1.00 0.00 ATOM 1213 CA GLU 157 -0.580 1.691 -5.305 1.00 0.00 ATOM 1214 CB GLU 157 -1.199 2.837 -4.501 1.00 0.00 ATOM 1215 CG GLU 157 -2.719 2.845 -4.499 1.00 0.00 ATOM 1216 CD GLU 157 -3.297 3.961 -3.654 1.00 0.00 ATOM 1217 OE1 GLU 157 -2.506 4.735 -3.070 1.00 0.00 ATOM 1218 OE2 GLU 157 -4.539 4.065 -3.575 1.00 0.00 ATOM 1219 O GLU 157 -1.907 1.018 -7.184 1.00 0.00 ATOM 1220 C GLU 157 -1.081 1.816 -6.738 1.00 0.00 ATOM 1221 N TYR 158 -0.555 2.792 -7.465 1.00 0.00 ATOM 1222 CA TYR 158 -0.982 3.005 -8.845 1.00 0.00 ATOM 1223 CB TYR 158 -0.388 4.301 -9.398 1.00 0.00 ATOM 1224 CG TYR 158 -1.026 5.552 -8.839 1.00 0.00 ATOM 1225 CD1 TYR 158 -2.239 5.493 -8.164 1.00 0.00 ATOM 1226 CD2 TYR 158 -0.415 6.791 -8.990 1.00 0.00 ATOM 1227 CE1 TYR 158 -2.830 6.633 -7.651 1.00 0.00 ATOM 1228 CE2 TYR 158 -0.990 7.941 -8.482 1.00 0.00 ATOM 1229 CZ TYR 158 -2.208 7.851 -7.808 1.00 0.00 ATOM 1230 OH TYR 158 -2.793 8.987 -7.297 1.00 0.00 ATOM 1231 O TYR 158 -1.263 1.402 -10.620 1.00 0.00 ATOM 1232 C TYR 158 -0.524 1.846 -9.734 1.00 0.00 ATOM 1233 N VAL 159 0.697 1.369 -9.496 1.00 0.00 ATOM 1234 CA VAL 159 1.278 0.264 -10.260 1.00 0.00 ATOM 1235 CB VAL 159 2.710 -0.050 -9.795 1.00 0.00 ATOM 1236 CG1 VAL 159 3.229 -1.309 -10.476 1.00 0.00 ATOM 1237 CG2 VAL 159 3.646 1.098 -10.136 1.00 0.00 ATOM 1238 O VAL 159 0.017 -1.602 -11.117 1.00 0.00 ATOM 1239 C VAL 159 0.473 -1.034 -10.122 1.00 0.00 ATOM 1240 N ARG 160 0.304 -1.513 -8.903 1.00 0.00 ATOM 1241 CA ARG 160 -0.441 -2.744 -8.668 1.00 0.00 ATOM 1242 CB ARG 160 -0.523 -3.041 -7.171 1.00 0.00 ATOM 1243 CG ARG 160 0.795 -3.485 -6.553 1.00 0.00 ATOM 1244 CD ARG 160 1.215 -4.852 -7.075 1.00 0.00 ATOM 1245 NE ARG 160 0.293 -5.902 -6.656 1.00 0.00 ATOM 1246 CZ ARG 160 0.298 -7.140 -7.143 1.00 0.00 ATOM 1247 NH1 ARG 160 -0.582 -8.031 -6.702 1.00 0.00 ATOM 1248 NH2 ARG 160 1.181 -7.482 -8.068 1.00 0.00 ATOM 1249 O ARG 160 -2.319 -3.486 -9.965 1.00 0.00 ATOM 1250 C ARG 160 -1.857 -2.623 -9.210 1.00 0.00 ATOM 1251 N THR 161 -2.554 -1.555 -8.894 1.00 0.00 ATOM 1252 CA THR 161 -3.898 -1.301 -9.327 1.00 0.00 ATOM 1253 CB THR 161 -4.577 -0.556 -8.049 1.00 0.00 ATOM 1254 CG2 THR 161 -5.939 0.044 -8.390 1.00 0.00 ATOM 1255 OG1 THR 161 -4.689 -1.494 -6.988 1.00 0.00 ATOM 1256 O THR 161 -5.085 -0.877 -11.345 1.00 0.00 ATOM 1257 C THR 161 -3.983 -0.838 -10.765 1.00 0.00 ATOM 1258 N ILE 162 -2.842 -0.471 -11.341 1.00 0.00 ATOM 1259 CA ILE 162 -2.798 -0.024 -12.738 1.00 0.00 ATOM 1260 CB ILE 162 -1.782 1.116 -12.934 1.00 0.00 ATOM 1261 CG1 ILE 162 -2.185 2.336 -12.107 1.00 0.00 ATOM 1262 CG2 ILE 162 -1.715 1.523 -14.397 1.00 0.00 ATOM 1263 CD1 ILE 162 -3.537 2.909 -12.480 1.00 0.00 ATOM 1264 O ILE 162 -3.063 -1.482 -14.609 1.00 0.00 ATOM 1265 C ILE 162 -2.389 -1.219 -13.604 1.00 0.00 ATOM 1266 N ALA 163 -1.263 -1.833 -13.260 1.00 0.00 ATOM 1267 CA ALA 163 -0.830 -3.001 -13.963 1.00 0.00 ATOM 1268 CB ALA 163 0.449 -3.513 -13.348 1.00 0.00 ATOM 1269 O ALA 163 -2.244 -4.702 -14.870 1.00 0.00 ATOM 1270 C ALA 163 -1.867 -4.083 -13.875 1.00 0.00 ATOM 1271 N MET 164 -2.334 -4.352 -12.674 1.00 0.00 ATOM 1272 CA MET 164 -3.338 -5.399 -12.580 1.00 0.00 ATOM 1273 CB MET 164 -3.673 -5.673 -11.126 1.00 0.00 ATOM 1274 CG MET 164 -4.654 -6.846 -10.948 1.00 0.00 ATOM 1275 SD MET 164 -4.134 -8.454 -11.597 1.00 0.00 ATOM 1276 CE MET 164 -2.956 -8.873 -10.326 1.00 0.00 ATOM 1277 O MET 164 -5.183 -5.862 -14.036 1.00 0.00 ATOM 1278 C MET 164 -4.589 -5.030 -13.381 1.00 0.00 ATOM 1279 N LEU 165 -5.067 -3.793 -13.304 1.00 0.00 ATOM 1280 CA LEU 165 -6.299 -3.439 -14.001 1.00 0.00 ATOM 1281 CB LEU 165 -6.638 -1.961 -13.724 1.00 0.00 ATOM 1282 CG LEU 165 -7.119 -1.718 -12.273 1.00 0.00 ATOM 1283 CD1 LEU 165 -7.456 -0.227 -12.079 1.00 0.00 ATOM 1284 CD2 LEU 165 -8.379 -2.575 -11.925 1.00 0.00 ATOM 1285 O LEU 165 -6.969 -4.195 -16.197 1.00 0.00 ATOM 1286 C LEU 165 -6.147 -3.566 -15.526 1.00 0.00 ATOM 1287 N PHE 166 -5.023 -3.132 -16.065 1.00 0.00 ATOM 1288 CA PHE 166 -4.804 -3.240 -17.503 1.00 0.00 ATOM 1289 CB PHE 166 -3.408 -2.627 -17.825 1.00 0.00 ATOM 1290 CG PHE 166 -3.047 -2.838 -19.276 1.00 0.00 ATOM 1291 CD1 PHE 166 -3.355 -1.853 -20.185 1.00 0.00 ATOM 1292 CD2 PHE 166 -2.483 -4.017 -19.687 1.00 0.00 ATOM 1293 CE1 PHE 166 -3.056 -2.028 -21.550 1.00 0.00 ATOM 1294 CE2 PHE 166 -2.150 -4.225 -21.046 1.00 0.00 ATOM 1295 CZ PHE 166 -2.448 -3.212 -21.968 1.00 0.00 ATOM 1296 O PHE 166 -5.529 -5.099 -18.856 1.00 0.00 ATOM 1297 C PHE 166 -4.843 -4.713 -17.913 1.00 0.00 ATOM 1298 N TYR 167 -4.991 -6.477 -16.939 1.00 0.00 ATOM 1299 CA TYR 167 -5.176 -7.892 -17.201 1.00 0.00 ATOM 1300 CB TYR 167 -4.517 -8.712 -16.083 1.00 0.00 ATOM 1301 CG TYR 167 -4.389 -10.180 -16.384 1.00 0.00 ATOM 1302 CD1 TYR 167 -3.278 -10.677 -17.056 1.00 0.00 ATOM 1303 CD2 TYR 167 -5.381 -11.080 -15.984 1.00 0.00 ATOM 1304 CE1 TYR 167 -3.147 -12.045 -17.329 1.00 0.00 ATOM 1305 CE2 TYR 167 -5.261 -12.446 -16.245 1.00 0.00 ATOM 1306 CZ TYR 167 -4.150 -12.919 -16.921 1.00 0.00 ATOM 1307 OH TYR 167 -4.075 -14.257 -17.218 1.00 0.00 ATOM 1308 O TYR 167 -7.516 -7.800 -16.659 1.00 0.00 ATOM 1309 C TYR 167 -6.666 -8.012 -17.522 1.00 0.00 ATOM 1310 N SER 168 -6.952 -8.329 -18.789 1.00 0.00 ATOM 1311 CA SER 168 -8.325 -8.430 -19.265 1.00 0.00 ATOM 1312 CB SER 168 -8.364 -8.421 -20.796 1.00 0.00 ATOM 1313 OG SER 168 -7.762 -9.588 -21.327 1.00 0.00 ATOM 1314 O SER 168 -10.158 -9.969 -19.000 1.00 0.00 ATOM 1315 C SER 168 -8.975 -9.733 -18.767 1.00 0.00 ATOM 1316 N HIS 169 -8.193 -10.563 -18.075 1.00 0.00 ATOM 1317 CA HIS 169 -8.660 -11.831 -17.536 1.00 0.00 ATOM 1318 CB HIS 169 -7.841 -13.027 -18.170 1.00 0.00 ATOM 1319 CG HIS 169 -7.459 -12.894 -19.610 1.00 0.00 ATOM 1320 CD2 HIS 169 -7.963 -13.478 -20.724 1.00 0.00 ATOM 1321 ND1 HIS 169 -6.451 -12.058 -20.039 1.00 0.00 ATOM 1322 CE1 HIS 169 -6.350 -12.132 -21.354 1.00 0.00 ATOM 1323 NE2 HIS 169 -7.257 -12.986 -21.795 1.00 0.00 ATOM 1324 O HIS 169 -8.518 -13.128 -15.515 1.00 0.00 ATOM 1325 C HIS 169 -8.501 -12.002 -16.020 1.00 0.00 ATOM 1326 N PHE 170 -8.338 -10.902 -15.286 1.00 0.00 ATOM 1327 CA PHE 170 -8.228 -10.996 -13.825 1.00 0.00 ATOM 1328 CB PHE 170 -7.231 -9.922 -13.241 1.00 0.00 ATOM 1329 CG PHE 170 -7.780 -8.516 -13.242 1.00 0.00 ATOM 1330 CD1 PHE 170 -8.634 -8.080 -12.230 1.00 0.00 ATOM 1331 CD2 PHE 170 -7.430 -7.617 -14.249 1.00 0.00 ATOM 1332 CE1 PHE 170 -9.130 -6.787 -12.226 1.00 0.00 ATOM 1333 CE2 PHE 170 -7.929 -6.313 -14.247 1.00 0.00 ATOM 1334 CZ PHE 170 -8.777 -5.902 -13.238 1.00 0.00 ATOM 1335 O PHE 170 -10.604 -10.582 -13.686 1.00 0.00 ATOM 1336 C PHE 170 -9.631 -11.253 -13.282 1.00 0.00 ATOM 1337 N ASN 171 -9.738 -12.245 -12.404 1.00 0.00 ATOM 1338 CA ASN 171 -11.013 -12.611 -11.813 1.00 0.00 ATOM 1339 CB ASN 171 -10.986 -14.066 -11.337 1.00 0.00 ATOM 1340 CG ASN 171 -10.062 -14.274 -10.154 1.00 0.00 ATOM 1341 ND2 ASN 171 -9.220 -13.284 -9.880 1.00 0.00 ATOM 1342 OD1 ASN 171 -10.107 -15.311 -9.493 1.00 0.00 ATOM 1343 O ASN 171 -10.660 -10.722 -10.362 1.00 0.00 ATOM 1344 C ASN 171 -11.337 -11.715 -10.604 1.00 0.00 ATOM 1345 N GLU 172 -12.400 -12.039 -9.883 1.00 0.00 ATOM 1346 CA GLU 172 -12.804 -11.264 -8.719 1.00 0.00 ATOM 1347 CB GLU 172 -14.014 -11.907 -8.039 1.00 0.00 ATOM 1348 CG GLU 172 -15.299 -11.821 -8.850 1.00 0.00 ATOM 1349 CD GLU 172 -16.462 -12.517 -8.169 1.00 0.00 ATOM 1350 OE1 GLU 172 -16.253 -13.110 -7.091 1.00 0.00 ATOM 1351 OE2 GLU 172 -17.584 -12.468 -8.718 1.00 0.00 ATOM 1352 O GLU 172 -11.413 -10.178 -7.092 1.00 0.00 ATOM 1353 C GLU 172 -11.650 -11.205 -7.728 1.00 0.00 ATOM 1354 N GLY 173 -10.938 -12.338 -7.615 1.00 0.00 ATOM 1355 CA GLY 173 -9.816 -12.384 -6.679 1.00 0.00 ATOM 1356 O GLY 173 -8.147 -10.783 -6.059 1.00 0.00 ATOM 1357 C GLY 173 -8.792 -11.298 -6.973 1.00 0.00 ATOM 1358 N GLU 174 -8.636 -10.956 -8.250 1.00 0.00 ATOM 1359 CA GLU 174 -7.673 -9.939 -8.655 1.00 0.00 ATOM 1360 CB GLU 174 -7.352 -10.059 -10.115 1.00 0.00 ATOM 1361 CG GLU 174 -6.488 -11.277 -10.455 1.00 0.00 ATOM 1362 CD GLU 174 -6.490 -11.678 -11.901 1.00 0.00 ATOM 1363 OE1 GLU 174 -7.371 -11.329 -12.704 1.00 0.00 ATOM 1364 OE2 GLU 174 -5.469 -12.347 -12.280 1.00 0.00 ATOM 1365 O GLU 174 -7.453 -7.761 -7.725 1.00 0.00 ATOM 1366 C GLU 174 -8.195 -8.586 -8.242 1.00 0.00 ATOM 1367 N ILE 175 -9.477 -8.354 -8.475 1.00 0.00 ATOM 1368 CA ILE 175 -10.076 -7.092 -8.090 1.00 0.00 ATOM 1369 CB ILE 175 -11.555 -7.032 -8.723 1.00 0.00 ATOM 1370 CG1 ILE 175 -11.497 -7.426 -10.240 1.00 0.00 ATOM 1371 CG2 ILE 175 -12.231 -5.672 -8.465 1.00 0.00 ATOM 1372 CD1 ILE 175 -12.887 -7.207 -10.955 1.00 0.00 ATOM 1373 O ILE 175 -9.624 -5.845 -6.107 1.00 0.00 ATOM 1374 C ILE 175 -9.893 -6.933 -6.590 1.00 0.00 ATOM 1375 N GLU 176 -10.028 -8.040 -5.862 1.00 0.00 ATOM 1376 CA GLU 176 -9.883 -8.026 -4.405 1.00 0.00 ATOM 1377 CB GLU 176 -10.265 -9.383 -3.813 1.00 0.00 ATOM 1378 CG GLU 176 -10.259 -9.422 -2.293 1.00 0.00 ATOM 1379 CD GLU 176 -10.689 -10.768 -1.745 1.00 0.00 ATOM 1380 OE1 GLU 176 -10.990 -11.671 -2.552 1.00 0.00 ATOM 1381 OE2 GLU 176 -10.724 -10.919 -0.506 1.00 0.00 ATOM 1382 O GLU 176 -8.201 -7.081 -2.964 1.00 0.00 ATOM 1383 C GLU 176 -8.443 -7.718 -3.985 1.00 0.00 ATOM 1384 N SER 177 -7.492 -8.172 -4.789 1.00 0.00 ATOM 1385 CA SER 177 -6.083 -7.934 -4.530 1.00 0.00 ATOM 1386 CB SER 177 -5.218 -8.701 -5.531 1.00 0.00 ATOM 1387 OG SER 177 -5.356 -10.103 -5.354 1.00 0.00 ATOM 1388 O SER 177 -5.124 -5.816 -3.881 1.00 0.00 ATOM 1389 C SER 177 -5.834 -6.426 -4.671 1.00 0.00 ATOM 1390 N LYS 178 -6.427 -5.827 -5.700 1.00 0.00 ATOM 1391 CA LYS 178 -6.283 -4.397 -5.937 1.00 0.00 ATOM 1392 CB LYS 178 -6.909 -4.013 -7.280 1.00 0.00 ATOM 1393 CG LYS 178 -6.140 -4.521 -8.489 1.00 0.00 ATOM 1394 CD LYS 178 -6.736 -3.991 -9.786 1.00 0.00 ATOM 1395 CE LYS 178 -8.075 -4.644 -10.083 1.00 0.00 ATOM 1396 NZ LYS 178 -8.629 -4.202 -11.392 1.00 0.00 ATOM 1397 O LYS 178 -6.429 -2.625 -4.339 1.00 0.00 ATOM 1398 C LYS 178 -6.972 -3.612 -4.840 1.00 0.00 ATOM 1399 N PRO 179 -8.177 -4.043 -4.470 1.00 0.00 ATOM 1400 CA PRO 179 -8.972 -3.379 -3.427 1.00 0.00 ATOM 1401 CB PRO 179 -10.139 -4.277 -3.153 1.00 0.00 ATOM 1402 CG PRO 179 -10.422 -4.827 -4.540 1.00 0.00 ATOM 1403 CD PRO 179 -9.044 -5.171 -5.075 1.00 0.00 ATOM 1404 O PRO 179 -8.285 -2.011 -1.575 1.00 0.00 ATOM 1405 C PRO 179 -8.191 -3.102 -2.137 1.00 0.00 ATOM 1406 N VAL 180 -7.394 -4.072 -1.684 1.00 0.00 ATOM 1407 CA VAL 180 -6.602 -3.907 -0.461 1.00 0.00 ATOM 1408 CB VAL 180 -5.864 -5.207 -0.088 1.00 0.00 ATOM 1409 CG1 VAL 180 -6.852 -6.349 0.084 1.00 0.00 ATOM 1410 CG2 VAL 180 -4.873 -5.587 -1.177 1.00 0.00 ATOM 1411 O VAL 180 -5.353 -2.074 0.428 1.00 0.00 ATOM 1412 C VAL 180 -5.525 -2.824 -0.554 1.00 0.00 ATOM 1413 N LEU 181 -4.944 -2.617 -1.751 1.00 0.00 ATOM 1414 CA LEU 181 -4.004 -1.508 -1.946 1.00 0.00 ATOM 1415 CB LEU 181 -3.434 -1.517 -3.397 1.00 0.00 ATOM 1416 CG LEU 181 -2.521 -2.738 -3.660 1.00 0.00 ATOM 1417 CD1 LEU 181 -1.993 -2.789 -5.093 1.00 0.00 ATOM 1418 CD2 LEU 181 -1.330 -2.684 -2.721 1.00 0.00 ATOM 1419 O LEU 181 -4.017 0.680 -0.889 1.00 0.00 ATOM 1420 C LEU 181 -4.624 -0.127 -1.597 1.00 0.00 ATOM 1421 N HIS 182 -5.824 0.149 -2.127 1.00 0.00 ATOM 1422 CA HIS 182 -6.532 1.420 -1.853 1.00 0.00 ATOM 1423 CB HIS 182 -7.833 1.529 -2.537 1.00 0.00 ATOM 1424 CG HIS 182 -7.609 1.942 -3.976 1.00 0.00 ATOM 1425 CD2 HIS 182 -7.539 1.187 -5.117 1.00 0.00 ATOM 1426 ND1 HIS 182 -7.363 3.272 -4.303 1.00 0.00 ATOM 1427 CE1 HIS 182 -7.187 3.299 -5.627 1.00 0.00 ATOM 1428 NE2 HIS 182 -7.291 2.071 -6.146 1.00 0.00 ATOM 1429 O HIS 182 -6.556 2.602 0.222 1.00 0.00 ATOM 1430 C HIS 182 -6.845 1.551 -0.361 1.00 0.00 TER END ################################ # # # END # # # ################################ From mailer@bialko.llnl.gov Mon Aug 26 14:30:19 2002 Date: Mon, 26 Aug 2002 14:30:13 -0700 (PDT) From: Automatic Reply To: karplus@cse.ucsc.edu X-SpamBouncer: 1.4 (10/07/01) X-SBPass: NoBounce X-SBClass: OK # # Protein Structure Prediction Center, LLNL, Livermore, CA # Verification system Mon Aug 26 14:02:10 PDT 2002 by Adam Zemla # # The PIN number of your submission is: PIN_258350_35041 # (PIN number is not an ACCESSION CODE) # Thank you for your submission. Your prediction has been accepted with an ACCESSION CODE: T0129TS001_2 Current information on models submitted in prediction T0129TS001 MODEL_INDEX PIN CODE DATE E-mail T0129TS001_2 PIN_258350_35041 4069-6308-1312 08/26/02 14:02:10 karplus@cse.ucsc.edu T0129TS001_1 PIN_739324_34603 4069-6308-1312 08/26/02 09:50:29 karplus@cse.ucsc.edu PLEASE NOTE: Submission of a duplicate prediction (same target, format, model index) will REPLACE an existing submission (ACCESSION CODE), provided it is received before the target has expired. The current status of models accepted for target T0129 MODEL_INDEX PIN CODE DATE E-mail T0129TS001_1 PIN_739324_34603 4069-6308-1312 08/26/02 09:50:29 karplus@cse.ucsc.edu T0129TS001_2 PIN_258350_35041 4069-6308-1312 08/26/02 14:02:10 karplus@cse.ucsc.edu T0129SS001_1 PIN_123526_15892 4069-6308-1312 07/26/02 15:00:20 karplus@bray.cse.ucsc.edu For more information on accepted models submitted to CASP5 see: http://PredictionCenter.llnl.gov/casp5/models/casp5-models.html Please check below if the verified data of your submission is correct. # Reading prediction format TS PFRMAT TS TARGET T0129 AUTHOR 4069-6308-1312 # Reading MODEL 2 PARENT N/A # Reading prediction format TS (DONE) # Checking the TS prediction MODEL 2 # Checking the TS prediction MODEL 2 (DONE) # MODEL index: 2 # Target name: T0129 # Total number of residues in target: 182 # Total number of residues in model: 182 # Total number of atoms in model: 1430 # Number of atoms with 1.0 occupancy: 1430 # Number of fragments in model: 1 # Number of METHOD records: 109 # No errors. ################################ # # # SUBMISSION # # # ################################ # # # BEGIN # # # ################################ PFRMAT TS TARGET T0129 AUTHOR 4069-6308-1312 METHOD The SAM-T02 human predictions start with the same method as the METHOD SAM-T02 server: METHOD METHOD Use the SAM-T2K method for finding homologs of the target and METHOD aligning them. METHOD METHOD Make local structure predictions using neural nets and the METHOD multiple alignment. We currently have 5 local-structure METHOD alphabets: METHOD DSSP METHOD STRIDE METHOD STR an extended version of DSSP that splits the beta strands METHOD into multiple classes (parallel/antiparallel/mixed, METHOD edge/center) METHOD ALPHA an discretization of the alpha torsion angle: METHOD CA(i-i), CA(i), CA(i+1), CA(i+2) METHOD DSSP_EHL2 CASP's collapse of the DSSP alphabet METHOD METHOD DSSP_EHL2 is not predicted directly by a neural net, but is METHOD computed as a weighted average of the other 4 networks (each METHOD probability vector output is multiplied by conditional METHOD probability matrix P(E|letter) P(H|letter) P(L|letter)). The METHOD weights for the averaging are the mutual information between the METHOD local structure alphabet and the DSSP_EHL2 alphabet in a large METHOD training set. METHOD METHOD METHOD We make four 2-track HMMs (1.0 amino acid + 0.3 local structure) METHOD and use them to score a template library of about 6200 templates. METHOD We also used a single-track HMM to score not just the template METHOD library, but a non-redundant copy of the entire PDB. METHOD METHOD [Difference from server: the web server did not include the ALPHA METHOD alphabet in either the DSSP_EHL2 computation or the 2-track HMMS.] METHOD METHOD One-track HMMs built from the template library multiple alignments METHOD were used to score the target sequence. METHOD METHOD All the logs of e-values were combined in a weighted average (with METHOD rather arbitrary weights, since we did not have time to METHOD optimize them), and the best templates ranked. METHOD METHOD Alignments of the target to the top templates were made using METHOD several different alignment methods (all using the SAM hmmscore METHOD program). METHOD METHOD After the large set of alignments were made the "human" methods and METHOD the server diverge significantly. The server just picks the METHOD best-scoring templates (after removing redundancy) and reports the METHOD local posterior-decoding alignments made with the 2-track AA+STR METHOD target HMM. METHOD METHOD The hand method used SAM's "fragfinder" program and the 2-track AA+STR METHOD HMM to find short fragments (9 residues long) for each position in the METHOD sequence (6 fragments were kept for each position). METHOD METHOD Then the "undertaker" program (named because it optimizes burial) is METHOD used to try to combine the alignments and the fragments into a METHOD consistent 3D model. No single alignment or parent template was used, METHOD though in many cases one had much more influence than the others. The METHOD alignment scores were not passed to undertaker, but were used only to METHOD pike the set of alignments and fragments that undertaker would see. METHOD METHOD A genetic algorithm with about 16 different operators were used to METHOD optimize a score function. The score function was hand-tweaked for METHOD each target (mainly by adding constraints to keep beta sheets METHOD together, but also by adjusting what terms were included in the score METHOD function and what weights were used). Undertaker was undergoing METHOD extensive modification during CASP season, so may have had quite METHOD different features available for different targets. METHOD METHOD Bower and Dunbrack's SCWRL was run on some of the intermediate METHOD conformations generated by undertaker, but the final conformation was METHOD chosen entirely by the undertaker score function. METHOD METHOD Optimization was generally done in many passes, with hand inspection METHOD of the best conformation after each pass, followed (often) by tweaking METHOD the score function to move the conformation in a direction we desired. METHOD METHOD In a few cases, when we started getting a decent structure that did METHOD not correspond well to our input alignments, we submitted the METHOD structure to VAST to get structure-structure alignments, to try to METHOD find some other possible templates to use as a base. METHOD METHOD In some cases, when several conformations had good parts, different METHOD conformations were manually cut-and-pasted, with undertaker run to try METHOD to smooth out the transitions. METHOD METHOD Because undertaker does not (yet) handle multimers, we often added METHOD "scaffolding" constraints by hand to try to retain structure in METHOD dimerization interfaces. This is a crude hack that we hope to get rid METHOD of when we have multimers implemented. METHOD METHOD Because undertaker does not (yet) have a hydrogen-bond scoring METHOD function, we often had to add constraints to hold beta sheets METHOD together. In some cases where the register was not obvious, we had to METHOD guess or try several different registers. METHOD METHOD In some cases, when we got desperate for initial starting points, we METHOD threw the Robetta ab-initio models into the undertaker pool, and METHOD optimized from them as well as the ones undertaker started with. METHOD METHOD For multiple-domain models, we generally broke the sequence into METHOD chunks (often somewhat arbitrary overlapping chunks), and did the full METHOD SAM-T02 method for each subchain. The alignments found were all METHOD tossed into the undertaker conformation search. In some cases, we METHOD performed undertaker runs for the subchains, and cut-and-pasted the METHOD pieces into one PDB file (with bad breaks) and let undertaker try to METHOD assemble the pieces. MODEL 2 PARENT N/A ATOM 1 N MET 1 1.865 -14.002 26.085 1.00 0.00 ATOM 2 CA MET 1 1.161 -14.292 24.792 1.00 0.00 ATOM 3 CB MET 1 0.747 -15.748 24.791 1.00 0.00 ATOM 4 CG MET 1 0.223 -16.095 23.411 1.00 0.00 ATOM 5 SD MET 1 0.353 -17.939 23.326 1.00 0.00 ATOM 6 CE MET 1 2.168 -18.015 23.109 1.00 0.00 ATOM 7 O MET 1 -0.908 -13.328 25.546 1.00 0.00 ATOM 8 C MET 1 -0.049 -13.386 24.637 1.00 0.00 ATOM 9 N LEU 2 -0.132 -12.668 23.517 1.00 0.00 ATOM 10 CA LEU 2 -1.245 -11.767 23.298 1.00 0.00 ATOM 11 CB LEU 2 -1.237 -11.208 21.891 1.00 0.00 ATOM 12 CG LEU 2 -0.099 -10.227 21.591 1.00 0.00 ATOM 13 CD1 LEU 2 -0.105 -9.856 20.125 1.00 0.00 ATOM 14 CD2 LEU 2 -0.263 -8.982 22.455 1.00 0.00 ATOM 15 O LEU 2 -3.427 -11.913 24.204 1.00 0.00 ATOM 16 C LEU 2 -2.540 -12.478 23.576 1.00 0.00 ATOM 17 N ILE 3 -2.668 -13.698 23.062 1.00 0.00 ATOM 18 CA ILE 3 -3.871 -14.488 23.302 1.00 0.00 ATOM 19 CB ILE 3 -3.792 -15.857 22.593 1.00 0.00 ATOM 20 CG1 ILE 3 -3.792 -15.641 21.060 1.00 0.00 ATOM 21 CG2 ILE 3 -4.922 -16.745 23.060 1.00 0.00 ATOM 22 CD1 ILE 3 -3.411 -16.906 20.299 1.00 0.00 ATOM 23 O ILE 3 -5.187 -14.473 25.317 1.00 0.00 ATOM 24 C ILE 3 -4.073 -14.635 24.814 1.00 0.00 ATOM 25 N SER 4 -2.980 -14.867 25.538 1.00 0.00 ATOM 26 CA SER 4 -3.016 -15.031 26.988 1.00 0.00 ATOM 27 CB SER 4 -1.800 -15.409 27.637 1.00 0.00 ATOM 28 OG SER 4 -1.434 -16.732 27.253 1.00 0.00 ATOM 29 O SER 4 -4.563 -13.807 28.365 1.00 0.00 ATOM 30 C SER 4 -3.552 -13.762 27.655 1.00 0.00 ATOM 31 N HIS 5 -2.873 -12.637 27.428 1.00 0.00 ATOM 32 CA HIS 5 -3.277 -11.355 28.006 1.00 0.00 ATOM 33 CB HIS 5 -2.307 -10.286 27.460 1.00 0.00 ATOM 34 CG HIS 5 -1.009 -10.236 28.252 1.00 0.00 ATOM 35 CD2 HIS 5 0.089 -11.026 28.209 1.00 0.00 ATOM 36 ND1 HIS 5 -0.786 -9.264 29.186 1.00 0.00 ATOM 37 CE1 HIS 5 0.443 -9.443 29.696 1.00 0.00 ATOM 38 NE2 HIS 5 0.992 -10.489 29.116 1.00 0.00 ATOM 39 O HIS 5 -5.465 -10.511 28.530 1.00 0.00 ATOM 40 C HIS 5 -4.731 -11.044 27.689 1.00 0.00 ATOM 41 N SER 6 -5.150 -11.368 26.473 1.00 0.00 ATOM 42 CA SER 6 -6.521 -11.146 26.070 1.00 0.00 ATOM 43 CB SER 6 -6.765 -11.597 24.679 1.00 0.00 ATOM 44 OG SER 6 -6.102 -10.707 23.783 1.00 0.00 ATOM 45 O SER 6 -8.479 -11.408 27.428 1.00 0.00 ATOM 46 C SER 6 -7.438 -11.907 27.025 1.00 0.00 ATOM 47 N ASP 7 -7.005 -13.086 27.448 1.00 0.00 ATOM 48 CA ASP 7 -7.782 -13.908 28.368 1.00 0.00 ATOM 49 CB ASP 7 -7.156 -15.307 28.438 1.00 0.00 ATOM 50 CG ASP 7 -7.924 -16.233 29.350 1.00 0.00 ATOM 51 OD1 ASP 7 -9.061 -16.598 28.998 1.00 0.00 ATOM 52 OD2 ASP 7 -7.402 -16.588 30.430 1.00 0.00 ATOM 53 O ASP 7 -8.979 -13.170 30.315 1.00 0.00 ATOM 54 C ASP 7 -7.880 -13.297 29.763 1.00 0.00 ATOM 55 N LEU 8 -6.737 -12.893 30.320 1.00 0.00 ATOM 56 CA LEU 8 -6.679 -12.276 31.652 1.00 0.00 ATOM 57 CB LEU 8 -5.251 -11.939 32.036 1.00 0.00 ATOM 58 CG LEU 8 -4.357 -13.155 32.298 1.00 0.00 ATOM 59 CD1 LEU 8 -2.927 -12.710 32.515 1.00 0.00 ATOM 60 CD2 LEU 8 -4.871 -13.908 33.520 1.00 0.00 ATOM 61 O LEU 8 -8.257 -10.797 32.699 1.00 0.00 ATOM 62 C LEU 8 -7.546 -11.021 31.712 1.00 0.00 ATOM 63 N ASN 9 -7.512 -10.218 30.644 1.00 0.00 ATOM 64 CA ASN 9 -8.329 -9.007 30.579 1.00 0.00 ATOM 65 CB ASN 9 -7.978 -8.220 29.321 1.00 0.00 ATOM 66 CG ASN 9 -6.633 -7.539 29.347 1.00 0.00 ATOM 67 ND2 ASN 9 -6.066 -7.393 30.534 1.00 0.00 ATOM 68 OD1 ASN 9 -6.083 -7.132 28.299 1.00 0.00 ATOM 69 O ASN 9 -10.652 -8.610 30.967 1.00 0.00 ATOM 70 C ASN 9 -9.799 -9.401 30.574 1.00 0.00 ATOM 71 N GLN 10 -10.077 -10.632 30.130 1.00 0.00 ATOM 72 CA GLN 10 -11.452 -11.130 30.058 1.00 0.00 ATOM 73 CB GLN 10 -11.557 -12.463 29.400 1.00 0.00 ATOM 74 CG GLN 10 -13.001 -12.935 29.294 1.00 0.00 ATOM 75 CD GLN 10 -13.039 -14.286 28.603 1.00 0.00 ATOM 76 OE1 GLN 10 -12.143 -15.106 28.801 1.00 0.00 ATOM 77 NE2 GLN 10 -14.067 -14.476 27.789 1.00 0.00 ATOM 78 O GLN 10 -13.091 -10.654 31.756 1.00 0.00 ATOM 79 C GLN 10 -11.984 -11.123 31.494 1.00 0.00 ATOM 80 N GLN 11 -11.145 -11.586 32.420 1.00 0.00 ATOM 81 CA GLN 11 -11.478 -11.622 33.844 1.00 0.00 ATOM 82 CB GLN 11 -10.349 -12.255 34.653 1.00 0.00 ATOM 83 CG GLN 11 -10.686 -12.484 36.115 1.00 0.00 ATOM 84 CD GLN 11 -11.869 -13.411 36.288 1.00 0.00 ATOM 85 OE1 GLN 11 -11.919 -14.484 35.686 1.00 0.00 ATOM 86 NE2 GLN 11 -12.828 -13.007 37.120 1.00 0.00 ATOM 87 O GLN 11 -12.729 -10.069 35.175 1.00 0.00 ATOM 88 C GLN 11 -11.791 -10.229 34.397 1.00 0.00 ATOM 89 N LEU 12 -11.005 -9.225 34.001 1.00 0.00 ATOM 90 CA LEU 12 -11.237 -7.850 34.454 1.00 0.00 ATOM 91 CB LEU 12 -10.214 -6.886 33.939 1.00 0.00 ATOM 92 CG LEU 12 -8.810 -7.069 34.525 1.00 0.00 ATOM 93 CD1 LEU 12 -7.832 -6.156 33.820 1.00 0.00 ATOM 94 CD2 LEU 12 -8.841 -6.764 36.018 1.00 0.00 ATOM 95 O LEU 12 -13.371 -6.814 34.859 1.00 0.00 ATOM 96 C LEU 12 -12.635 -7.393 34.052 1.00 0.00 ATOM 97 N LYS 13 -12.999 -7.668 32.804 1.00 0.00 ATOM 98 CA LYS 13 -14.306 -7.282 32.275 1.00 0.00 ATOM 99 CB LYS 13 -14.335 -7.479 30.758 1.00 0.00 ATOM 100 CG LYS 13 -15.621 -7.044 30.064 1.00 0.00 ATOM 101 CD LYS 13 -16.126 -5.674 30.521 1.00 0.00 ATOM 102 CE LYS 13 -15.171 -4.545 30.205 1.00 0.00 ATOM 103 NZ LYS 13 -15.698 -3.260 30.744 1.00 0.00 ATOM 104 O LYS 13 -16.475 -7.491 33.277 1.00 0.00 ATOM 105 C LYS 13 -15.438 -8.061 32.944 1.00 0.00 ATOM 106 N SER 14 -15.224 -9.363 33.139 1.00 0.00 ATOM 107 CA SER 14 -16.208 -10.239 33.777 1.00 0.00 ATOM 108 CB SER 14 -15.920 -11.653 33.912 1.00 0.00 ATOM 109 OG SER 14 -14.970 -11.863 34.940 1.00 0.00 ATOM 110 O SER 14 -17.740 -9.614 35.514 1.00 0.00 ATOM 111 C SER 14 -16.569 -9.685 35.147 1.00 0.00 ATOM 112 N ALA 15 -15.546 -9.265 35.885 1.00 0.00 ATOM 113 CA ALA 15 -15.729 -8.697 37.210 1.00 0.00 ATOM 114 CB ALA 15 -14.473 -8.924 38.046 1.00 0.00 ATOM 115 O ALA 15 -16.043 -6.556 38.230 1.00 0.00 ATOM 116 C ALA 15 -16.127 -7.224 37.203 1.00 0.00 ATOM 117 N GLY 16 -16.554 -6.727 36.044 1.00 0.00 ATOM 118 CA GLY 16 -17.006 -5.350 35.915 1.00 0.00 ATOM 119 O GLY 16 -16.335 -3.117 36.424 1.00 0.00 ATOM 120 C GLY 16 -15.985 -4.239 36.049 1.00 0.00 ATOM 121 N ILE 17 -14.728 -4.529 35.727 1.00 0.00 ATOM 122 CA ILE 17 -13.675 -3.524 35.808 1.00 0.00 ATOM 123 CB ILE 17 -12.289 -4.416 35.862 1.00 0.00 ATOM 124 CG1 ILE 17 -12.267 -5.211 37.174 1.00 0.00 ATOM 125 CG2 ILE 17 -11.081 -3.484 35.780 1.00 0.00 ATOM 126 CD1 ILE 17 -12.341 -4.359 38.419 1.00 0.00 ATOM 127 O ILE 17 -13.826 -3.402 33.391 1.00 0.00 ATOM 128 C ILE 17 -13.451 -2.859 34.444 1.00 0.00 ATOM 129 N GLY 18 -12.885 -1.659 34.468 1.00 0.00 ATOM 130 CA GLY 18 -12.630 -0.928 33.236 1.00 0.00 ATOM 131 O GLY 18 -10.249 -1.269 33.338 1.00 0.00 ATOM 132 C GLY 18 -11.262 -1.241 32.637 1.00 0.00 ATOM 133 N PHE 19 -11.254 -1.539 31.343 1.00 0.00 ATOM 134 CA PHE 19 -10.013 -1.825 30.633 1.00 0.00 ATOM 135 CB PHE 19 -10.322 -2.506 29.312 1.00 0.00 ATOM 136 CG PHE 19 -10.929 -3.848 29.507 1.00 0.00 ATOM 137 CD1 PHE 19 -12.312 -3.982 29.632 1.00 0.00 ATOM 138 CD2 PHE 19 -10.132 -5.000 29.528 1.00 0.00 ATOM 139 CE1 PHE 19 -12.899 -5.237 29.774 1.00 0.00 ATOM 140 CE2 PHE 19 -10.700 -6.267 29.665 1.00 0.00 ATOM 141 CZ PHE 19 -12.086 -6.379 29.795 1.00 0.00 ATOM 142 O PHE 19 -10.064 0.491 29.944 1.00 0.00 ATOM 143 C PHE 19 -9.366 -0.490 30.227 1.00 0.00 ATOM 144 N ASN 20 -8.038 -0.444 30.245 1.00 0.00 ATOM 145 CA ASN 20 -7.310 0.759 29.868 1.00 0.00 ATOM 146 CB ASN 20 -5.968 0.863 30.526 1.00 0.00 ATOM 147 CG ASN 20 -5.055 -0.333 30.233 1.00 0.00 ATOM 148 ND2 ASN 20 -3.972 -0.427 30.989 1.00 0.00 ATOM 149 OD1 ASN 20 -5.308 -1.146 29.335 1.00 0.00 ATOM 150 O ASN 20 -7.389 -0.173 27.639 1.00 0.00 ATOM 151 C ASN 20 -7.217 0.838 28.339 1.00 0.00 ATOM 152 N ALA 21 -6.977 2.043 27.820 1.00 0.00 ATOM 153 CA ALA 21 -6.844 2.241 26.378 1.00 0.00 ATOM 154 CB ALA 21 -6.519 3.706 26.073 1.00 0.00 ATOM 155 O ALA 21 -5.922 0.680 24.789 1.00 0.00 ATOM 156 C ALA 21 -5.748 1.318 25.830 1.00 0.00 ATOM 157 N THR 22 -4.640 1.201 26.558 1.00 0.00 ATOM 158 CA THR 22 -3.518 0.360 26.161 1.00 0.00 ATOM 159 CB THR 22 -2.401 0.421 27.210 1.00 0.00 ATOM 160 CG2 THR 22 -1.092 -0.098 26.617 1.00 0.00 ATOM 161 OG1 THR 22 -2.237 1.782 27.632 1.00 0.00 ATOM 162 O THR 22 -3.377 -1.691 24.941 1.00 0.00 ATOM 163 C THR 22 -3.857 -1.105 25.910 1.00 0.00 ATOM 164 N GLU 23 -4.660 -1.700 26.777 1.00 0.00 ATOM 165 CA GLU 23 -5.033 -3.110 26.619 1.00 0.00 ATOM 166 CB GLU 23 -5.719 -3.643 27.887 1.00 0.00 ATOM 167 CG GLU 23 -4.745 -3.829 29.060 1.00 0.00 ATOM 168 CD GLU 23 -5.413 -4.121 30.408 1.00 0.00 ATOM 169 OE1 GLU 23 -6.611 -3.806 30.593 1.00 0.00 ATOM 170 OE2 GLU 23 -4.718 -4.650 31.305 1.00 0.00 ATOM 171 O GLU 23 -5.701 -4.126 24.557 1.00 0.00 ATOM 172 C GLU 23 -5.927 -3.257 25.398 1.00 0.00 ATOM 173 N LEU 24 -6.894 -2.350 25.267 1.00 0.00 ATOM 174 CA LEU 24 -7.820 -2.364 24.136 1.00 0.00 ATOM 175 CB LEU 24 -8.890 -1.298 24.286 1.00 0.00 ATOM 176 CG LEU 24 -9.889 -1.555 25.418 1.00 0.00 ATOM 177 CD1 LEU 24 -10.803 -0.360 25.583 1.00 0.00 ATOM 178 CD2 LEU 24 -10.701 -2.807 25.105 1.00 0.00 ATOM 179 O LEU 24 -7.380 -2.854 21.816 1.00 0.00 ATOM 180 C LEU 24 -7.082 -2.173 22.804 1.00 0.00 ATOM 181 N HIS 25 -6.104 -1.269 22.783 1.00 0.00 ATOM 182 CA HIS 25 -5.327 -1.029 21.559 1.00 0.00 ATOM 183 CB HIS 25 -4.472 0.223 21.787 1.00 0.00 ATOM 184 CG HIS 25 -5.256 1.498 21.523 1.00 0.00 ATOM 185 CD2 HIS 25 -6.156 2.164 22.286 1.00 0.00 ATOM 186 ND1 HIS 25 -5.107 2.193 20.356 1.00 0.00 ATOM 187 CE1 HIS 25 -5.887 3.284 20.412 1.00 0.00 ATOM 188 NE2 HIS 25 -6.519 3.293 21.567 1.00 0.00 ATOM 189 O HIS 25 -4.356 -2.627 20.043 1.00 0.00 ATOM 190 C HIS 25 -4.488 -2.260 21.211 1.00 0.00 ATOM 191 N GLY 26 -3.942 -2.903 22.237 1.00 0.00 ATOM 192 CA GLY 26 -3.149 -4.108 22.053 1.00 0.00 ATOM 193 O GLY 26 -3.605 -5.917 20.526 1.00 0.00 ATOM 194 C GLY 26 -4.031 -5.206 21.442 1.00 0.00 ATOM 195 N PHE 27 -5.273 -5.305 21.925 1.00 0.00 ATOM 196 CA PHE 27 -6.222 -6.315 21.443 1.00 0.00 ATOM 197 CB PHE 27 -7.545 -6.482 22.167 1.00 0.00 ATOM 198 CG PHE 27 -7.474 -6.671 23.651 1.00 0.00 ATOM 199 CD1 PHE 27 -8.471 -6.143 24.476 1.00 0.00 ATOM 200 CD2 PHE 27 -6.456 -7.422 24.229 1.00 0.00 ATOM 201 CE1 PHE 27 -8.480 -6.342 25.840 1.00 0.00 ATOM 202 CE2 PHE 27 -6.425 -7.654 25.655 1.00 0.00 ATOM 203 CZ PHE 27 -7.455 -7.092 26.427 1.00 0.00 ATOM 204 O PHE 27 -6.400 -7.052 19.160 1.00 0.00 ATOM 205 C PHE 27 -6.574 -6.136 19.970 1.00 0.00 ATOM 206 N LEU 28 -7.054 -4.946 19.629 1.00 0.00 ATOM 207 CA LEU 28 -7.455 -4.641 18.258 1.00 0.00 ATOM 208 CB LEU 28 -7.986 -3.215 18.137 1.00 0.00 ATOM 209 CG LEU 28 -9.291 -2.932 18.888 1.00 0.00 ATOM 210 CD1 LEU 28 -9.609 -1.454 18.836 1.00 0.00 ATOM 211 CD2 LEU 28 -10.421 -3.742 18.264 1.00 0.00 ATOM 212 O LEU 28 -6.625 -5.477 16.179 1.00 0.00 ATOM 213 C LEU 28 -6.370 -4.855 17.210 1.00 0.00 ATOM 214 N SER 29 -5.156 -4.378 17.464 1.00 0.00 ATOM 215 CA SER 29 -4.101 -4.570 16.468 1.00 0.00 ATOM 216 CB SER 29 -2.899 -3.724 16.897 1.00 0.00 ATOM 217 OG SER 29 -3.223 -2.343 16.751 1.00 0.00 ATOM 218 O SER 29 -3.333 -6.488 15.255 1.00 0.00 ATOM 219 C SER 29 -3.674 -6.030 16.345 1.00 0.00 ATOM 220 N GLY 30 -3.723 -6.756 17.461 1.00 0.00 ATOM 221 CA GLY 30 -3.357 -8.160 17.464 1.00 0.00 ATOM 222 O GLY 30 -4.032 -9.947 16.039 1.00 0.00 ATOM 223 C GLY 30 -4.383 -8.989 16.720 1.00 0.00 ATOM 224 N LEU 31 -5.653 -8.607 16.829 1.00 0.00 ATOM 225 CA LEU 31 -6.725 -9.325 16.144 1.00 0.00 ATOM 226 CB LEU 31 -8.109 -8.882 16.654 1.00 0.00 ATOM 227 CG LEU 31 -9.273 -9.541 15.932 1.00 0.00 ATOM 228 CD1 LEU 31 -9.316 -10.925 15.760 1.00 0.00 ATOM 229 CD2 LEU 31 -10.311 -8.781 15.395 1.00 0.00 ATOM 230 O LEU 31 -6.794 -10.009 13.851 1.00 0.00 ATOM 231 C LEU 31 -6.638 -9.082 14.648 1.00 0.00 ATOM 232 N LEU 32 -6.388 -7.828 14.273 1.00 0.00 ATOM 233 CA LEU 32 -6.294 -7.450 12.866 1.00 0.00 ATOM 234 CB LEU 32 -6.266 -5.954 12.680 1.00 0.00 ATOM 235 CG LEU 32 -6.152 -5.531 11.206 1.00 0.00 ATOM 236 CD1 LEU 32 -7.531 -5.616 10.605 1.00 0.00 ATOM 237 CD2 LEU 32 -5.641 -4.080 11.078 1.00 0.00 ATOM 238 O LEU 32 -5.198 -8.549 11.046 1.00 0.00 ATOM 239 C LEU 32 -5.088 -8.083 12.180 1.00 0.00 ATOM 240 N CYS 33 -3.952 -8.135 12.863 1.00 0.00 ATOM 241 CA CYS 33 -2.768 -8.722 12.250 1.00 0.00 ATOM 242 CB CYS 33 -1.493 -8.044 12.867 1.00 0.00 ATOM 243 SG CYS 33 -1.447 -6.333 12.300 1.00 0.00 ATOM 244 O CYS 33 -1.682 -10.843 11.899 1.00 0.00 ATOM 245 C CYS 33 -2.652 -10.250 12.381 1.00 0.00 ATOM 246 N GLY 34 -3.616 -10.874 13.059 1.00 0.00 ATOM 247 CA GLY 34 -3.607 -12.321 13.196 1.00 0.00 ATOM 248 O GLY 34 -2.967 -14.220 14.478 1.00 0.00 ATOM 249 C GLY 34 -2.958 -12.989 14.397 1.00 0.00 ATOM 250 N GLY 35 -2.401 -12.219 15.327 1.00 0.00 ATOM 251 CA GLY 35 -1.774 -12.816 16.504 1.00 0.00 ATOM 252 O GLY 35 -2.393 -13.968 18.528 1.00 0.00 ATOM 253 C GLY 35 -2.754 -13.235 17.600 1.00 0.00 ATOM 254 N LEU 36 -3.977 -12.730 17.502 1.00 0.00 ATOM 255 CA LEU 36 -5.039 -13.069 18.431 1.00 0.00 ATOM 256 CB LEU 36 -5.485 -11.883 19.190 1.00 0.00 ATOM 257 CG LEU 36 -4.516 -10.881 19.771 1.00 0.00 ATOM 258 CD1 LEU 36 -5.263 -9.852 20.611 1.00 0.00 ATOM 259 CD2 LEU 36 -3.502 -11.593 20.645 1.00 0.00 ATOM 260 O LEU 36 -6.782 -13.221 16.777 1.00 0.00 ATOM 261 C LEU 36 -6.078 -13.818 17.593 1.00 0.00 ATOM 262 N LYS 37 -6.133 -15.155 17.736 1.00 0.00 ATOM 263 CA LYS 37 -7.080 -15.994 16.991 1.00 0.00 ATOM 264 CB LYS 37 -6.935 -17.449 17.483 1.00 0.00 ATOM 265 CG LYS 37 -5.576 -18.127 17.236 1.00 0.00 ATOM 266 CD LYS 37 -5.589 -19.514 17.832 1.00 0.00 ATOM 267 CE LYS 37 -4.262 -20.288 17.598 1.00 0.00 ATOM 268 NZ LYS 37 -4.459 -21.621 18.303 1.00 0.00 ATOM 269 O LYS 37 -8.869 -15.061 18.283 1.00 0.00 ATOM 270 C LYS 37 -8.540 -15.658 17.259 1.00 0.00 ATOM 271 N ASP 38 -9.402 -16.009 16.305 1.00 0.00 ATOM 272 CA ASP 38 -10.830 -15.765 16.421 1.00 0.00 ATOM 273 CB ASP 38 -11.560 -16.273 15.179 1.00 0.00 ATOM 274 CG ASP 38 -11.273 -15.430 13.956 1.00 0.00 ATOM 275 OD1 ASP 38 -10.133 -15.493 13.450 1.00 0.00 ATOM 276 OD2 ASP 38 -12.174 -14.682 13.512 1.00 0.00 ATOM 277 O ASP 38 -12.306 -15.738 18.293 1.00 0.00 ATOM 278 C ASP 38 -11.454 -16.372 17.678 1.00 0.00 ATOM 279 N GLN 39 -11.005 -17.567 18.080 1.00 0.00 ATOM 280 CA GLN 39 -11.559 -18.223 19.272 1.00 0.00 ATOM 281 CB GLN 39 -11.010 -19.646 19.440 1.00 0.00 ATOM 282 CG GLN 39 -9.541 -19.767 19.864 1.00 0.00 ATOM 283 CD GLN 39 -8.572 -19.803 18.716 1.00 0.00 ATOM 284 OE1 GLN 39 -8.784 -19.183 17.658 1.00 0.00 ATOM 285 NE2 GLN 39 -7.448 -20.494 18.915 1.00 0.00 ATOM 286 O GLN 39 -12.119 -17.647 21.526 1.00 0.00 ATOM 287 C GLN 39 -11.371 -17.448 20.571 1.00 0.00 ATOM 288 N SER 40 -10.373 -16.568 20.609 1.00 0.00 ATOM 289 CA SER 40 -10.147 -15.737 21.789 1.00 0.00 ATOM 290 CB SER 40 -8.665 -15.429 21.877 1.00 0.00 ATOM 291 OG SER 40 -7.969 -16.619 22.244 1.00 0.00 ATOM 292 O SER 40 -11.409 -13.898 22.660 1.00 0.00 ATOM 293 C SER 40 -10.943 -14.448 21.662 1.00 0.00 ATOM 294 N TRP 41 -11.124 -13.982 20.427 1.00 0.00 ATOM 295 CA TRP 41 -11.877 -12.756 20.173 1.00 0.00 ATOM 296 CB TRP 41 -11.565 -12.332 18.684 1.00 0.00 ATOM 297 CG TRP 41 -12.298 -11.075 18.286 1.00 0.00 ATOM 298 CD1 TRP 41 -12.046 -9.804 18.723 1.00 0.00 ATOM 299 CD2 TRP 41 -13.440 -10.981 17.421 1.00 0.00 ATOM 300 CE2 TRP 41 -13.829 -9.618 17.389 1.00 0.00 ATOM 301 CE3 TRP 41 -14.176 -11.909 16.671 1.00 0.00 ATOM 302 NE1 TRP 41 -12.962 -8.924 18.190 1.00 0.00 ATOM 303 CZ2 TRP 41 -14.919 -9.167 16.638 1.00 0.00 ATOM 304 CZ3 TRP 41 -15.261 -11.459 15.924 1.00 0.00 ATOM 305 CH2 TRP 41 -15.622 -10.099 15.915 1.00 0.00 ATOM 306 O TRP 41 -14.100 -12.091 20.799 1.00 0.00 ATOM 307 C TRP 41 -13.376 -12.990 20.369 1.00 0.00 ATOM 308 N LEU 42 -13.845 -14.178 19.993 1.00 0.00 ATOM 309 CA LEU 42 -15.260 -14.537 20.144 1.00 0.00 ATOM 310 CB LEU 42 -15.519 -15.872 19.417 1.00 0.00 ATOM 311 CG LEU 42 -16.951 -16.393 19.616 1.00 0.00 ATOM 312 CD1 LEU 42 -17.954 -15.436 18.975 1.00 0.00 ATOM 313 CD2 LEU 42 -17.060 -17.766 19.037 1.00 0.00 ATOM 314 O LEU 42 -16.690 -14.197 22.039 1.00 0.00 ATOM 315 C LEU 42 -15.618 -14.641 21.626 1.00 0.00 ATOM 316 N PRO 43 -14.713 -15.210 22.423 1.00 0.00 ATOM 317 CA PRO 43 -14.924 -15.330 23.868 1.00 0.00 ATOM 318 CB PRO 43 -13.791 -16.136 24.383 1.00 0.00 ATOM 319 CG PRO 43 -13.417 -17.011 23.228 1.00 0.00 ATOM 320 CD PRO 43 -13.578 -16.115 22.014 1.00 0.00 ATOM 321 O PRO 43 -15.903 -13.652 25.278 1.00 0.00 ATOM 322 C PRO 43 -15.003 -13.929 24.486 1.00 0.00 ATOM 323 N LEU 44 -14.092 -13.035 24.092 1.00 0.00 ATOM 324 CA LEU 44 -14.097 -11.662 24.614 1.00 0.00 ATOM 325 CB LEU 44 -12.917 -10.848 24.069 1.00 0.00 ATOM 326 CG LEU 44 -12.976 -9.348 24.415 1.00 0.00 ATOM 327 CD1 LEU 44 -12.850 -9.166 25.921 1.00 0.00 ATOM 328 CD2 LEU 44 -11.891 -8.546 23.672 1.00 0.00 ATOM 329 O LEU 44 -16.009 -10.281 25.053 1.00 0.00 ATOM 330 C LEU 44 -15.395 -10.971 24.231 1.00 0.00 ATOM 331 N LEU 45 -15.813 -11.167 22.983 1.00 0.00 ATOM 332 CA LEU 45 -17.043 -10.565 22.481 1.00 0.00 ATOM 333 CB LEU 45 -17.207 -11.038 20.981 1.00 0.00 ATOM 334 CG LEU 45 -17.107 -10.112 19.755 1.00 0.00 ATOM 335 CD1 LEU 45 -16.278 -8.879 20.041 1.00 0.00 ATOM 336 CD2 LEU 45 -16.527 -10.896 18.588 1.00 0.00 ATOM 337 O LEU 45 -19.193 -10.203 23.495 1.00 0.00 ATOM 338 C LEU 45 -18.279 -11.009 23.275 1.00 0.00 ATOM 339 N TYR 46 -18.318 -12.282 23.685 1.00 0.00 ATOM 340 CA TYR 46 -19.456 -12.783 24.463 1.00 0.00 ATOM 341 CB TYR 46 -19.478 -14.305 24.559 1.00 0.00 ATOM 342 CG TYR 46 -20.811 -14.796 25.087 1.00 0.00 ATOM 343 CD1 TYR 46 -21.927 -14.814 24.257 1.00 0.00 ATOM 344 CD2 TYR 46 -20.961 -15.216 26.395 1.00 0.00 ATOM 345 CE1 TYR 46 -23.163 -15.234 24.727 1.00 0.00 ATOM 346 CE2 TYR 46 -22.188 -15.653 26.872 1.00 0.00 ATOM 347 CZ TYR 46 -23.287 -15.636 26.043 1.00 0.00 ATOM 348 OH TYR 46 -24.489 -16.061 26.542 1.00 0.00 ATOM 349 O TYR 46 -20.373 -11.800 26.439 1.00 0.00 ATOM 350 C TYR 46 -19.367 -12.201 25.863 1.00 0.00 ATOM 351 N GLN 47 -18.151 -12.101 26.393 1.00 0.00 ATOM 352 CA GLN 47 -17.962 -11.512 27.720 1.00 0.00 ATOM 353 CB GLN 47 -16.516 -11.565 28.228 1.00 0.00 ATOM 354 CG GLN 47 -16.055 -13.012 28.439 1.00 0.00 ATOM 355 CD GLN 47 -16.895 -13.630 29.564 1.00 0.00 ATOM 356 OE1 GLN 47 -17.559 -14.723 29.241 1.00 0.00 ATOM 357 NE2 GLN 47 -16.922 -13.061 30.653 1.00 0.00 ATOM 358 O GLN 47 -19.050 -9.609 28.727 1.00 0.00 ATOM 359 C GLN 47 -18.452 -10.050 27.742 1.00 0.00 ATOM 360 N PHE 48 -18.219 -9.312 26.651 1.00 0.00 ATOM 361 CA PHE 48 -18.677 -7.916 26.527 1.00 0.00 ATOM 362 CB PHE 48 -18.091 -7.196 25.264 1.00 0.00 ATOM 363 CG PHE 48 -16.596 -7.174 25.173 1.00 0.00 ATOM 364 CD1 PHE 48 -15.966 -7.218 23.926 1.00 0.00 ATOM 365 CD2 PHE 48 -15.811 -7.048 26.313 1.00 0.00 ATOM 366 CE1 PHE 48 -14.598 -7.141 23.788 1.00 0.00 ATOM 367 CE2 PHE 48 -14.371 -6.965 26.217 1.00 0.00 ATOM 368 CZ PHE 48 -13.802 -7.020 24.933 1.00 0.00 ATOM 369 O PHE 48 -20.867 -6.950 26.926 1.00 0.00 ATOM 370 C PHE 48 -20.214 -7.868 26.413 1.00 0.00 ATOM 371 N SER 49 -20.786 -8.835 25.705 1.00 0.00 ATOM 372 CA SER 49 -22.240 -8.908 25.552 1.00 0.00 ATOM 373 CB SER 49 -22.759 -10.013 24.713 1.00 0.00 ATOM 374 OG SER 49 -22.660 -11.249 25.393 1.00 0.00 ATOM 375 O SER 49 -23.984 -8.392 27.135 1.00 0.00 ATOM 376 C SER 49 -22.921 -8.975 26.928 1.00 0.00 ATOM 377 N ASN 50 -22.277 -9.655 27.871 1.00 0.00 ATOM 378 CA ASN 50 -22.814 -9.821 29.216 1.00 0.00 ATOM 379 CB ASN 50 -22.476 -11.241 29.716 1.00 0.00 ATOM 380 CG ASN 50 -23.194 -12.318 28.923 1.00 0.00 ATOM 381 ND2 ASN 50 -22.536 -13.466 28.731 1.00 0.00 ATOM 382 OD1 ASN 50 -24.318 -12.105 28.455 1.00 0.00 ATOM 383 O ASN 50 -23.097 -8.428 31.131 1.00 0.00 ATOM 384 C ASN 50 -22.338 -8.797 30.236 1.00 0.00 ATOM 385 N ASP 51 -21.092 -8.336 30.113 1.00 0.00 ATOM 386 CA ASP 51 -20.540 -7.367 31.065 1.00 0.00 ATOM 387 CB ASP 51 -19.129 -7.652 31.476 1.00 0.00 ATOM 388 CG ASP 51 -18.984 -8.831 32.396 1.00 0.00 ATOM 389 OD1 ASP 51 -19.892 -9.049 33.215 1.00 0.00 ATOM 390 OD2 ASP 51 -17.963 -9.540 32.311 1.00 0.00 ATOM 391 O ASP 51 -20.571 -5.006 31.509 1.00 0.00 ATOM 392 C ASP 51 -20.567 -5.891 30.649 1.00 0.00 ATOM 393 N ASN 52 -20.599 -5.630 29.345 1.00 0.00 ATOM 394 CA ASN 52 -20.633 -4.257 28.849 1.00 0.00 ATOM 395 CB ASN 52 -21.531 -3.423 29.973 1.00 0.00 ATOM 396 CG ASN 52 -20.923 -3.353 31.362 1.00 0.00 ATOM 397 ND2 ASN 52 -20.183 -2.301 31.661 1.00 0.00 ATOM 398 OD1 ASN 52 -21.130 -4.280 32.155 1.00 0.00 ATOM 399 O ASN 52 -18.269 -4.049 29.264 1.00 0.00 ATOM 400 C ASN 52 -19.324 -3.485 28.970 1.00 0.00 ATOM 401 N HIS 53 -19.395 -2.180 28.737 1.00 0.00 ATOM 402 CA HIS 53 -18.213 -1.309 28.826 1.00 0.00 ATOM 403 CB HIS 53 -17.679 -1.015 27.379 1.00 0.00 ATOM 404 CG HIS 53 -17.075 -2.209 26.701 1.00 0.00 ATOM 405 CD2 HIS 53 -17.664 -3.175 25.955 1.00 0.00 ATOM 406 ND1 HIS 53 -15.738 -2.515 26.767 1.00 0.00 ATOM 407 CE1 HIS 53 -15.521 -3.637 26.079 1.00 0.00 ATOM 408 NE2 HIS 53 -16.666 -4.050 25.584 1.00 0.00 ATOM 409 O HIS 53 -19.740 0.495 29.171 1.00 0.00 ATOM 410 C HIS 53 -18.594 0.076 29.315 1.00 0.00 ATOM 411 N ALA 54 -17.631 0.779 29.910 1.00 0.00 ATOM 412 CA ALA 54 -17.859 2.148 30.357 1.00 0.00 ATOM 413 CB ALA 54 -16.772 2.638 31.331 1.00 0.00 ATOM 414 O ALA 54 -17.321 2.555 28.048 1.00 0.00 ATOM 415 C ALA 54 -17.780 3.017 29.099 1.00 0.00 ATOM 416 N TYR 55 -18.239 4.269 29.263 1.00 0.00 ATOM 417 CA TYR 55 -18.177 5.169 28.056 1.00 0.00 ATOM 418 CB TYR 55 -18.976 6.419 28.329 1.00 0.00 ATOM 419 CG TYR 55 -18.703 7.531 27.323 1.00 0.00 ATOM 420 CD1 TYR 55 -18.923 7.344 25.974 1.00 0.00 ATOM 421 CD2 TYR 55 -18.306 8.763 27.794 1.00 0.00 ATOM 422 CE1 TYR 55 -18.685 8.388 25.063 1.00 0.00 ATOM 423 CE2 TYR 55 -18.059 9.821 26.909 1.00 0.00 ATOM 424 CZ TYR 55 -18.268 9.590 25.580 1.00 0.00 ATOM 425 OH TYR 55 -18.008 10.679 24.742 1.00 0.00 ATOM 426 O TYR 55 -16.502 5.160 26.357 1.00 0.00 ATOM 427 C TYR 55 -16.750 5.367 27.535 1.00 0.00 ATOM 428 N PRO 56 -15.804 5.659 28.469 1.00 0.00 ATOM 429 CA PRO 56 -14.415 5.787 27.939 1.00 0.00 ATOM 430 CB PRO 56 -13.639 6.197 29.199 1.00 0.00 ATOM 431 CG PRO 56 -14.631 6.863 30.085 1.00 0.00 ATOM 432 CD PRO 56 -15.973 6.135 29.818 1.00 0.00 ATOM 433 O PRO 56 -13.248 4.621 26.183 1.00 0.00 ATOM 434 C PRO 56 -13.893 4.556 27.246 1.00 0.00 ATOM 435 N THR 57 -14.208 3.377 27.784 1.00 0.00 ATOM 436 CA THR 57 -13.761 2.118 27.188 1.00 0.00 ATOM 437 CB THR 57 -14.117 0.963 28.111 1.00 0.00 ATOM 438 CG2 THR 57 -13.693 -0.366 27.517 1.00 0.00 ATOM 439 OG1 THR 57 -13.390 1.176 29.353 1.00 0.00 ATOM 440 O THR 57 -13.736 1.507 24.867 1.00 0.00 ATOM 441 C THR 57 -14.394 1.941 25.811 1.00 0.00 ATOM 442 N GLY 58 -15.683 2.248 25.711 1.00 0.00 ATOM 443 CA GLY 58 -16.408 2.102 24.449 1.00 0.00 ATOM 444 O GLY 58 -15.870 2.703 22.182 1.00 0.00 ATOM 445 C GLY 58 -15.875 3.048 23.368 1.00 0.00 ATOM 446 N LEU 59 -15.463 4.244 23.785 1.00 0.00 ATOM 447 CA LEU 59 -14.918 5.253 22.881 1.00 0.00 ATOM 448 CB LEU 59 -14.703 6.579 23.576 1.00 0.00 ATOM 449 CG LEU 59 -14.029 7.629 22.681 1.00 0.00 ATOM 450 CD1 LEU 59 -14.941 7.992 21.511 1.00 0.00 ATOM 451 CD2 LEU 59 -13.691 8.831 23.503 1.00 0.00 ATOM 452 O LEU 59 -13.395 4.813 21.067 1.00 0.00 ATOM 453 C LEU 59 -13.607 4.741 22.278 1.00 0.00 ATOM 454 N VAL 60 -12.741 4.212 23.136 1.00 0.00 ATOM 455 CA VAL 60 -11.457 3.659 22.726 1.00 0.00 ATOM 456 CB VAL 60 -10.676 3.223 24.022 1.00 0.00 ATOM 457 CG1 VAL 60 -9.421 2.448 23.661 1.00 0.00 ATOM 458 CG2 VAL 60 -10.306 4.473 24.834 1.00 0.00 ATOM 459 O VAL 60 -10.845 2.257 20.865 1.00 0.00 ATOM 460 C VAL 60 -11.629 2.451 21.800 1.00 0.00 ATOM 461 N GLN 61 -12.647 1.631 22.064 1.00 0.00 ATOM 462 CA GLN 61 -12.911 0.454 21.240 1.00 0.00 ATOM 463 CB GLN 61 -13.979 -0.417 21.911 1.00 0.00 ATOM 464 CG GLN 61 -14.252 -1.692 21.126 1.00 0.00 ATOM 465 CD GLN 61 -15.306 -2.512 21.849 1.00 0.00 ATOM 466 OE1 GLN 61 -16.230 -1.951 22.436 1.00 0.00 ATOM 467 NE2 GLN 61 -15.128 -3.823 21.805 1.00 0.00 ATOM 468 O GLN 61 -12.897 0.325 18.847 1.00 0.00 ATOM 469 C GLN 61 -13.308 0.914 19.841 1.00 0.00 ATOM 470 N PRO 62 -14.090 1.989 19.778 1.00 0.00 ATOM 471 CA PRO 62 -14.551 2.560 18.515 1.00 0.00 ATOM 472 CB PRO 62 -15.554 3.605 18.882 1.00 0.00 ATOM 473 CG PRO 62 -16.103 3.127 20.191 1.00 0.00 ATOM 474 CD PRO 62 -14.900 2.538 20.905 1.00 0.00 ATOM 475 O PRO 62 -13.284 2.834 16.487 1.00 0.00 ATOM 476 C PRO 62 -13.390 3.121 17.679 1.00 0.00 ATOM 477 N VAL 63 -12.515 3.899 18.311 1.00 0.00 ATOM 478 CA VAL 63 -11.378 4.492 17.609 1.00 0.00 ATOM 479 CB VAL 63 -10.640 5.468 18.592 1.00 0.00 ATOM 480 CG1 VAL 63 -9.342 5.959 17.976 1.00 0.00 ATOM 481 CG2 VAL 63 -11.549 6.661 18.918 1.00 0.00 ATOM 482 O VAL 63 -9.879 3.561 16.009 1.00 0.00 ATOM 483 C VAL 63 -10.408 3.438 17.113 1.00 0.00 ATOM 484 N THR 64 -10.212 2.384 17.905 1.00 0.00 ATOM 485 CA THR 64 -9.322 1.292 17.514 1.00 0.00 ATOM 486 CB THR 64 -9.247 0.331 18.737 1.00 0.00 ATOM 487 CG2 THR 64 -8.370 -0.870 18.438 1.00 0.00 ATOM 488 OG1 THR 64 -8.650 1.088 19.827 1.00 0.00 ATOM 489 O THR 64 -9.066 0.093 15.451 1.00 0.00 ATOM 490 C THR 64 -9.849 0.575 16.272 1.00 0.00 ATOM 491 N GLU 65 -11.169 0.506 16.131 1.00 0.00 ATOM 492 CA GLU 65 -11.765 -0.133 14.964 1.00 0.00 ATOM 493 CB GLU 65 -13.258 -0.394 15.204 1.00 0.00 ATOM 494 CG GLU 65 -13.510 -1.711 15.941 1.00 0.00 ATOM 495 CD GLU 65 -14.963 -1.929 16.333 1.00 0.00 ATOM 496 OE1 GLU 65 -15.830 -1.134 15.916 1.00 0.00 ATOM 497 OE2 GLU 65 -15.241 -2.904 17.063 1.00 0.00 ATOM 498 O GLU 65 -11.461 0.226 12.612 1.00 0.00 ATOM 499 C GLU 65 -11.558 0.735 13.726 1.00 0.00 ATOM 500 N LEU 66 -11.475 2.045 13.930 1.00 0.00 ATOM 501 CA LEU 66 -11.262 2.972 12.827 1.00 0.00 ATOM 502 CB LEU 66 -11.563 4.410 13.270 1.00 0.00 ATOM 503 CG LEU 66 -13.010 4.905 13.136 1.00 0.00 ATOM 504 CD1 LEU 66 -13.111 6.333 13.648 1.00 0.00 ATOM 505 CD2 LEU 66 -13.452 4.832 11.683 1.00 0.00 ATOM 506 O LEU 66 -9.543 2.997 11.154 1.00 0.00 ATOM 507 C LEU 66 -9.816 2.870 12.347 1.00 0.00 ATOM 508 N TYR 67 -8.889 2.645 13.264 1.00 0.00 ATOM 509 CA TYR 67 -7.464 2.519 12.953 1.00 0.00 ATOM 510 CB TYR 67 -6.699 2.416 14.334 1.00 0.00 ATOM 511 CG TYR 67 -6.790 3.666 15.183 1.00 0.00 ATOM 512 CD1 TYR 67 -6.174 4.853 14.803 1.00 0.00 ATOM 513 CD2 TYR 67 -7.482 3.671 16.382 1.00 0.00 ATOM 514 CE1 TYR 67 -6.247 6.002 15.578 1.00 0.00 ATOM 515 CE2 TYR 67 -7.577 4.805 17.176 1.00 0.00 ATOM 516 CZ TYR 67 -6.958 5.964 16.767 1.00 0.00 ATOM 517 OH TYR 67 -7.053 7.092 17.558 1.00 0.00 ATOM 518 O TYR 67 -6.094 1.324 11.404 1.00 0.00 ATOM 519 C TYR 67 -7.130 1.324 12.066 1.00 0.00 ATOM 520 N GLU 68 -7.971 0.283 12.103 1.00 0.00 ATOM 521 CA GLU 68 -7.726 -0.911 11.312 1.00 0.00 ATOM 522 CB GLU 68 -8.814 -1.954 11.572 1.00 0.00 ATOM 523 CG GLU 68 -8.770 -2.512 12.980 1.00 0.00 ATOM 524 CD GLU 68 -7.398 -3.052 13.341 1.00 0.00 ATOM 525 OE1 GLU 68 -6.883 -3.917 12.601 1.00 0.00 ATOM 526 OE2 GLU 68 -6.834 -2.613 14.365 1.00 0.00 ATOM 527 O GLU 68 -6.940 -1.256 9.083 1.00 0.00 ATOM 528 C GLU 68 -7.650 -0.586 9.832 1.00 0.00 ATOM 529 N GLN 69 -8.375 0.446 9.411 1.00 0.00 ATOM 530 CA GLN 69 -8.355 0.843 8.008 1.00 0.00 ATOM 531 CB GLN 69 -9.324 1.993 7.754 1.00 0.00 ATOM 532 CG GLN 69 -10.772 1.583 7.653 1.00 0.00 ATOM 533 CD GLN 69 -11.680 2.777 7.485 1.00 0.00 ATOM 534 OE1 GLN 69 -11.973 3.488 8.446 1.00 0.00 ATOM 535 NE2 GLN 69 -12.117 3.019 6.255 1.00 0.00 ATOM 536 O GLN 69 -6.523 1.079 6.491 1.00 0.00 ATOM 537 C GLN 69 -6.952 1.282 7.621 1.00 0.00 ATOM 538 N ILE 70 -6.252 1.898 8.579 1.00 0.00 ATOM 539 CA ILE 70 -4.893 2.335 8.278 1.00 0.00 ATOM 540 CB ILE 70 -4.362 3.218 9.436 1.00 0.00 ATOM 541 CG1 ILE 70 -5.215 4.480 9.582 1.00 0.00 ATOM 542 CG2 ILE 70 -2.900 3.506 9.214 1.00 0.00 ATOM 543 CD1 ILE 70 -4.750 5.417 10.676 1.00 0.00 ATOM 544 O ILE 70 -3.187 1.146 7.107 1.00 0.00 ATOM 545 C ILE 70 -3.994 1.150 8.017 1.00 0.00 ATOM 546 N SER 71 -4.125 0.103 8.826 1.00 0.00 ATOM 547 CA SER 71 -3.317 -1.104 8.661 1.00 0.00 ATOM 548 CB SER 71 -3.760 -1.953 9.935 1.00 0.00 ATOM 549 OG SER 71 -3.182 -1.349 11.091 1.00 0.00 ATOM 550 O SER 71 -2.947 -2.741 6.936 1.00 0.00 ATOM 551 C SER 71 -3.670 -1.841 7.367 1.00 0.00 ATOM 552 N GLN 72 -4.813 -1.512 6.788 1.00 0.00 ATOM 553 CA GLN 72 -5.247 -2.128 5.539 1.00 0.00 ATOM 554 CB GLN 72 -6.653 -1.576 5.159 1.00 0.00 ATOM 555 CG GLN 72 -7.333 -2.102 3.887 1.00 0.00 ATOM 556 CD GLN 72 -8.258 -1.094 3.217 1.00 0.00 ATOM 557 OE1 GLN 72 -8.595 -0.027 3.758 1.00 0.00 ATOM 558 NE2 GLN 72 -8.674 -1.422 1.997 1.00 0.00 ATOM 559 O GLN 72 -3.747 -2.556 3.718 1.00 0.00 ATOM 560 C GLN 72 -4.230 -1.729 4.482 1.00 0.00 ATOM 561 N THR 73 -3.870 -0.445 4.406 1.00 0.00 ATOM 562 CA THR 73 -2.879 -0.064 3.415 1.00 0.00 ATOM 563 CB THR 73 -2.642 1.454 3.517 1.00 0.00 ATOM 564 CG2 THR 73 -1.582 2.081 2.641 1.00 0.00 ATOM 565 OG1 THR 73 -3.859 2.075 3.239 1.00 0.00 ATOM 566 O THR 73 -0.909 -1.266 2.731 1.00 0.00 ATOM 567 C THR 73 -1.578 -0.817 3.656 1.00 0.00 ATOM 568 N LEU 74 -1.176 -0.989 4.906 1.00 0.00 ATOM 569 CA LEU 74 0.121 -1.604 5.123 1.00 0.00 ATOM 570 CB LEU 74 0.461 -1.585 6.621 1.00 0.00 ATOM 571 CG LEU 74 0.712 -0.164 7.140 1.00 0.00 ATOM 572 CD1 LEU 74 0.909 -0.214 8.651 1.00 0.00 ATOM 573 CD2 LEU 74 1.941 0.433 6.468 1.00 0.00 ATOM 574 O LEU 74 1.414 -3.438 4.237 1.00 0.00 ATOM 575 C LEU 74 0.302 -2.977 4.482 1.00 0.00 ATOM 576 N SER 75 -0.820 -3.645 4.267 1.00 0.00 ATOM 577 CA SER 75 -0.824 -4.997 3.693 1.00 0.00 ATOM 578 CB SER 75 -2.268 -5.538 3.603 1.00 0.00 ATOM 579 OG SER 75 -3.071 -4.589 2.936 1.00 0.00 ATOM 580 O SER 75 0.638 -5.852 2.003 1.00 0.00 ATOM 581 C SER 75 -0.179 -4.973 2.327 1.00 0.00 ATOM 582 N ASP 76 -0.548 -3.998 1.497 1.00 0.00 ATOM 583 CA ASP 76 0.060 -3.889 0.171 1.00 0.00 ATOM 584 CB ASP 76 -0.521 -2.709 -0.609 1.00 0.00 ATOM 585 CG ASP 76 -1.891 -3.003 -1.216 1.00 0.00 ATOM 586 OD1 ASP 76 -2.334 -4.178 -1.188 1.00 0.00 ATOM 587 OD2 ASP 76 -2.522 -2.045 -1.729 1.00 0.00 ATOM 588 O ASP 76 2.367 -4.302 -0.347 1.00 0.00 ATOM 589 C ASP 76 1.564 -3.666 0.322 1.00 0.00 ATOM 590 N VAL 77 1.946 -2.735 1.191 1.00 0.00 ATOM 591 CA VAL 77 3.358 -2.453 1.386 1.00 0.00 ATOM 592 CB VAL 77 3.552 -1.206 2.289 1.00 0.00 ATOM 593 CG1 VAL 77 5.027 -0.999 2.609 1.00 0.00 ATOM 594 CG2 VAL 77 3.001 0.015 1.573 1.00 0.00 ATOM 595 O VAL 77 5.207 -3.932 1.588 1.00 0.00 ATOM 596 C VAL 77 4.077 -3.654 1.963 1.00 0.00 ATOM 597 N GLU 78 3.428 -4.395 2.858 1.00 0.00 ATOM 598 CA GLU 78 4.086 -5.570 3.417 1.00 0.00 ATOM 599 CB GLU 78 3.227 -6.218 4.507 1.00 0.00 ATOM 600 CG GLU 78 3.365 -5.540 5.852 1.00 0.00 ATOM 601 CD GLU 78 4.822 -5.346 6.257 1.00 0.00 ATOM 602 OE1 GLU 78 5.592 -6.336 6.242 1.00 0.00 ATOM 603 OE2 GLU 78 5.195 -4.201 6.595 1.00 0.00 ATOM 604 O GLU 78 5.486 -7.203 2.365 1.00 0.00 ATOM 605 C GLU 78 4.412 -6.601 2.342 1.00 0.00 ATOM 606 N GLY 79 3.495 -6.824 1.404 1.00 0.00 ATOM 607 CA GLY 79 3.756 -7.779 0.331 1.00 0.00 ATOM 608 O GLY 79 3.860 -7.938 -2.059 1.00 0.00 ATOM 609 C GLY 79 3.692 -7.206 -1.083 1.00 0.00 ATOM 610 N PHE 80 3.471 -5.907 -1.214 1.00 0.00 ATOM 611 CA PHE 80 3.384 -5.279 -2.516 1.00 0.00 ATOM 612 CB PHE 80 1.933 -4.859 -2.815 1.00 0.00 ATOM 613 CG PHE 80 1.001 -6.026 -2.971 1.00 0.00 ATOM 614 CD1 PHE 80 1.155 -6.913 -4.036 1.00 0.00 ATOM 615 CD2 PHE 80 0.007 -6.278 -2.026 1.00 0.00 ATOM 616 CE1 PHE 80 0.336 -8.036 -4.153 1.00 0.00 ATOM 617 CE2 PHE 80 -0.821 -7.404 -2.141 1.00 0.00 ATOM 618 CZ PHE 80 -0.655 -8.275 -3.197 1.00 0.00 ATOM 619 O PHE 80 4.580 -3.467 -1.527 1.00 0.00 ATOM 620 C PHE 80 4.321 -4.091 -2.556 1.00 0.00 ATOM 621 N THR 81 4.789 -3.775 -3.754 1.00 0.00 ATOM 622 CA THR 81 5.713 -2.678 -3.966 1.00 0.00 ATOM 623 CB THR 81 7.098 -3.244 -4.397 1.00 0.00 ATOM 624 CG2 THR 81 8.084 -2.132 -4.674 1.00 0.00 ATOM 625 OG1 THR 81 7.622 -4.062 -3.347 1.00 0.00 ATOM 626 O THR 81 4.904 -2.065 -6.145 1.00 0.00 ATOM 627 C THR 81 5.224 -1.679 -5.024 1.00 0.00 ATOM 628 N PHE 82 5.160 -0.406 -4.649 1.00 0.00 ATOM 629 CA PHE 82 4.779 0.673 -5.563 1.00 0.00 ATOM 630 CB PHE 82 3.679 1.553 -4.954 1.00 0.00 ATOM 631 CG PHE 82 2.363 0.857 -4.791 1.00 0.00 ATOM 632 CD1 PHE 82 1.440 0.830 -5.835 1.00 0.00 ATOM 633 CD2 PHE 82 2.043 0.212 -3.595 1.00 0.00 ATOM 634 CE1 PHE 82 0.219 0.167 -5.686 1.00 0.00 ATOM 635 CE2 PHE 82 0.824 -0.456 -3.440 1.00 0.00 ATOM 636 CZ PHE 82 -0.084 -0.475 -4.487 1.00 0.00 ATOM 637 O PHE 82 6.497 2.182 -4.837 1.00 0.00 ATOM 638 C PHE 82 6.034 1.534 -5.772 1.00 0.00 ATOM 639 N GLU 83 6.609 1.512 -6.974 1.00 0.00 ATOM 640 CA GLU 83 7.792 2.318 -7.258 1.00 0.00 ATOM 641 CB GLU 83 8.339 1.791 -8.647 1.00 0.00 ATOM 642 CG GLU 83 7.418 2.003 -9.842 1.00 0.00 ATOM 643 CD GLU 83 8.012 1.472 -11.135 1.00 0.00 ATOM 644 OE1 GLU 83 9.142 0.935 -11.113 1.00 0.00 ATOM 645 OE2 GLU 83 7.334 1.597 -12.177 1.00 0.00 ATOM 646 O GLU 83 8.379 4.631 -7.452 1.00 0.00 ATOM 647 C GLU 83 7.473 3.809 -7.330 1.00 0.00 ATOM 648 N LEU 84 6.190 4.158 -7.250 1.00 0.00 ATOM 649 CA LEU 84 5.776 5.557 -7.299 1.00 0.00 ATOM 650 CB LEU 84 4.355 5.421 -8.084 1.00 0.00 ATOM 651 CG LEU 84 4.512 5.108 -9.576 1.00 0.00 ATOM 652 CD1 LEU 84 3.155 4.868 -10.200 1.00 0.00 ATOM 653 CD2 LEU 84 5.218 6.268 -10.266 1.00 0.00 ATOM 654 O LEU 84 5.442 7.356 -5.755 1.00 0.00 ATOM 655 C LEU 84 5.602 6.145 -5.903 1.00 0.00 ATOM 656 N GLY 85 5.628 5.295 -4.877 1.00 0.00 ATOM 657 CA GLY 85 5.487 5.783 -3.511 1.00 0.00 ATOM 658 O GLY 85 6.351 5.355 -1.312 1.00 0.00 ATOM 659 C GLY 85 6.442 5.126 -2.515 1.00 0.00 ATOM 660 N LEU 86 7.378 4.332 -3.026 1.00 0.00 ATOM 661 CA LEU 86 8.362 3.667 -2.179 1.00 0.00 ATOM 662 CB LEU 86 7.979 2.222 -1.931 1.00 0.00 ATOM 663 CG LEU 86 6.678 1.981 -1.160 1.00 0.00 ATOM 664 CD1 LEU 86 6.321 0.503 -1.185 1.00 0.00 ATOM 665 CD2 LEU 86 6.823 2.467 0.281 1.00 0.00 ATOM 666 O LEU 86 9.859 3.617 -4.051 1.00 0.00 ATOM 667 C LEU 86 9.740 3.721 -2.832 1.00 0.00 ATOM 668 N THR 87 10.778 3.898 -2.022 1.00 0.00 ATOM 669 CA THR 87 12.137 3.920 -2.545 1.00 0.00 ATOM 670 CB THR 87 13.077 4.733 -1.652 1.00 0.00 ATOM 671 CG2 THR 87 12.570 6.168 -1.536 1.00 0.00 ATOM 672 OG1 THR 87 13.158 4.124 -0.353 1.00 0.00 ATOM 673 O THR 87 12.074 1.612 -1.879 1.00 0.00 ATOM 674 C THR 87 12.638 2.477 -2.555 1.00 0.00 ATOM 675 N GLU 88 13.690 2.220 -3.325 1.00 0.00 ATOM 676 CA GLU 88 14.255 0.878 -3.445 1.00 0.00 ATOM 677 CB GLU 88 15.597 0.932 -4.229 1.00 0.00 ATOM 678 CG GLU 88 15.499 1.437 -5.668 1.00 0.00 ATOM 679 CD GLU 88 14.402 0.740 -6.452 1.00 0.00 ATOM 680 OE1 GLU 88 14.309 -0.500 -6.362 1.00 0.00 ATOM 681 OE2 GLU 88 13.633 1.430 -7.156 1.00 0.00 ATOM 682 O GLU 88 14.186 -1.052 -2.036 1.00 0.00 ATOM 683 C GLU 88 14.493 0.137 -2.133 1.00 0.00 ATOM 684 N ASP 89 15.045 0.822 -1.135 1.00 0.00 ATOM 685 CA ASP 89 15.315 0.193 0.158 1.00 0.00 ATOM 686 CB ASP 89 16.066 1.175 1.076 1.00 0.00 ATOM 687 CG ASP 89 16.678 0.482 2.302 1.00 0.00 ATOM 688 OD1 ASP 89 17.453 -0.494 2.135 1.00 0.00 ATOM 689 OD2 ASP 89 16.399 0.935 3.432 1.00 0.00 ATOM 690 O ASP 89 14.056 -1.337 1.524 1.00 0.00 ATOM 691 C ASP 89 14.044 -0.302 0.852 1.00 0.00 ATOM 692 N GLU 90 12.957 0.444 0.700 1.00 0.00 ATOM 693 CA GLU 90 11.685 0.073 1.308 1.00 0.00 ATOM 694 CB GLU 90 10.661 1.188 1.252 1.00 0.00 ATOM 695 CG GLU 90 11.015 2.293 2.221 1.00 0.00 ATOM 696 CD GLU 90 10.096 3.495 2.144 1.00 0.00 ATOM 697 OE1 GLU 90 9.025 3.412 1.494 1.00 0.00 ATOM 698 OE2 GLU 90 10.492 4.503 2.771 1.00 0.00 ATOM 699 O GLU 90 10.530 -2.032 1.216 1.00 0.00 ATOM 700 C GLU 90 11.091 -1.137 0.587 1.00 0.00 ATOM 701 N ASN 91 11.210 -1.156 -0.735 1.00 0.00 ATOM 702 CA ASN 91 10.692 -2.273 -1.513 1.00 0.00 ATOM 703 CB ASN 91 10.643 -2.138 -2.999 1.00 0.00 ATOM 704 CG ASN 91 9.646 -1.095 -3.456 1.00 0.00 ATOM 705 ND2 ASN 91 9.873 -0.458 -4.608 1.00 0.00 ATOM 706 OD1 ASN 91 8.591 -0.917 -2.846 1.00 0.00 ATOM 707 O ASN 91 10.838 -4.631 -1.041 1.00 0.00 ATOM 708 C ASN 91 11.434 -3.553 -1.118 1.00 0.00 ATOM 709 N VAL 92 12.734 -3.426 -0.854 1.00 0.00 ATOM 710 CA VAL 92 13.509 -4.602 -0.451 1.00 0.00 ATOM 711 CB VAL 92 15.016 -4.271 -0.317 1.00 0.00 ATOM 712 CG1 VAL 92 15.767 -5.486 0.221 1.00 0.00 ATOM 713 CG2 VAL 92 15.586 -3.871 -1.678 1.00 0.00 ATOM 714 O VAL 92 12.728 -6.347 1.043 1.00 0.00 ATOM 715 C VAL 92 12.946 -5.136 0.875 1.00 0.00 ATOM 716 N PHE 93 12.640 -4.219 1.794 1.00 0.00 ATOM 717 CA PHE 93 12.087 -4.622 3.079 1.00 0.00 ATOM 718 CB PHE 93 11.963 -3.434 4.027 1.00 0.00 ATOM 719 CG PHE 93 11.538 -3.827 5.413 1.00 0.00 ATOM 720 CD1 PHE 93 12.225 -4.834 6.107 1.00 0.00 ATOM 721 CD2 PHE 93 10.449 -3.214 6.026 1.00 0.00 ATOM 722 CE1 PHE 93 11.835 -5.209 7.386 1.00 0.00 ATOM 723 CE2 PHE 93 10.058 -3.591 7.312 1.00 0.00 ATOM 724 CZ PHE 93 10.751 -4.592 7.989 1.00 0.00 ATOM 725 O PHE 93 10.436 -6.312 3.569 1.00 0.00 ATOM 726 C PHE 93 10.718 -5.312 2.919 1.00 0.00 ATOM 727 N THR 94 9.874 -4.783 2.047 1.00 0.00 ATOM 728 CA THR 94 8.552 -5.356 1.794 1.00 0.00 ATOM 729 CB THR 94 7.765 -4.500 0.842 1.00 0.00 ATOM 730 CG2 THR 94 6.404 -5.102 0.552 1.00 0.00 ATOM 731 OG1 THR 94 7.580 -3.211 1.490 1.00 0.00 ATOM 732 O THR 94 8.014 -7.705 1.674 1.00 0.00 ATOM 733 C THR 94 8.715 -6.778 1.254 1.00 0.00 ATOM 734 N GLN 95 9.651 -6.935 0.318 1.00 0.00 ATOM 735 CA GLN 95 9.942 -8.231 -0.284 1.00 0.00 ATOM 736 CB GLN 95 11.032 -8.140 -1.330 1.00 0.00 ATOM 737 CG GLN 95 10.623 -7.421 -2.602 1.00 0.00 ATOM 738 CD GLN 95 11.768 -7.338 -3.590 1.00 0.00 ATOM 739 OE1 GLN 95 12.173 -8.343 -4.166 1.00 0.00 ATOM 740 NE2 GLN 95 12.321 -6.143 -3.760 1.00 0.00 ATOM 741 O GLN 95 9.919 -10.381 0.774 1.00 0.00 ATOM 742 C GLN 95 10.362 -9.238 0.778 1.00 0.00 ATOM 743 N ALA 96 11.235 -8.804 1.680 1.00 0.00 ATOM 744 CA ALA 96 11.727 -9.669 2.748 1.00 0.00 ATOM 745 CB ALA 96 12.794 -8.928 3.554 1.00 0.00 ATOM 746 O ALA 96 10.449 -11.318 3.959 1.00 0.00 ATOM 747 C ALA 96 10.586 -10.125 3.667 1.00 0.00 ATOM 748 N ASP 97 9.769 -9.180 4.119 1.00 0.00 ATOM 749 CA ASP 97 8.655 -9.523 4.997 1.00 0.00 ATOM 750 CB ASP 97 7.872 -8.273 5.405 1.00 0.00 ATOM 751 CG ASP 97 8.682 -7.326 6.284 1.00 0.00 ATOM 752 OD1 ASP 97 9.812 -7.684 6.693 1.00 0.00 ATOM 753 OD2 ASP 97 8.174 -6.220 6.577 1.00 0.00 ATOM 754 O ASP 97 7.268 -11.477 4.895 1.00 0.00 ATOM 755 C ASP 97 7.710 -10.500 4.297 1.00 0.00 ATOM 756 N SER 98 7.404 -10.225 3.033 1.00 0.00 ATOM 757 CA SER 98 6.515 -11.072 2.251 1.00 0.00 ATOM 758 CB SER 98 6.245 -10.427 0.890 1.00 0.00 ATOM 759 OG SER 98 5.568 -9.190 1.047 1.00 0.00 ATOM 760 O SER 98 6.438 -13.463 2.404 1.00 0.00 ATOM 761 C SER 98 7.081 -12.472 2.055 1.00 0.00 ATOM 762 N LEU 99 8.290 -12.536 1.492 1.00 0.00 ATOM 763 CA LEU 99 8.925 -13.821 1.251 1.00 0.00 ATOM 764 CB LEU 99 10.200 -13.643 0.444 1.00 0.00 ATOM 765 CG LEU 99 10.023 -13.420 -1.059 1.00 0.00 ATOM 766 CD1 LEU 99 11.362 -13.108 -1.638 1.00 0.00 ATOM 767 CD2 LEU 99 9.480 -14.628 -1.751 1.00 0.00 ATOM 768 O LEU 99 9.008 -15.733 2.689 1.00 0.00 ATOM 769 C LEU 99 9.229 -14.525 2.559 1.00 0.00 ATOM 770 N SER 100 9.635 -13.760 3.572 1.00 0.00 ATOM 771 CA SER 100 9.846 -14.300 4.920 1.00 0.00 ATOM 772 CB SER 100 10.330 -13.239 5.914 1.00 0.00 ATOM 773 OG SER 100 11.499 -12.600 5.455 1.00 0.00 ATOM 774 O SER 100 8.628 -15.994 6.111 1.00 0.00 ATOM 775 C SER 100 8.584 -14.885 5.559 1.00 0.00 ATOM 776 N ASP 101 7.464 -14.163 5.488 1.00 0.00 ATOM 777 CA ASP 101 6.199 -14.556 6.063 1.00 0.00 ATOM 778 CB ASP 101 5.235 -13.373 5.930 1.00 0.00 ATOM 779 CG ASP 101 5.404 -12.281 6.984 1.00 0.00 ATOM 780 OD1 ASP 101 6.163 -12.386 7.944 1.00 0.00 ATOM 781 OD2 ASP 101 4.767 -11.249 6.924 1.00 0.00 ATOM 782 O ASP 101 5.183 -16.759 5.999 1.00 0.00 ATOM 783 C ASP 101 5.649 -15.800 5.361 1.00 0.00 ATOM 784 N TRP 102 5.765 -15.846 4.036 1.00 0.00 ATOM 785 CA TRP 102 5.324 -17.009 3.259 1.00 0.00 ATOM 786 CB TRP 102 5.367 -16.745 1.770 1.00 0.00 ATOM 787 CG TRP 102 4.496 -15.598 1.329 1.00 0.00 ATOM 788 CD1 TRP 102 3.408 -15.093 1.983 1.00 0.00 ATOM 789 CD2 TRP 102 4.618 -14.848 0.113 1.00 0.00 ATOM 790 CE2 TRP 102 3.564 -13.903 0.099 1.00 0.00 ATOM 791 CE3 TRP 102 5.512 -14.881 -0.967 1.00 0.00 ATOM 792 NE1 TRP 102 2.843 -14.076 1.250 1.00 0.00 ATOM 793 CZ2 TRP 102 3.382 -12.999 -0.958 1.00 0.00 ATOM 794 CZ3 TRP 102 5.331 -13.982 -2.018 1.00 0.00 ATOM 795 CH2 TRP 102 4.272 -13.053 -2.001 1.00 0.00 ATOM 796 O TRP 102 5.603 -19.387 3.556 1.00 0.00 ATOM 797 C TRP 102 6.140 -18.275 3.570 1.00 0.00 ATOM 798 N ALA 103 7.423 -18.107 3.860 1.00 0.00 ATOM 799 CA ALA 103 8.284 -19.220 4.192 1.00 0.00 ATOM 800 CB ALA 103 9.749 -18.810 4.146 1.00 0.00 ATOM 801 O ALA 103 7.876 -21.029 5.700 1.00 0.00 ATOM 802 C ALA 103 7.922 -19.811 5.554 1.00 0.00 ATOM 803 N ASN 104 7.661 -18.979 6.561 1.00 0.00 ATOM 804 CA ASN 104 7.225 -19.501 7.856 1.00 0.00 ATOM 805 CB ASN 104 7.123 -18.415 8.898 1.00 0.00 ATOM 806 CG ASN 104 8.408 -18.169 9.652 1.00 0.00 ATOM 807 ND2 ASN 104 8.614 -16.924 10.078 1.00 0.00 ATOM 808 OD1 ASN 104 9.191 -19.109 9.885 1.00 0.00 ATOM 809 O ASN 104 5.718 -21.310 8.303 1.00 0.00 ATOM 810 C ASN 104 5.900 -20.256 7.706 1.00 0.00 ATOM 811 N GLN 105 4.963 -19.710 6.941 1.00 0.00 ATOM 812 CA GLN 105 3.671 -20.344 6.766 1.00 0.00 ATOM 813 CB GLN 105 2.751 -19.428 5.990 1.00 0.00 ATOM 814 CG GLN 105 1.401 -19.970 5.724 1.00 0.00 ATOM 815 CD GLN 105 0.520 -18.947 5.067 1.00 0.00 ATOM 816 OE1 GLN 105 -0.380 -18.361 5.719 1.00 0.00 ATOM 817 NE2 GLN 105 0.781 -18.662 3.796 1.00 0.00 ATOM 818 O GLN 105 3.183 -22.670 6.407 1.00 0.00 ATOM 819 C GLN 105 3.822 -21.677 6.035 1.00 0.00 ATOM 820 N PHE 106 4.679 -21.742 5.034 1.00 0.00 ATOM 821 CA PHE 106 4.926 -22.982 4.305 1.00 0.00 ATOM 822 CB PHE 106 5.872 -22.789 3.138 1.00 0.00 ATOM 823 CG PHE 106 5.310 -21.906 2.003 1.00 0.00 ATOM 824 CD1 PHE 106 3.957 -21.547 1.947 1.00 0.00 ATOM 825 CD2 PHE 106 6.175 -21.455 1.005 1.00 0.00 ATOM 826 CE1 PHE 106 3.496 -20.751 0.906 1.00 0.00 ATOM 827 CE2 PHE 106 5.703 -20.659 -0.035 1.00 0.00 ATOM 828 CZ PHE 106 4.363 -20.304 -0.083 1.00 0.00 ATOM 829 O PHE 106 4.944 -25.196 5.254 1.00 0.00 ATOM 830 C PHE 106 5.439 -24.069 5.254 1.00 0.00 ATOM 831 N LEU 107 6.389 -23.703 6.103 1.00 0.00 ATOM 832 CA LEU 107 6.971 -24.621 7.064 1.00 0.00 ATOM 833 CB LEU 107 7.942 -23.863 7.982 1.00 0.00 ATOM 834 CG LEU 107 9.221 -23.369 7.298 1.00 0.00 ATOM 835 CD1 LEU 107 10.020 -22.508 8.251 1.00 0.00 ATOM 836 CD2 LEU 107 10.046 -24.564 6.839 1.00 0.00 ATOM 837 O LEU 107 6.029 -26.500 8.175 1.00 0.00 ATOM 838 C LEU 107 5.904 -25.314 7.892 1.00 0.00 ATOM 839 N LEU 108 4.861 -24.589 8.281 1.00 0.00 ATOM 840 CA LEU 108 3.779 -25.156 9.065 1.00 0.00 ATOM 841 CB LEU 108 3.148 -26.270 8.116 1.00 0.00 ATOM 842 CG LEU 108 2.456 -25.727 6.861 1.00 0.00 ATOM 843 CD1 LEU 108 1.930 -26.877 6.014 1.00 0.00 ATOM 844 CD2 LEU 108 1.337 -24.756 7.207 1.00 0.00 ATOM 845 O LEU 108 3.900 -26.966 10.689 1.00 0.00 ATOM 846 C LEU 108 4.277 -25.818 10.365 1.00 0.00 ATOM 847 N GLY 109 5.059 -25.071 11.129 1.00 0.00 ATOM 848 CA GLY 109 5.595 -25.568 12.383 1.00 0.00 ATOM 849 O GLY 109 3.835 -24.288 13.458 1.00 0.00 ATOM 850 C GLY 109 4.757 -25.082 13.566 1.00 0.00 ATOM 851 N ILE 110 5.106 -25.596 14.730 1.00 0.00 ATOM 852 CA ILE 110 4.516 -25.259 15.985 1.00 0.00 ATOM 853 CB ILE 110 4.476 -26.546 16.951 1.00 0.00 ATOM 854 CG1 ILE 110 5.913 -27.000 17.307 1.00 0.00 ATOM 855 CG2 ILE 110 3.627 -27.655 16.279 1.00 0.00 ATOM 856 CD1 ILE 110 5.988 -28.058 18.443 1.00 0.00 ATOM 857 O ILE 110 4.584 -23.709 17.775 1.00 0.00 ATOM 858 C ILE 110 5.164 -24.076 16.706 1.00 0.00 ATOM 859 N GLY 111 6.234 -23.518 16.168 1.00 0.00 ATOM 860 CA GLY 111 6.891 -22.422 16.862 1.00 0.00 ATOM 861 O GLY 111 8.557 -22.572 15.165 1.00 0.00 ATOM 862 C GLY 111 8.253 -22.119 16.272 1.00 0.00 ATOM 863 N LEU 112 9.053 -21.333 16.973 1.00 0.00 ATOM 864 CA LEU 112 10.390 -20.951 16.522 1.00 0.00 ATOM 865 CB LEU 112 10.631 -19.512 16.951 1.00 0.00 ATOM 866 CG LEU 112 9.614 -18.497 16.474 1.00 0.00 ATOM 867 CD1 LEU 112 10.086 -17.117 16.953 1.00 0.00 ATOM 868 CD2 LEU 112 9.570 -18.482 14.935 1.00 0.00 ATOM 869 O LEU 112 11.273 -22.486 18.151 1.00 0.00 ATOM 870 C LEU 112 11.511 -21.898 17.127 1.00 0.00 ATOM 871 N ALA 113 12.578 -21.970 16.367 1.00 0.00 ATOM 872 CA ALA 113 13.719 -22.839 16.662 1.00 0.00 ATOM 873 CB ALA 113 14.639 -22.830 15.463 1.00 0.00 ATOM 874 O ALA 113 15.007 -23.034 18.636 1.00 0.00 ATOM 875 C ALA 113 14.428 -22.254 17.874 1.00 0.00 ATOM 876 N GLN 114 14.388 -20.971 18.023 1.00 0.00 ATOM 877 CA GLN 114 14.957 -20.235 19.162 1.00 0.00 ATOM 878 CB GLN 114 16.346 -19.641 18.835 1.00 0.00 ATOM 879 CG GLN 114 17.228 -20.645 18.111 1.00 0.00 ATOM 880 CD GLN 114 18.002 -20.038 16.966 1.00 0.00 ATOM 881 OE1 GLN 114 19.030 -19.391 17.175 1.00 0.00 ATOM 882 NE2 GLN 114 17.536 -20.232 15.733 1.00 0.00 ATOM 883 O GLN 114 13.434 -18.455 18.596 1.00 0.00 ATOM 884 C GLN 114 14.039 -19.047 19.500 1.00 0.00 ATOM 885 N PRO 115 14.075 -18.672 20.760 1.00 0.00 ATOM 886 CA PRO 115 13.329 -17.525 21.282 1.00 0.00 ATOM 887 CB PRO 115 13.562 -17.556 22.795 1.00 0.00 ATOM 888 CG PRO 115 13.921 -19.009 23.034 1.00 0.00 ATOM 889 CD PRO 115 14.849 -19.312 21.846 1.00 0.00 ATOM 890 O PRO 115 12.916 -15.356 20.350 1.00 0.00 ATOM 891 C PRO 115 13.771 -16.223 20.626 1.00 0.00 ATOM 892 N GLU 116 15.062 -16.070 20.388 1.00 0.00 ATOM 893 CA GLU 116 15.615 -14.872 19.744 1.00 0.00 ATOM 894 CB GLU 116 17.126 -14.738 19.778 1.00 0.00 ATOM 895 CG GLU 116 17.841 -14.704 21.126 1.00 0.00 ATOM 896 CD GLU 116 18.023 -16.055 21.746 1.00 0.00 ATOM 897 OE1 GLU 116 17.123 -16.819 22.009 1.00 0.00 ATOM 898 OE2 GLU 116 19.217 -16.335 21.954 1.00 0.00 ATOM 899 O GLU 116 15.134 -13.775 17.646 1.00 0.00 ATOM 900 C GLU 116 15.267 -14.853 18.246 1.00 0.00 ATOM 901 N LEU 117 15.155 -16.040 17.673 1.00 0.00 ATOM 902 CA LEU 117 14.831 -16.186 16.241 1.00 0.00 ATOM 903 CB LEU 117 15.180 -17.586 15.770 1.00 0.00 ATOM 904 CG LEU 117 14.951 -17.938 14.318 1.00 0.00 ATOM 905 CD1 LEU 117 15.757 -17.036 13.387 1.00 0.00 ATOM 906 CD2 LEU 117 15.363 -19.396 14.138 1.00 0.00 ATOM 907 O LEU 117 13.094 -15.084 15.018 1.00 0.00 ATOM 908 C LEU 117 13.378 -15.784 16.006 1.00 0.00 ATOM 909 N ALA 118 12.528 -16.225 16.925 1.00 0.00 ATOM 910 CA ALA 118 11.095 -15.917 16.834 1.00 0.00 ATOM 911 CB ALA 118 10.281 -16.633 17.894 1.00 0.00 ATOM 912 O ALA 118 10.006 -13.891 16.176 1.00 0.00 ATOM 913 C ALA 118 10.841 -14.419 16.917 1.00 0.00 ATOM 914 N LYS 119 11.551 -13.780 17.835 1.00 0.00 ATOM 915 CA LYS 119 11.452 -12.350 18.094 1.00 0.00 ATOM 916 CB LYS 119 11.136 -12.035 19.532 1.00 0.00 ATOM 917 CG LYS 119 11.039 -10.528 19.849 1.00 0.00 ATOM 918 CD LYS 119 10.858 -10.253 21.331 1.00 0.00 ATOM 919 CE LYS 119 9.436 -10.472 21.728 1.00 0.00 ATOM 920 NZ LYS 119 9.288 -10.241 23.225 1.00 0.00 ATOM 921 O LYS 119 13.777 -11.808 17.995 1.00 0.00 ATOM 922 C LYS 119 12.646 -11.577 17.571 1.00 0.00 ATOM 923 N GLU 120 12.384 -10.638 16.670 1.00 0.00 ATOM 924 CA GLU 120 13.436 -9.811 16.103 1.00 0.00 ATOM 925 CB GLU 120 13.730 -9.912 14.693 1.00 0.00 ATOM 926 CG GLU 120 13.818 -11.327 14.135 1.00 0.00 ATOM 927 CD GLU 120 13.602 -11.420 12.641 1.00 0.00 ATOM 928 OE1 GLU 120 13.357 -10.386 11.989 1.00 0.00 ATOM 929 OE2 GLU 120 13.661 -12.556 12.123 1.00 0.00 ATOM 930 O GLU 120 12.916 -7.596 16.820 1.00 0.00 ATOM 931 C GLU 120 13.629 -8.585 16.953 1.00 0.00 ATOM 932 N LYS 121 14.589 -8.712 17.869 1.00 0.00 ATOM 933 CA LYS 121 14.924 -7.639 18.800 1.00 0.00 ATOM 934 CB LYS 121 15.932 -7.994 19.843 1.00 0.00 ATOM 935 CG LYS 121 15.439 -9.070 20.811 1.00 0.00 ATOM 936 CD LYS 121 16.482 -9.317 21.916 1.00 0.00 ATOM 937 CE LYS 121 15.980 -10.276 23.010 1.00 0.00 ATOM 938 NZ LYS 121 17.000 -10.378 24.090 1.00 0.00 ATOM 939 O LYS 121 14.902 -5.293 18.218 1.00 0.00 ATOM 940 C LYS 121 15.371 -6.415 18.015 1.00 0.00 ATOM 941 N GLY 122 16.291 -6.643 17.078 1.00 0.00 ATOM 942 CA GLY 122 16.850 -5.588 16.260 1.00 0.00 ATOM 943 O GLY 122 15.826 -3.645 15.348 1.00 0.00 ATOM 944 C GLY 122 15.799 -4.880 15.406 1.00 0.00 ATOM 945 N GLU 123 14.916 -5.632 14.749 1.00 0.00 ATOM 946 CA GLU 123 13.817 -5.112 13.950 1.00 0.00 ATOM 947 CB GLU 123 13.015 -6.213 13.288 1.00 0.00 ATOM 948 CG GLU 123 13.780 -6.762 12.097 1.00 0.00 ATOM 949 CD GLU 123 13.101 -7.944 11.483 1.00 0.00 ATOM 950 OE1 GLU 123 12.243 -8.628 12.076 1.00 0.00 ATOM 951 OE2 GLU 123 13.436 -8.240 10.298 1.00 0.00 ATOM 952 O GLU 123 12.429 -3.206 14.524 1.00 0.00 ATOM 953 C GLU 123 12.901 -4.299 14.867 1.00 0.00 ATOM 954 N ILE 124 12.673 -4.822 16.075 1.00 0.00 ATOM 955 CA ILE 124 11.811 -4.184 17.048 1.00 0.00 ATOM 956 CB ILE 124 11.538 -5.215 18.223 1.00 0.00 ATOM 957 CG1 ILE 124 10.747 -6.429 17.675 1.00 0.00 ATOM 958 CG2 ILE 124 10.832 -4.525 19.365 1.00 0.00 ATOM 959 CD1 ILE 124 10.724 -7.593 18.657 1.00 0.00 ATOM 960 O ILE 124 11.678 -1.895 17.761 1.00 0.00 ATOM 961 C ILE 124 12.392 -2.883 17.575 1.00 0.00 ATOM 962 N GLY 125 13.706 -2.825 17.790 1.00 0.00 ATOM 963 CA GLY 125 14.374 -1.621 18.265 1.00 0.00 ATOM 964 O GLY 125 13.905 0.650 17.577 1.00 0.00 ATOM 965 C GLY 125 14.247 -0.492 17.251 1.00 0.00 ATOM 966 N GLU 126 14.460 -0.876 15.977 1.00 0.00 ATOM 967 CA GLU 126 14.383 0.072 14.881 1.00 0.00 ATOM 968 CB GLU 126 15.001 -0.573 13.652 1.00 0.00 ATOM 969 CG GLU 126 16.509 -0.609 13.829 1.00 0.00 ATOM 970 CD GLU 126 17.134 0.774 13.999 1.00 0.00 ATOM 971 OE1 GLU 126 16.858 1.654 13.180 1.00 0.00 ATOM 972 OE2 GLU 126 17.902 0.995 14.942 1.00 0.00 ATOM 973 O GLU 126 12.662 1.661 14.394 1.00 0.00 ATOM 974 C GLU 126 12.922 0.479 14.667 1.00 0.00 ATOM 975 N ALA 127 11.945 -0.452 14.848 1.00 0.00 ATOM 976 CA ALA 127 10.515 -0.150 14.682 1.00 0.00 ATOM 977 CB ALA 127 9.717 -1.388 14.784 1.00 0.00 ATOM 978 O ALA 127 9.295 1.736 15.592 1.00 0.00 ATOM 979 C ALA 127 10.091 0.810 15.804 1.00 0.00 ATOM 980 N VAL 128 10.624 0.633 17.022 1.00 0.00 ATOM 981 CA VAL 128 10.289 1.514 18.149 1.00 0.00 ATOM 982 CB VAL 128 11.018 1.077 19.473 1.00 0.00 ATOM 983 CG1 VAL 128 10.752 2.074 20.601 1.00 0.00 ATOM 984 CG2 VAL 128 10.493 -0.274 19.942 1.00 0.00 ATOM 985 O VAL 128 9.931 3.890 17.925 1.00 0.00 ATOM 986 C VAL 128 10.724 2.944 17.788 1.00 0.00 ATOM 987 N ASP 129 11.958 3.117 17.297 1.00 0.00 ATOM 988 CA ASP 129 12.497 4.414 16.904 1.00 0.00 ATOM 989 CB ASP 129 13.885 4.318 16.350 1.00 0.00 ATOM 990 CG ASP 129 14.463 5.667 15.995 1.00 0.00 ATOM 991 OD1 ASP 129 14.743 6.450 16.922 1.00 0.00 ATOM 992 OD2 ASP 129 14.625 5.958 14.790 1.00 0.00 ATOM 993 O ASP 129 11.109 6.256 16.230 1.00 0.00 ATOM 994 C ASP 129 11.591 5.162 15.926 1.00 0.00 ATOM 995 N ASP 130 11.302 4.522 14.798 1.00 0.00 ATOM 996 CA ASP 130 10.509 5.162 13.740 1.00 0.00 ATOM 997 CB ASP 130 10.503 4.305 12.469 1.00 0.00 ATOM 998 CG ASP 130 11.821 4.345 11.712 1.00 0.00 ATOM 999 OD1 ASP 130 12.760 5.038 12.158 1.00 0.00 ATOM 1000 OD2 ASP 130 11.911 3.678 10.661 1.00 0.00 ATOM 1001 O ASP 130 8.498 6.460 13.810 1.00 0.00 ATOM 1002 C ASP 130 9.066 5.434 14.169 1.00 0.00 ATOM 1003 N LEU 131 8.471 4.521 14.931 1.00 0.00 ATOM 1004 CA LEU 131 7.102 4.691 15.398 1.00 0.00 ATOM 1005 CB LEU 131 6.540 3.370 15.919 1.00 0.00 ATOM 1006 CG LEU 131 6.236 2.311 14.849 1.00 0.00 ATOM 1007 CD1 LEU 131 5.774 1.003 15.499 1.00 0.00 ATOM 1008 CD2 LEU 131 5.189 2.808 13.880 1.00 0.00 ATOM 1009 O LEU 131 5.986 6.483 16.525 1.00 0.00 ATOM 1010 C LEU 131 6.984 5.762 16.467 1.00 0.00 ATOM 1011 N GLN 132 7.985 5.865 17.337 1.00 0.00 ATOM 1012 CA GLN 132 7.951 6.891 18.379 1.00 0.00 ATOM 1013 CB GLN 132 8.976 6.740 19.478 1.00 0.00 ATOM 1014 CG GLN 132 8.724 5.477 20.307 1.00 0.00 ATOM 1015 CD GLN 132 7.379 5.628 21.029 1.00 0.00 ATOM 1016 OE1 GLN 132 6.491 4.687 20.777 1.00 0.00 ATOM 1017 NE2 GLN 132 7.210 6.613 21.745 1.00 0.00 ATOM 1018 O GLN 132 7.416 9.205 18.085 1.00 0.00 ATOM 1019 C GLN 132 8.096 8.252 17.712 1.00 0.00 ATOM 1020 N ASP 133 8.962 8.323 16.704 1.00 0.00 ATOM 1021 CA ASP 133 9.154 9.551 15.948 1.00 0.00 ATOM 1022 CB ASP 133 10.286 9.524 14.984 1.00 0.00 ATOM 1023 CG ASP 133 11.643 9.636 15.658 1.00 0.00 ATOM 1024 OD1 ASP 133 11.699 9.740 16.902 1.00 0.00 ATOM 1025 OD2 ASP 133 12.658 9.623 14.933 1.00 0.00 ATOM 1026 O ASP 133 7.425 11.040 15.191 1.00 0.00 ATOM 1027 C ASP 133 7.863 9.887 15.201 1.00 0.00 ATOM 1028 N ILE 134 7.244 8.875 14.596 1.00 0.00 ATOM 1029 CA ILE 134 5.998 9.057 13.863 1.00 0.00 ATOM 1030 CB ILE 134 5.676 7.691 13.122 1.00 0.00 ATOM 1031 CG1 ILE 134 6.753 7.423 12.043 1.00 0.00 ATOM 1032 CG2 ILE 134 4.277 7.738 12.555 1.00 0.00 ATOM 1033 CD1 ILE 134 6.685 6.001 11.500 1.00 0.00 ATOM 1034 O ILE 134 4.042 10.286 14.438 1.00 0.00 ATOM 1035 C ILE 134 4.883 9.479 14.804 1.00 0.00 ATOM 1036 N CYS 135 4.876 8.936 16.014 1.00 0.00 ATOM 1037 CA CYS 135 3.858 9.296 16.981 1.00 0.00 ATOM 1038 CB CYS 135 4.117 8.529 18.279 1.00 0.00 ATOM 1039 SG CYS 135 4.189 6.736 18.121 1.00 0.00 ATOM 1040 O CYS 135 2.850 11.437 17.329 1.00 0.00 ATOM 1041 C CYS 135 3.892 10.785 17.262 1.00 0.00 ATOM 1042 N GLN 136 5.094 11.328 17.406 1.00 0.00 ATOM 1043 CA GLN 136 5.271 12.759 17.669 1.00 0.00 ATOM 1044 CB GLN 136 6.665 13.122 18.057 1.00 0.00 ATOM 1045 CG GLN 136 7.094 12.644 19.410 1.00 0.00 ATOM 1046 CD GLN 136 8.429 13.244 19.773 1.00 0.00 ATOM 1047 OE1 GLN 136 9.463 12.827 19.283 1.00 0.00 ATOM 1048 NE2 GLN 136 8.403 14.270 20.608 1.00 0.00 ATOM 1049 O GLN 136 4.253 14.633 16.547 1.00 0.00 ATOM 1050 C GLN 136 4.914 13.598 16.439 1.00 0.00 ATOM 1051 N LEU 137 5.399 13.161 15.281 1.00 0.00 ATOM 1052 CA LEU 137 5.158 13.851 14.024 1.00 0.00 ATOM 1053 CB LEU 137 5.932 13.443 12.857 1.00 0.00 ATOM 1054 CG LEU 137 7.442 13.687 12.942 1.00 0.00 ATOM 1055 CD1 LEU 137 8.139 13.043 11.764 1.00 0.00 ATOM 1056 CD2 LEU 137 7.713 15.187 12.966 1.00 0.00 ATOM 1057 O LEU 137 3.078 14.954 13.554 1.00 0.00 ATOM 1058 C LEU 137 3.677 13.881 13.639 1.00 0.00 ATOM 1059 N GLY 138 3.076 12.708 13.467 1.00 0.00 ATOM 1060 CA GLY 138 1.689 12.626 13.047 1.00 0.00 ATOM 1061 O GLY 138 -0.569 12.772 13.822 1.00 0.00 ATOM 1062 C GLY 138 0.595 12.468 14.094 1.00 0.00 ATOM 1063 N TYR 139 0.932 11.974 15.273 1.00 0.00 ATOM 1064 CA TYR 139 -0.096 11.816 16.286 1.00 0.00 ATOM 1065 CB TYR 139 -0.829 13.154 16.532 1.00 0.00 ATOM 1066 CG TYR 139 0.092 14.313 16.767 1.00 0.00 ATOM 1067 CD1 TYR 139 0.388 15.207 15.741 1.00 0.00 ATOM 1068 CD2 TYR 139 0.722 14.487 18.002 1.00 0.00 ATOM 1069 CE1 TYR 139 1.295 16.247 15.935 1.00 0.00 ATOM 1070 CE2 TYR 139 1.632 15.526 18.205 1.00 0.00 ATOM 1071 CZ TYR 139 1.912 16.396 17.166 1.00 0.00 ATOM 1072 OH TYR 139 2.832 17.405 17.348 1.00 0.00 ATOM 1073 O TYR 139 -2.324 10.919 16.452 1.00 0.00 ATOM 1074 C TYR 139 -1.163 10.748 16.044 1.00 0.00 ATOM 1075 N ASP 140 -0.789 9.647 15.384 1.00 0.00 ATOM 1076 CA ASP 140 -1.715 8.536 15.142 1.00 0.00 ATOM 1077 CB ASP 140 -0.818 7.455 14.438 1.00 0.00 ATOM 1078 CG ASP 140 -1.596 6.162 14.177 1.00 0.00 ATOM 1079 OD1 ASP 140 -2.782 6.047 14.559 1.00 0.00 ATOM 1080 OD2 ASP 140 -0.990 5.245 13.569 1.00 0.00 ATOM 1081 O ASP 140 -1.085 7.791 17.320 1.00 0.00 ATOM 1082 C ASP 140 -2.005 7.971 16.517 1.00 0.00 ATOM 1083 N GLU 141 -3.269 7.645 16.775 1.00 0.00 ATOM 1084 CA GLU 141 -3.654 7.123 18.075 1.00 0.00 ATOM 1085 CB GLU 141 -5.181 7.002 18.193 1.00 0.00 ATOM 1086 CG GLU 141 -5.848 8.340 18.530 1.00 0.00 ATOM 1087 CD GLU 141 -7.316 8.108 18.672 1.00 0.00 ATOM 1088 OE1 GLU 141 -7.817 7.020 18.470 1.00 0.00 ATOM 1089 OE2 GLU 141 -7.988 9.168 19.025 1.00 0.00 ATOM 1090 O GLU 141 -2.896 5.404 19.543 1.00 0.00 ATOM 1091 C GLU 141 -3.004 5.788 18.384 1.00 0.00 ATOM 1092 N ASP 142 -2.567 5.060 17.385 1.00 0.00 ATOM 1093 CA ASP 142 -1.924 3.778 17.634 1.00 0.00 ATOM 1094 CB ASP 142 -2.367 2.738 16.583 1.00 0.00 ATOM 1095 CG ASP 142 -1.999 3.130 15.151 1.00 0.00 ATOM 1096 OD1 ASP 142 -1.807 4.332 14.888 1.00 0.00 ATOM 1097 OD2 ASP 142 -1.923 2.228 14.288 1.00 0.00 ATOM 1098 O ASP 142 0.243 2.779 17.918 1.00 0.00 ATOM 1099 C ASP 142 -0.390 3.827 17.753 1.00 0.00 ATOM 1100 N ASP 143 0.203 5.024 17.672 1.00 0.00 ATOM 1101 CA ASP 143 1.663 5.152 17.770 1.00 0.00 ATOM 1102 CB ASP 143 2.194 6.247 16.840 1.00 0.00 ATOM 1103 CG ASP 143 2.239 5.819 15.381 1.00 0.00 ATOM 1104 OD1 ASP 143 2.182 4.620 15.074 1.00 0.00 ATOM 1105 OD2 ASP 143 2.340 6.706 14.516 1.00 0.00 ATOM 1106 O ASP 143 3.446 5.588 19.325 1.00 0.00 ATOM 1107 C ASP 143 2.244 5.339 19.176 1.00 0.00 ATOM 1108 N ASN 144 1.399 5.274 20.205 1.00 0.00 ATOM 1109 CA ASN 144 1.893 5.402 21.585 1.00 0.00 ATOM 1110 CB ASN 144 0.742 5.677 22.562 1.00 0.00 ATOM 1111 CG ASN 144 -0.291 4.567 22.570 1.00 0.00 ATOM 1112 ND2 ASN 144 -1.343 4.730 21.773 1.00 0.00 ATOM 1113 OD1 ASN 144 -0.139 3.563 23.269 1.00 0.00 ATOM 1114 O ASN 144 2.274 3.019 21.390 1.00 0.00 ATOM 1115 C ASN 144 2.616 4.091 21.922 1.00 0.00 ATOM 1116 N GLU 145 3.601 4.173 22.810 1.00 0.00 ATOM 1117 CA GLU 145 4.404 3.014 23.157 1.00 0.00 ATOM 1118 CB GLU 145 5.371 3.343 24.293 1.00 0.00 ATOM 1119 CG GLU 145 6.409 2.252 24.454 1.00 0.00 ATOM 1120 CD GLU 145 7.211 2.379 25.718 1.00 0.00 ATOM 1121 OE1 GLU 145 6.781 1.824 26.753 1.00 0.00 ATOM 1122 OE2 GLU 145 8.279 3.020 25.666 1.00 0.00 ATOM 1123 O GLU 145 4.059 0.658 22.974 1.00 0.00 ATOM 1124 C GLU 145 3.677 1.711 23.467 1.00 0.00 ATOM 1125 N GLU 146 2.621 1.774 24.275 1.00 0.00 ATOM 1126 CA GLU 146 1.911 0.555 24.641 1.00 0.00 ATOM 1127 CB GLU 146 0.812 0.843 25.667 1.00 0.00 ATOM 1128 CG GLU 146 1.334 1.035 27.079 1.00 0.00 ATOM 1129 CD GLU 146 0.223 1.088 28.109 1.00 0.00 ATOM 1130 OE1 GLU 146 -0.668 0.215 28.067 1.00 0.00 ATOM 1131 OE2 GLU 146 0.251 1.992 28.969 1.00 0.00 ATOM 1132 O GLU 146 1.298 -1.299 23.246 1.00 0.00 ATOM 1133 C GLU 146 1.299 -0.078 23.395 1.00 0.00 ATOM 1134 N GLU 147 0.771 0.749 22.496 1.00 0.00 ATOM 1135 CA GLU 147 0.180 0.227 21.268 1.00 0.00 ATOM 1136 CB GLU 147 -0.548 1.337 20.502 1.00 0.00 ATOM 1137 CG GLU 147 -1.895 1.731 21.096 1.00 0.00 ATOM 1138 CD GLU 147 -2.889 0.585 21.092 1.00 0.00 ATOM 1139 OE1 GLU 147 -3.052 -0.054 20.032 1.00 0.00 ATOM 1140 OE2 GLU 147 -3.511 0.324 22.143 1.00 0.00 ATOM 1141 O GLU 147 1.025 -1.463 19.779 1.00 0.00 ATOM 1142 C GLU 147 1.248 -0.410 20.378 1.00 0.00 ATOM 1143 N LEU 148 2.413 0.224 20.298 1.00 0.00 ATOM 1144 CA LEU 148 3.498 -0.314 19.486 1.00 0.00 ATOM 1145 CB LEU 148 4.672 0.670 19.455 1.00 0.00 ATOM 1146 CG LEU 148 4.413 1.979 18.700 1.00 0.00 ATOM 1147 CD1 LEU 148 5.541 2.973 18.959 1.00 0.00 ATOM 1148 CD2 LEU 148 4.271 1.681 17.213 1.00 0.00 ATOM 1149 O LEU 148 4.256 -2.587 19.282 1.00 0.00 ATOM 1150 C LEU 148 3.958 -1.661 20.037 1.00 0.00 ATOM 1151 N ALA 149 4.007 -1.771 21.362 1.00 0.00 ATOM 1152 CA ALA 149 4.444 -3.008 22.004 1.00 0.00 ATOM 1153 CB ALA 149 4.462 -2.833 23.519 1.00 0.00 ATOM 1154 O ALA 149 4.037 -5.325 21.519 1.00 0.00 ATOM 1155 C ALA 149 3.560 -4.192 21.626 1.00 0.00 ATOM 1156 N GLU 150 2.271 -3.916 21.427 1.00 0.00 ATOM 1157 CA GLU 150 1.334 -4.990 21.059 1.00 0.00 ATOM 1158 CB GLU 150 -0.078 -4.440 21.137 1.00 0.00 ATOM 1159 CG GLU 150 -0.405 -4.114 22.615 1.00 0.00 ATOM 1160 CD GLU 150 -1.598 -3.259 22.819 1.00 0.00 ATOM 1161 OE1 GLU 150 -2.320 -2.890 21.875 1.00 0.00 ATOM 1162 OE2 GLU 150 -1.813 -2.882 24.021 1.00 0.00 ATOM 1163 O GLU 150 1.607 -6.852 19.557 1.00 0.00 ATOM 1164 C GLU 150 1.670 -5.608 19.733 1.00 0.00 ATOM 1165 N ALA 151 2.103 -4.795 18.756 1.00 0.00 ATOM 1166 CA ALA 151 2.571 -5.333 17.478 1.00 0.00 ATOM 1167 CB ALA 151 2.883 -4.208 16.484 1.00 0.00 ATOM 1168 O ALA 151 3.870 -7.301 17.065 1.00 0.00 ATOM 1169 C ALA 151 3.789 -6.223 17.663 1.00 0.00 ATOM 1170 N LEU 152 4.749 -5.802 18.491 1.00 0.00 ATOM 1171 CA LEU 152 5.942 -6.609 18.721 1.00 0.00 ATOM 1172 CB LEU 152 6.903 -5.874 19.660 1.00 0.00 ATOM 1173 CG LEU 152 7.549 -4.666 18.972 1.00 0.00 ATOM 1174 CD1 LEU 152 8.211 -3.750 19.991 1.00 0.00 ATOM 1175 CD2 LEU 152 8.561 -5.159 17.942 1.00 0.00 ATOM 1176 O LEU 152 6.082 -8.990 18.643 1.00 0.00 ATOM 1177 C LEU 152 5.643 -8.011 19.238 1.00 0.00 ATOM 1178 N GLU 153 4.894 -8.120 20.333 1.00 0.00 ATOM 1179 CA GLU 153 4.567 -9.445 20.863 1.00 0.00 ATOM 1180 CB GLU 153 3.730 -9.341 22.144 1.00 0.00 ATOM 1181 CG GLU 153 4.528 -8.951 23.378 1.00 0.00 ATOM 1182 CD GLU 153 4.701 -7.447 23.532 1.00 0.00 ATOM 1183 OE1 GLU 153 4.448 -6.701 22.560 1.00 0.00 ATOM 1184 OE2 GLU 153 5.096 -7.011 24.637 1.00 0.00 ATOM 1185 O GLU 153 4.050 -11.442 19.623 1.00 0.00 ATOM 1186 C GLU 153 3.802 -10.249 19.822 1.00 0.00 ATOM 1187 N GLU 154 2.877 -9.596 19.143 1.00 0.00 ATOM 1188 CA GLU 154 2.052 -10.208 18.122 1.00 0.00 ATOM 1189 CB GLU 154 0.958 -9.219 17.655 1.00 0.00 ATOM 1190 CG GLU 154 -0.121 -9.057 18.730 1.00 0.00 ATOM 1191 CD GLU 154 -1.230 -8.107 18.295 1.00 0.00 ATOM 1192 OE1 GLU 154 -1.193 -7.641 17.138 1.00 0.00 ATOM 1193 OE2 GLU 154 -2.096 -7.799 19.140 1.00 0.00 ATOM 1194 O GLU 154 2.702 -11.739 16.397 1.00 0.00 ATOM 1195 C GLU 154 2.920 -10.645 16.957 1.00 0.00 ATOM 1196 N ILE 155 3.945 -9.882 16.614 1.00 0.00 ATOM 1197 CA ILE 155 4.854 -10.281 15.552 1.00 0.00 ATOM 1198 CB ILE 155 5.785 -9.165 15.059 1.00 0.00 ATOM 1199 CG1 ILE 155 4.917 -7.943 14.610 1.00 0.00 ATOM 1200 CG2 ILE 155 6.705 -9.616 13.939 1.00 0.00 ATOM 1201 CD1 ILE 155 5.800 -6.714 14.413 1.00 0.00 ATOM 1202 O ILE 155 5.873 -12.456 15.112 1.00 0.00 ATOM 1203 C ILE 155 5.616 -11.531 15.930 1.00 0.00 ATOM 1204 N ILE 156 6.110 -11.587 17.162 1.00 0.00 ATOM 1205 CA ILE 156 6.855 -12.781 17.611 1.00 0.00 ATOM 1206 CB ILE 156 7.381 -12.487 19.059 1.00 0.00 ATOM 1207 CG1 ILE 156 8.494 -11.471 19.047 1.00 0.00 ATOM 1208 CG2 ILE 156 7.843 -13.802 19.659 1.00 0.00 ATOM 1209 CD1 ILE 156 8.857 -10.889 20.399 1.00 0.00 ATOM 1210 O ILE 156 6.375 -15.051 17.088 1.00 0.00 ATOM 1211 C ILE 156 5.956 -13.979 17.576 1.00 0.00 ATOM 1212 N GLU 157 4.709 -13.884 17.996 1.00 0.00 ATOM 1213 CA GLU 157 3.769 -14.984 17.924 1.00 0.00 ATOM 1214 CB GLU 157 2.502 -14.516 18.623 1.00 0.00 ATOM 1215 CG GLU 157 1.410 -15.569 18.680 1.00 0.00 ATOM 1216 CD GLU 157 0.118 -15.030 19.282 1.00 0.00 ATOM 1217 OE1 GLU 157 -0.227 -13.859 19.089 1.00 0.00 ATOM 1218 OE2 GLU 157 -0.549 -15.813 19.952 1.00 0.00 ATOM 1219 O GLU 157 3.567 -16.594 16.149 1.00 0.00 ATOM 1220 C GLU 157 3.522 -15.401 16.472 1.00 0.00 ATOM 1221 N TYR 158 3.349 -14.427 15.575 1.00 0.00 ATOM 1222 CA TYR 158 3.167 -14.719 14.170 1.00 0.00 ATOM 1223 CB TYR 158 2.766 -13.432 13.461 1.00 0.00 ATOM 1224 CG TYR 158 2.774 -13.527 11.936 1.00 0.00 ATOM 1225 CD1 TYR 158 3.926 -13.195 11.204 1.00 0.00 ATOM 1226 CD2 TYR 158 1.634 -13.962 11.268 1.00 0.00 ATOM 1227 CE1 TYR 158 3.934 -13.306 9.812 1.00 0.00 ATOM 1228 CE2 TYR 158 1.630 -14.070 9.881 1.00 0.00 ATOM 1229 CZ TYR 158 2.781 -13.742 9.162 1.00 0.00 ATOM 1230 OH TYR 158 2.741 -13.859 7.797 1.00 0.00 ATOM 1231 O TYR 158 4.358 -16.301 12.815 1.00 0.00 ATOM 1232 C TYR 158 4.433 -15.312 13.543 1.00 0.00 ATOM 1233 N VAL 159 5.599 -14.722 13.788 1.00 0.00 ATOM 1234 CA VAL 159 6.823 -15.189 13.167 1.00 0.00 ATOM 1235 CB VAL 159 7.946 -14.151 13.444 1.00 0.00 ATOM 1236 CG1 VAL 159 9.279 -14.660 12.930 1.00 0.00 ATOM 1237 CG2 VAL 159 7.615 -12.856 12.754 1.00 0.00 ATOM 1238 O VAL 159 7.526 -17.431 12.908 1.00 0.00 ATOM 1239 C VAL 159 7.148 -16.580 13.705 1.00 0.00 ATOM 1240 N ARG 160 6.929 -16.904 14.986 1.00 0.00 ATOM 1241 CA ARG 160 7.193 -18.240 15.501 1.00 0.00 ATOM 1242 CB ARG 160 6.830 -18.336 16.991 1.00 0.00 ATOM 1243 CG ARG 160 6.905 -19.740 17.559 1.00 0.00 ATOM 1244 CD ARG 160 6.486 -19.730 19.000 1.00 0.00 ATOM 1245 NE ARG 160 6.366 -21.077 19.527 1.00 0.00 ATOM 1246 CZ ARG 160 5.317 -21.868 19.287 1.00 0.00 ATOM 1247 NH1 ARG 160 4.290 -21.485 18.521 1.00 0.00 ATOM 1248 NH2 ARG 160 5.316 -23.076 19.838 1.00 0.00 ATOM 1249 O ARG 160 6.911 -20.291 14.329 1.00 0.00 ATOM 1250 C ARG 160 6.372 -19.249 14.718 1.00 0.00 ATOM 1251 N THR 161 5.090 -18.915 14.442 1.00 0.00 ATOM 1252 CA THR 161 4.249 -19.857 13.677 1.00 0.00 ATOM 1253 CB THR 161 3.335 -20.604 14.710 1.00 0.00 ATOM 1254 CG2 THR 161 2.652 -21.848 14.129 1.00 0.00 ATOM 1255 OG1 THR 161 4.115 -21.104 15.813 1.00 0.00 ATOM 1256 O THR 161 2.857 -18.074 13.045 1.00 0.00 ATOM 1257 C THR 161 3.342 -19.137 12.713 1.00 0.00 ATOM 1258 N ILE 162 3.009 -19.744 11.592 1.00 0.00 ATOM 1259 CA ILE 162 1.963 -19.244 10.704 1.00 0.00 ATOM 1260 CB ILE 162 2.390 -18.349 9.527 1.00 0.00 ATOM 1261 CG1 ILE 162 1.153 -17.792 8.801 1.00 0.00 ATOM 1262 CG2 ILE 162 3.303 -19.054 8.548 1.00 0.00 ATOM 1263 CD1 ILE 162 1.508 -16.592 7.911 1.00 0.00 ATOM 1264 O ILE 162 1.818 -21.573 9.963 1.00 0.00 ATOM 1265 C ILE 162 1.226 -20.517 10.210 1.00 0.00 ATOM 1266 N ALA 163 -0.079 -20.442 10.130 1.00 0.00 ATOM 1267 CA ALA 163 -0.919 -21.515 9.598 1.00 0.00 ATOM 1268 CB ALA 163 -1.733 -22.222 10.674 1.00 0.00 ATOM 1269 O ALA 163 -2.354 -19.850 8.745 1.00 0.00 ATOM 1270 C ALA 163 -1.871 -20.959 8.541 1.00 0.00 ATOM 1271 N MET 164 -2.089 -21.735 7.505 1.00 0.00 ATOM 1272 CA MET 164 -2.931 -21.329 6.385 1.00 0.00 ATOM 1273 CB MET 164 -2.776 -22.492 5.335 1.00 0.00 ATOM 1274 CG MET 164 -3.673 -22.336 4.134 1.00 0.00 ATOM 1275 SD MET 164 -3.201 -20.842 3.189 1.00 0.00 ATOM 1276 CE MET 164 -1.943 -21.449 2.083 1.00 0.00 ATOM 1277 O MET 164 -4.992 -20.267 6.159 1.00 0.00 ATOM 1278 C MET 164 -4.348 -21.121 6.813 1.00 0.00 ATOM 1279 N LEU 165 -4.970 -21.777 7.766 1.00 0.00 ATOM 1280 CA LEU 165 -6.369 -21.556 8.177 1.00 0.00 ATOM 1281 CB LEU 165 -6.751 -22.700 9.080 1.00 0.00 ATOM 1282 CG LEU 165 -8.104 -23.248 9.360 1.00 0.00 ATOM 1283 CD1 LEU 165 -8.230 -23.457 10.881 1.00 0.00 ATOM 1284 CD2 LEU 165 -9.209 -22.393 8.756 1.00 0.00 ATOM 1285 O LEU 165 -7.366 -19.455 8.801 1.00 0.00 ATOM 1286 C LEU 165 -6.405 -20.232 8.954 1.00 0.00 ATOM 1287 N PHE 166 -5.375 -20.025 9.796 1.00 0.00 ATOM 1288 CA PHE 166 -5.322 -18.774 10.614 1.00 0.00 ATOM 1289 CB PHE 166 -4.221 -18.769 11.648 1.00 0.00 ATOM 1290 CG PHE 166 -4.285 -19.843 12.706 1.00 0.00 ATOM 1291 CD1 PHE 166 -5.517 -20.408 13.049 1.00 0.00 ATOM 1292 CD2 PHE 166 -3.089 -20.221 13.330 1.00 0.00 ATOM 1293 CE1 PHE 166 -5.472 -21.387 14.059 1.00 0.00 ATOM 1294 CE2 PHE 166 -3.026 -21.190 14.322 1.00 0.00 ATOM 1295 CZ PHE 166 -4.275 -21.763 14.676 1.00 0.00 ATOM 1296 O PHE 166 -5.922 -16.562 9.831 1.00 0.00 ATOM 1297 C PHE 166 -5.196 -17.568 9.661 1.00 0.00 ATOM 1298 N TYR 167 -4.299 -17.780 8.687 1.00 0.00 ATOM 1299 CA TYR 167 -4.051 -16.742 7.649 1.00 0.00 ATOM 1300 CB TYR 167 -3.114 -17.485 6.618 1.00 0.00 ATOM 1301 CG TYR 167 -2.751 -16.726 5.380 1.00 0.00 ATOM 1302 CD1 TYR 167 -1.650 -15.865 5.333 1.00 0.00 ATOM 1303 CD2 TYR 167 -3.488 -16.893 4.210 1.00 0.00 ATOM 1304 CE1 TYR 167 -1.321 -15.186 4.174 1.00 0.00 ATOM 1305 CE2 TYR 167 -3.166 -16.234 3.042 1.00 0.00 ATOM 1306 CZ TYR 167 -2.087 -15.363 3.037 1.00 0.00 ATOM 1307 OH TYR 167 -1.759 -14.728 1.856 1.00 0.00 ATOM 1308 O TYR 167 -5.435 -15.112 6.644 1.00 0.00 ATOM 1309 C TYR 167 -5.348 -16.292 7.019 1.00 0.00 ATOM 1310 N SER 168 -6.336 -17.185 6.925 1.00 0.00 ATOM 1311 CA SER 168 -7.650 -16.886 6.365 1.00 0.00 ATOM 1312 CB SER 168 -8.503 -18.111 6.289 1.00 0.00 ATOM 1313 OG SER 168 -7.962 -19.015 5.329 1.00 0.00 ATOM 1314 O SER 168 -8.976 -14.895 6.567 1.00 0.00 ATOM 1315 C SER 168 -8.403 -15.811 7.149 1.00 0.00 ATOM 1316 N HIS 169 -8.339 -15.900 8.473 1.00 0.00 ATOM 1317 CA HIS 169 -8.993 -14.937 9.357 1.00 0.00 ATOM 1318 CB HIS 169 -8.922 -15.408 10.807 1.00 0.00 ATOM 1319 CG HIS 169 -9.538 -16.752 11.035 1.00 0.00 ATOM 1320 CD2 HIS 169 -8.987 -17.939 11.381 1.00 0.00 ATOM 1321 ND1 HIS 169 -10.885 -16.988 10.868 1.00 0.00 ATOM 1322 CE1 HIS 169 -11.139 -18.264 11.104 1.00 0.00 ATOM 1323 NE2 HIS 169 -10.004 -18.862 11.417 1.00 0.00 ATOM 1324 O HIS 169 -9.136 -12.557 9.176 1.00 0.00 ATOM 1325 C HIS 169 -8.402 -13.537 9.238 1.00 0.00 ATOM 1326 N PHE 170 -7.071 -13.446 9.211 1.00 0.00 ATOM 1327 CA PHE 170 -6.379 -12.172 9.073 1.00 0.00 ATOM 1328 CB PHE 170 -4.846 -12.247 9.189 1.00 0.00 ATOM 1329 CG PHE 170 -4.217 -10.939 8.747 1.00 0.00 ATOM 1330 CD1 PHE 170 -4.087 -9.869 9.636 1.00 0.00 ATOM 1331 CD2 PHE 170 -3.765 -10.750 7.440 1.00 0.00 ATOM 1332 CE1 PHE 170 -3.516 -8.655 9.246 1.00 0.00 ATOM 1333 CE2 PHE 170 -3.200 -9.540 7.015 1.00 0.00 ATOM 1334 CZ PHE 170 -3.091 -8.486 7.924 1.00 0.00 ATOM 1335 O PHE 170 -6.983 -10.318 7.709 1.00 0.00 ATOM 1336 C PHE 170 -6.742 -11.517 7.753 1.00 0.00 ATOM 1337 N ASN 171 -6.838 -12.279 6.676 1.00 0.00 ATOM 1338 CA ASN 171 -7.176 -11.722 5.369 1.00 0.00 ATOM 1339 CB ASN 171 -6.939 -12.730 4.255 1.00 0.00 ATOM 1340 CG ASN 171 -7.360 -12.225 2.897 1.00 0.00 ATOM 1341 ND2 ASN 171 -6.520 -11.401 2.270 1.00 0.00 ATOM 1342 OD1 ASN 171 -8.438 -12.589 2.418 1.00 0.00 ATOM 1343 O ASN 171 -8.929 -10.155 4.815 1.00 0.00 ATOM 1344 C ASN 171 -8.635 -11.241 5.312 1.00 0.00 ATOM 1345 N GLU 172 -9.555 -12.066 5.794 1.00 0.00 ATOM 1346 CA GLU 172 -10.974 -11.724 5.765 1.00 0.00 ATOM 1347 CB GLU 172 -11.820 -12.926 6.183 1.00 0.00 ATOM 1348 CG GLU 172 -11.752 -14.096 5.220 1.00 0.00 ATOM 1349 CD GLU 172 -12.560 -13.878 3.950 1.00 0.00 ATOM 1350 OE1 GLU 172 -12.717 -12.714 3.503 1.00 0.00 ATOM 1351 OE2 GLU 172 -13.020 -14.890 3.375 1.00 0.00 ATOM 1352 O GLU 172 -12.160 -9.727 6.327 1.00 0.00 ATOM 1353 C GLU 172 -11.297 -10.535 6.653 1.00 0.00 ATOM 1354 N GLY 173 -10.566 -10.412 7.754 1.00 0.00 ATOM 1355 CA GLY 173 -10.706 -9.283 8.668 1.00 0.00 ATOM 1356 O GLY 173 -10.729 -6.915 8.242 1.00 0.00 ATOM 1357 C GLY 173 -10.165 -7.992 8.042 1.00 0.00 ATOM 1358 N GLU 174 -9.160 -8.120 7.172 1.00 0.00 ATOM 1359 CA GLU 174 -8.736 -6.999 6.349 1.00 0.00 ATOM 1360 CB GLU 174 -7.668 -7.446 5.349 1.00 0.00 ATOM 1361 CG GLU 174 -6.234 -7.266 5.818 1.00 0.00 ATOM 1362 CD GLU 174 -5.946 -5.868 6.335 1.00 0.00 ATOM 1363 OE1 GLU 174 -5.728 -4.949 5.515 1.00 0.00 ATOM 1364 OE2 GLU 174 -5.938 -5.691 7.569 1.00 0.00 ATOM 1365 O GLU 174 -10.298 -5.293 5.683 1.00 0.00 ATOM 1366 C GLU 174 -9.942 -6.467 5.579 1.00 0.00 ATOM 1367 N ILE 175 -10.574 -7.356 4.821 1.00 0.00 ATOM 1368 CA ILE 175 -11.723 -6.982 4.003 1.00 0.00 ATOM 1369 CB ILE 175 -12.248 -8.171 3.163 1.00 0.00 ATOM 1370 CG1 ILE 175 -11.160 -8.629 2.161 1.00 0.00 ATOM 1371 CG2 ILE 175 -13.547 -7.801 2.489 1.00 0.00 ATOM 1372 CD1 ILE 175 -11.480 -9.982 1.539 1.00 0.00 ATOM 1373 O ILE 175 -13.351 -5.283 4.507 1.00 0.00 ATOM 1374 C ILE 175 -12.853 -6.364 4.835 1.00 0.00 ATOM 1375 N GLU 176 -13.159 -7.002 5.974 1.00 0.00 ATOM 1376 CA GLU 176 -14.221 -6.531 6.850 1.00 0.00 ATOM 1377 CB GLU 176 -14.367 -7.492 8.023 1.00 0.00 ATOM 1378 CG GLU 176 -15.657 -7.356 8.796 1.00 0.00 ATOM 1379 CD GLU 176 -15.688 -8.229 10.051 1.00 0.00 ATOM 1380 OE1 GLU 176 -14.805 -9.117 10.196 1.00 0.00 ATOM 1381 OE2 GLU 176 -16.597 -8.023 10.895 1.00 0.00 ATOM 1382 O GLU 176 -14.873 -4.276 7.309 1.00 0.00 ATOM 1383 C GLU 176 -13.974 -5.103 7.337 1.00 0.00 ATOM 1384 N SER 177 -12.745 -4.829 7.766 1.00 0.00 ATOM 1385 CA SER 177 -12.396 -3.494 8.243 1.00 0.00 ATOM 1386 CB SER 177 -11.018 -3.511 8.909 1.00 0.00 ATOM 1387 OG SER 177 -11.037 -4.314 10.079 1.00 0.00 ATOM 1388 O SER 177 -12.777 -1.301 7.346 1.00 0.00 ATOM 1389 C SER 177 -12.423 -2.460 7.123 1.00 0.00 ATOM 1390 N LYS 178 -12.042 -2.875 5.918 1.00 0.00 ATOM 1391 CA LYS 178 -12.060 -1.969 4.775 1.00 0.00 ATOM 1392 CB LYS 178 -11.392 -2.623 3.558 1.00 0.00 ATOM 1393 CG LYS 178 -11.483 -1.794 2.284 1.00 0.00 ATOM 1394 CD LYS 178 -10.862 -2.509 1.093 1.00 0.00 ATOM 1395 CE LYS 178 -10.988 -1.673 -0.176 1.00 0.00 ATOM 1396 NZ LYS 178 -10.338 -2.322 -1.350 1.00 0.00 ATOM 1397 O LYS 178 -13.855 -0.496 4.136 1.00 0.00 ATOM 1398 C LYS 178 -13.513 -1.641 4.447 1.00 0.00 ATOM 1399 N PRO 179 -14.358 -2.682 4.528 1.00 0.00 ATOM 1400 CA PRO 179 -15.776 -2.483 4.237 1.00 0.00 ATOM 1401 CB PRO 179 -16.233 -3.921 3.931 1.00 0.00 ATOM 1402 CG PRO 179 -15.005 -4.596 3.402 1.00 0.00 ATOM 1403 CD PRO 179 -13.878 -4.028 4.246 1.00 0.00 ATOM 1404 O PRO 179 -17.377 -1.018 5.175 1.00 0.00 ATOM 1405 C PRO 179 -16.505 -1.854 5.389 1.00 0.00 ATOM 1406 N VAL 180 -16.073 -2.104 6.649 1.00 0.00 ATOM 1407 CA VAL 180 -16.644 -1.395 7.784 1.00 0.00 ATOM 1408 CB VAL 180 -16.020 -1.882 9.106 1.00 0.00 ATOM 1409 CG1 VAL 180 -16.450 -0.995 10.260 1.00 0.00 ATOM 1410 CG2 VAL 180 -16.454 -3.332 9.368 1.00 0.00 ATOM 1411 O VAL 180 -17.300 0.903 7.878 1.00 0.00 ATOM 1412 C VAL 180 -16.391 0.108 7.621 1.00 0.00 ATOM 1413 N LEU 181 -15.195 0.487 7.203 1.00 0.00 ATOM 1414 CA LEU 181 -14.865 1.915 7.066 1.00 0.00 ATOM 1415 CB LEU 181 -13.365 2.111 6.883 1.00 0.00 ATOM 1416 CG LEU 181 -12.518 1.757 8.109 1.00 0.00 ATOM 1417 CD1 LEU 181 -11.048 1.826 7.761 1.00 0.00 ATOM 1418 CD2 LEU 181 -12.841 2.722 9.245 1.00 0.00 ATOM 1419 O LEU 181 -16.117 3.715 6.063 1.00 0.00 ATOM 1420 C LEU 181 -15.615 2.603 5.908 1.00 0.00 ATOM 1421 N HIS 182 -15.707 1.916 4.780 1.00 0.00 ATOM 1422 CA HIS 182 -16.385 2.449 3.583 1.00 0.00 ATOM 1423 CB HIS 182 -15.278 2.450 2.469 1.00 0.00 ATOM 1424 CG HIS 182 -14.305 3.552 2.664 1.00 0.00 ATOM 1425 CD2 HIS 182 -13.000 3.536 3.028 1.00 0.00 ATOM 1426 ND1 HIS 182 -14.645 4.881 2.505 1.00 0.00 ATOM 1427 CE1 HIS 182 -13.591 5.636 2.765 1.00 0.00 ATOM 1428 NE2 HIS 182 -12.580 4.845 3.088 1.00 0.00 ATOM 1429 O HIS 182 -17.200 0.654 2.212 1.00 0.00 ATOM 1430 C HIS 182 -17.420 1.418 3.084 1.00 0.00 TER END ################################ # # # END # # # ################################ From mailer@bialko.llnl.gov Mon Aug 26 14:30:29 2002 Date: Mon, 26 Aug 2002 14:30:23 -0700 (PDT) From: Automatic Reply To: karplus@cse.ucsc.edu X-SpamBouncer: 1.4 (10/07/01) X-SBPass: NoBounce X-SBClass: OK # # Protein Structure Prediction Center, LLNL, Livermore, CA # Verification system Mon Aug 26 14:02:29 PDT 2002 by Adam Zemla # # The PIN number of your submission is: PIN_260251_35042 # (PIN number is not an ACCESSION CODE) # Thank you for your submission. Your prediction has been accepted with an ACCESSION CODE: T0129TS001_3 Current information on models submitted in prediction T0129TS001 MODEL_INDEX PIN CODE DATE E-mail T0129TS001_3 PIN_260251_35042 4069-6308-1312 08/26/02 14:02:29 karplus@cse.ucsc.edu T0129TS001_2 PIN_258350_35041 4069-6308-1312 08/26/02 14:02:10 karplus@cse.ucsc.edu T0129TS001_1 PIN_739324_34603 4069-6308-1312 08/26/02 09:50:29 karplus@cse.ucsc.edu PLEASE NOTE: Submission of a duplicate prediction (same target, format, model index) will REPLACE an existing submission (ACCESSION CODE), provided it is received before the target has expired. The current status of models accepted for target T0129 MODEL_INDEX PIN CODE DATE E-mail T0129TS001_1 PIN_739324_34603 4069-6308-1312 08/26/02 09:50:29 karplus@cse.ucsc.edu T0129TS001_2 PIN_258350_35041 4069-6308-1312 08/26/02 14:02:10 karplus@cse.ucsc.edu T0129TS001_3 PIN_260251_35042 4069-6308-1312 08/26/02 14:02:29 karplus@cse.ucsc.edu T0129SS001_1 PIN_123526_15892 4069-6308-1312 07/26/02 15:00:20 karplus@bray.cse.ucsc.edu For more information on accepted models submitted to CASP5 see: http://PredictionCenter.llnl.gov/casp5/models/casp5-models.html Please check below if the verified data of your submission is correct. # Reading prediction format TS PFRMAT TS TARGET T0129 AUTHOR 4069-6308-1312 # Reading MODEL 3 PARENT N/A # Reading prediction format TS (DONE) # Checking the TS prediction MODEL 3 # Checking the TS prediction MODEL 3 (DONE) # MODEL index: 3 # Target name: T0129 # Total number of residues in target: 182 # Total number of residues in model: 182 # Total number of atoms in model: 1430 # Number of atoms with 1.0 occupancy: 1430 # Number of fragments in model: 1 # Number of METHOD records: 109 # No errors. ################################ # # # SUBMISSION # # # ################################ # # # BEGIN # # # ################################ PFRMAT TS TARGET T0129 AUTHOR 4069-6308-1312 METHOD The SAM-T02 human predictions start with the same method as the METHOD SAM-T02 server: METHOD METHOD Use the SAM-T2K method for finding homologs of the target and METHOD aligning them. METHOD METHOD Make local structure predictions using neural nets and the METHOD multiple alignment. We currently have 5 local-structure METHOD alphabets: METHOD DSSP METHOD STRIDE METHOD STR an extended version of DSSP that splits the beta strands METHOD into multiple classes (parallel/antiparallel/mixed, METHOD edge/center) METHOD ALPHA an discretization of the alpha torsion angle: METHOD CA(i-i), CA(i), CA(i+1), CA(i+2) METHOD DSSP_EHL2 CASP's collapse of the DSSP alphabet METHOD METHOD DSSP_EHL2 is not predicted directly by a neural net, but is METHOD computed as a weighted average of the other 4 networks (each METHOD probability vector output is multiplied by conditional METHOD probability matrix P(E|letter) P(H|letter) P(L|letter)). The METHOD weights for the averaging are the mutual information between the METHOD local structure alphabet and the DSSP_EHL2 alphabet in a large METHOD training set. METHOD METHOD METHOD We make four 2-track HMMs (1.0 amino acid + 0.3 local structure) METHOD and use them to score a template library of about 6200 templates. METHOD We also used a single-track HMM to score not just the template METHOD library, but a non-redundant copy of the entire PDB. METHOD METHOD [Difference from server: the web server did not include the ALPHA METHOD alphabet in either the DSSP_EHL2 computation or the 2-track HMMS.] METHOD METHOD One-track HMMs built from the template library multiple alignments METHOD were used to score the target sequence. METHOD METHOD All the logs of e-values were combined in a weighted average (with METHOD rather arbitrary weights, since we did not have time to METHOD optimize them), and the best templates ranked. METHOD METHOD Alignments of the target to the top templates were made using METHOD several different alignment methods (all using the SAM hmmscore METHOD program). METHOD METHOD After the large set of alignments were made the "human" methods and METHOD the server diverge significantly. The server just picks the METHOD best-scoring templates (after removing redundancy) and reports the METHOD local posterior-decoding alignments made with the 2-track AA+STR METHOD target HMM. METHOD METHOD The hand method used SAM's "fragfinder" program and the 2-track AA+STR METHOD HMM to find short fragments (9 residues long) for each position in the METHOD sequence (6 fragments were kept for each position). METHOD METHOD Then the "undertaker" program (named because it optimizes burial) is METHOD used to try to combine the alignments and the fragments into a METHOD consistent 3D model. No single alignment or parent template was used, METHOD though in many cases one had much more influence than the others. The METHOD alignment scores were not passed to undertaker, but were used only to METHOD pike the set of alignments and fragments that undertaker would see. METHOD METHOD A genetic algorithm with about 16 different operators were used to METHOD optimize a score function. The score function was hand-tweaked for METHOD each target (mainly by adding constraints to keep beta sheets METHOD together, but also by adjusting what terms were included in the score METHOD function and what weights were used). Undertaker was undergoing METHOD extensive modification during CASP season, so may have had quite METHOD different features available for different targets. METHOD METHOD Bower and Dunbrack's SCWRL was run on some of the intermediate METHOD conformations generated by undertaker, but the final conformation was METHOD chosen entirely by the undertaker score function. METHOD METHOD Optimization was generally done in many passes, with hand inspection METHOD of the best conformation after each pass, followed (often) by tweaking METHOD the score function to move the conformation in a direction we desired. METHOD METHOD In a few cases, when we started getting a decent structure that did METHOD not correspond well to our input alignments, we submitted the METHOD structure to VAST to get structure-structure alignments, to try to METHOD find some other possible templates to use as a base. METHOD METHOD In some cases, when several conformations had good parts, different METHOD conformations were manually cut-and-pasted, with undertaker run to try METHOD to smooth out the transitions. METHOD METHOD Because undertaker does not (yet) handle multimers, we often added METHOD "scaffolding" constraints by hand to try to retain structure in METHOD dimerization interfaces. This is a crude hack that we hope to get rid METHOD of when we have multimers implemented. METHOD METHOD Because undertaker does not (yet) have a hydrogen-bond scoring METHOD function, we often had to add constraints to hold beta sheets METHOD together. In some cases where the register was not obvious, we had to METHOD guess or try several different registers. METHOD METHOD In some cases, when we got desperate for initial starting points, we METHOD threw the Robetta ab-initio models into the undertaker pool, and METHOD optimized from them as well as the ones undertaker started with. METHOD METHOD For multiple-domain models, we generally broke the sequence into METHOD chunks (often somewhat arbitrary overlapping chunks), and did the full METHOD SAM-T02 method for each subchain. The alignments found were all METHOD tossed into the undertaker conformation search. In some cases, we METHOD performed undertaker runs for the subchains, and cut-and-pasted the METHOD pieces into one PDB file (with bad breaks) and let undertaker try to METHOD assemble the pieces. MODEL 3 PARENT N/A ATOM 1 N MET 1 -25.551 -34.771 -1.517 1.00 0.00 ATOM 2 CA MET 1 -26.052 -33.388 -1.349 1.00 0.00 ATOM 3 CB MET 1 -26.048 -33.004 0.129 1.00 0.00 ATOM 4 CG MET 1 -26.752 -31.700 0.441 1.00 0.00 ATOM 5 SD MET 1 -26.848 -31.417 2.210 1.00 0.00 ATOM 6 CE MET 1 -25.146 -31.042 2.564 1.00 0.00 ATOM 7 O MET 1 -25.590 -31.290 -2.419 1.00 0.00 ATOM 8 C MET 1 -25.187 -32.416 -2.154 1.00 0.00 ATOM 9 N LEU 2 -23.987 -32.834 -2.513 1.00 0.00 ATOM 10 CA LEU 2 -23.067 -32.040 -3.285 1.00 0.00 ATOM 11 CB LEU 2 -21.634 -32.601 -3.221 1.00 0.00 ATOM 12 CG LEU 2 -21.041 -32.593 -1.812 1.00 0.00 ATOM 13 CD1 LEU 2 -19.759 -33.415 -1.802 1.00 0.00 ATOM 14 CD2 LEU 2 -20.749 -31.153 -1.388 1.00 0.00 ATOM 15 O LEU 2 -23.375 -30.703 -5.271 1.00 0.00 ATOM 16 C LEU 2 -23.535 -31.825 -4.711 1.00 0.00 ATOM 17 N ILE 3 -23.970 -32.882 -5.366 1.00 0.00 ATOM 18 CA ILE 3 -24.410 -32.734 -6.774 1.00 0.00 ATOM 19 CB ILE 3 -24.570 -34.137 -7.412 1.00 0.00 ATOM 20 CG1 ILE 3 -23.204 -34.837 -7.551 1.00 0.00 ATOM 21 CG2 ILE 3 -25.275 -33.990 -8.805 1.00 0.00 ATOM 22 CD1 ILE 3 -23.299 -36.310 -8.025 1.00 0.00 ATOM 23 O ILE 3 -25.743 -30.943 -7.656 1.00 0.00 ATOM 24 C ILE 3 -25.690 -31.886 -6.812 1.00 0.00 ATOM 25 N SER 4 -26.599 -32.090 -5.922 1.00 0.00 ATOM 26 CA SER 4 -27.830 -31.310 -5.894 1.00 0.00 ATOM 27 CB SER 4 -28.793 -31.840 -4.898 1.00 0.00 ATOM 28 OG SER 4 -30.039 -31.170 -4.990 1.00 0.00 ATOM 29 O SER 4 -28.060 -28.925 -6.325 1.00 0.00 ATOM 30 C SER 4 -27.489 -29.845 -5.677 1.00 0.00 ATOM 31 N HIS 5 -26.597 -29.525 -4.763 1.00 0.00 ATOM 32 CA HIS 5 -26.237 -28.129 -4.481 1.00 0.00 ATOM 33 CB HIS 5 -25.403 -27.741 -3.411 1.00 0.00 ATOM 34 CG HIS 5 -25.934 -28.000 -2.037 1.00 0.00 ATOM 35 CD2 HIS 5 -27.194 -28.231 -1.603 1.00 0.00 ATOM 36 ND1 HIS 5 -25.129 -28.031 -0.920 1.00 0.00 ATOM 37 CE1 HIS 5 -25.872 -28.273 0.145 1.00 0.00 ATOM 38 NE2 HIS 5 -27.129 -28.398 -0.242 1.00 0.00 ATOM 39 O HIS 5 -25.979 -26.209 -5.892 1.00 0.00 ATOM 40 C HIS 5 -25.694 -27.410 -5.710 1.00 0.00 ATOM 41 N SER 6 -24.903 -28.121 -6.501 1.00 0.00 ATOM 42 CA SER 6 -24.276 -27.598 -7.716 1.00 0.00 ATOM 43 CB SER 6 -23.263 -28.601 -8.219 1.00 0.00 ATOM 44 OG SER 6 -22.163 -28.658 -7.316 1.00 0.00 ATOM 45 O SER 6 -25.186 -26.334 -9.528 1.00 0.00 ATOM 46 C SER 6 -25.304 -27.326 -8.799 1.00 0.00 ATOM 47 N ASP 7 -26.301 -28.183 -8.902 1.00 0.00 ATOM 48 CA ASP 7 -27.335 -27.934 -9.951 1.00 0.00 ATOM 49 CB ASP 7 -28.226 -29.059 -10.243 1.00 0.00 ATOM 50 CG ASP 7 -27.561 -30.148 -11.067 1.00 0.00 ATOM 51 OD1 ASP 7 -26.369 -30.010 -11.411 1.00 0.00 ATOM 52 OD2 ASP 7 -28.243 -31.148 -11.374 1.00 0.00 ATOM 53 O ASP 7 -28.416 -25.799 -10.336 1.00 0.00 ATOM 54 C ASP 7 -28.148 -26.726 -9.532 1.00 0.00 ATOM 55 N LEU 8 -28.568 -26.702 -8.282 1.00 0.00 ATOM 56 CA LEU 8 -29.357 -25.559 -7.750 1.00 0.00 ATOM 57 CB LEU 8 -29.717 -25.818 -6.271 1.00 0.00 ATOM 58 CG LEU 8 -30.400 -24.638 -5.560 1.00 0.00 ATOM 59 CD1 LEU 8 -31.714 -24.304 -6.242 1.00 0.00 ATOM 60 CD2 LEU 8 -30.611 -25.112 -4.113 1.00 0.00 ATOM 61 O LEU 8 -29.102 -23.290 -8.374 1.00 0.00 ATOM 62 C LEU 8 -28.536 -24.311 -7.985 1.00 0.00 ATOM 63 N ASN 9 -27.233 -24.387 -7.786 1.00 0.00 ATOM 64 CA ASN 9 -26.282 -23.283 -7.965 1.00 0.00 ATOM 65 CB ASN 9 -24.888 -23.556 -7.568 1.00 0.00 ATOM 66 CG ASN 9 -24.676 -23.399 -6.081 1.00 0.00 ATOM 67 ND2 ASN 9 -23.487 -23.783 -5.605 1.00 0.00 ATOM 68 OD1 ASN 9 -25.537 -22.897 -5.366 1.00 0.00 ATOM 69 O ASN 9 -26.380 -21.518 -9.615 1.00 0.00 ATOM 70 C ASN 9 -26.290 -22.742 -9.390 1.00 0.00 ATOM 71 N GLN 10 -26.210 -23.609 -10.396 1.00 0.00 ATOM 72 CA GLN 10 -26.222 -23.128 -11.773 1.00 0.00 ATOM 73 CB GLN 10 -25.800 -24.244 -12.745 1.00 0.00 ATOM 74 CG GLN 10 -25.944 -23.813 -14.206 1.00 0.00 ATOM 75 CD GLN 10 -25.117 -24.652 -15.160 1.00 0.00 ATOM 76 OE1 GLN 10 -24.727 -25.768 -14.842 1.00 0.00 ATOM 77 NE2 GLN 10 -24.859 -24.111 -16.346 1.00 0.00 ATOM 78 O GLN 10 -27.790 -21.608 -12.776 1.00 0.00 ATOM 79 C GLN 10 -27.628 -22.624 -12.103 1.00 0.00 ATOM 80 N GLN 11 -28.652 -23.315 -11.621 1.00 0.00 ATOM 81 CA GLN 11 -30.012 -22.857 -11.900 1.00 0.00 ATOM 82 CB GLN 11 -31.064 -23.871 -11.419 1.00 0.00 ATOM 83 CG GLN 11 -32.492 -23.465 -11.832 1.00 0.00 ATOM 84 CD GLN 11 -33.549 -24.510 -11.524 1.00 0.00 ATOM 85 OE1 GLN 11 -33.328 -25.410 -10.726 1.00 0.00 ATOM 86 NE2 GLN 11 -34.726 -24.369 -12.149 1.00 0.00 ATOM 87 O GLN 11 -30.864 -20.617 -11.841 1.00 0.00 ATOM 88 C GLN 11 -30.251 -21.506 -11.241 1.00 0.00 ATOM 89 N LEU 12 -29.769 -21.343 -10.009 1.00 0.00 ATOM 90 CA LEU 12 -29.940 -20.073 -9.296 1.00 0.00 ATOM 91 CB LEU 12 -29.357 -20.153 -7.872 1.00 0.00 ATOM 92 CG LEU 12 -30.227 -20.825 -6.796 1.00 0.00 ATOM 93 CD1 LEU 12 -29.405 -21.061 -5.506 1.00 0.00 ATOM 94 CD2 LEU 12 -31.441 -19.945 -6.506 1.00 0.00 ATOM 95 O LEU 12 -29.783 -17.854 -10.152 1.00 0.00 ATOM 96 C LEU 12 -29.244 -18.943 -10.034 1.00 0.00 ATOM 97 N LYS 13 -28.037 -19.212 -10.515 1.00 0.00 ATOM 98 CA LYS 13 -27.265 -18.193 -11.198 1.00 0.00 ATOM 99 CB LYS 13 -25.820 -18.677 -11.377 1.00 0.00 ATOM 100 CG LYS 13 -24.866 -17.651 -12.002 1.00 0.00 ATOM 101 CD LYS 13 -24.846 -16.362 -11.192 1.00 0.00 ATOM 102 CE LYS 13 -23.865 -15.349 -11.764 1.00 0.00 ATOM 103 NZ LYS 13 -23.894 -14.074 -10.985 1.00 0.00 ATOM 104 O LYS 13 -27.858 -16.638 -12.925 1.00 0.00 ATOM 105 C LYS 13 -27.856 -17.810 -12.551 1.00 0.00 ATOM 106 N SER 14 -28.368 -18.783 -13.280 1.00 0.00 ATOM 107 CA SER 14 -28.918 -18.542 -14.618 1.00 0.00 ATOM 108 CB SER 14 -29.427 -19.658 -15.388 1.00 0.00 ATOM 109 OG SER 14 -30.678 -20.076 -14.878 1.00 0.00 ATOM 110 O SER 14 -30.038 -16.550 -15.345 1.00 0.00 ATOM 111 C SER 14 -29.998 -17.475 -14.537 1.00 0.00 ATOM 112 N ALA 15 -30.857 -17.602 -13.530 1.00 0.00 ATOM 113 CA ALA 15 -31.938 -16.655 -13.310 1.00 0.00 ATOM 114 CB ALA 15 -33.088 -17.345 -12.585 1.00 0.00 ATOM 115 O ALA 15 -32.354 -14.639 -12.090 1.00 0.00 ATOM 116 C ALA 15 -31.511 -15.384 -12.581 1.00 0.00 ATOM 117 N GLY 16 -30.200 -15.150 -12.511 1.00 0.00 ATOM 118 CA GLY 16 -29.667 -13.951 -11.883 1.00 0.00 ATOM 119 O GLY 16 -29.826 -12.677 -9.872 1.00 0.00 ATOM 120 C GLY 16 -29.804 -13.799 -10.381 1.00 0.00 ATOM 121 N ILE 17 -29.877 -14.914 -9.664 1.00 0.00 ATOM 122 CA ILE 17 -29.994 -14.875 -8.212 1.00 0.00 ATOM 123 CB ILE 17 -30.586 -16.365 -7.827 1.00 0.00 ATOM 124 CG1 ILE 17 -32.003 -16.495 -8.400 1.00 0.00 ATOM 125 CG2 ILE 17 -30.604 -16.528 -6.308 1.00 0.00 ATOM 126 CD1 ILE 17 -32.974 -15.449 -7.904 1.00 0.00 ATOM 127 O ILE 17 -27.651 -15.490 -8.162 1.00 0.00 ATOM 128 C ILE 17 -28.617 -15.010 -7.549 1.00 0.00 ATOM 129 N GLY 18 -28.520 -14.540 -6.312 1.00 0.00 ATOM 130 CA GLY 18 -27.261 -14.607 -5.584 1.00 0.00 ATOM 131 O GLY 18 -28.025 -16.343 -4.102 1.00 0.00 ATOM 132 C GLY 18 -27.105 -15.902 -4.794 1.00 0.00 ATOM 133 N PHE 19 -25.951 -16.540 -4.954 1.00 0.00 ATOM 134 CA PHE 19 -25.654 -17.773 -4.233 1.00 0.00 ATOM 135 CB PHE 19 -24.478 -18.478 -4.886 1.00 0.00 ATOM 136 CG PHE 19 -24.804 -18.947 -6.258 1.00 0.00 ATOM 137 CD1 PHE 19 -24.609 -18.108 -7.354 1.00 0.00 ATOM 138 CD2 PHE 19 -25.275 -20.248 -6.477 1.00 0.00 ATOM 139 CE1 PHE 19 -24.871 -18.548 -8.649 1.00 0.00 ATOM 140 CE2 PHE 19 -25.541 -20.711 -7.766 1.00 0.00 ATOM 141 CZ PHE 19 -25.342 -19.852 -8.850 1.00 0.00 ATOM 142 O PHE 19 -24.484 -16.369 -2.649 1.00 0.00 ATOM 143 C PHE 19 -25.138 -17.402 -2.831 1.00 0.00 ATOM 144 N ASN 20 -25.476 -18.221 -1.839 1.00 0.00 ATOM 145 CA ASN 20 -25.038 -17.985 -0.471 1.00 0.00 ATOM 146 CB ASN 20 -25.970 -18.561 0.551 1.00 0.00 ATOM 147 CG ASN 20 -26.183 -20.073 0.393 1.00 0.00 ATOM 148 ND2 ASN 20 -27.187 -20.585 1.088 1.00 0.00 ATOM 149 OD1 ASN 20 -25.451 -20.764 -0.323 1.00 0.00 ATOM 150 O ASN 20 -23.120 -19.312 -1.104 1.00 0.00 ATOM 151 C ASN 20 -23.602 -18.495 -0.303 1.00 0.00 ATOM 152 N ALA 21 -22.909 -17.990 0.718 1.00 0.00 ATOM 153 CA ALA 21 -21.538 -18.414 0.995 1.00 0.00 ATOM 154 CB ALA 21 -21.011 -17.715 2.250 1.00 0.00 ATOM 155 O ALA 21 -20.609 -20.610 0.633 1.00 0.00 ATOM 156 C ALA 21 -21.496 -19.939 1.167 1.00 0.00 ATOM 157 N THR 22 -22.485 -20.490 1.864 1.00 0.00 ATOM 158 CA THR 22 -22.575 -21.935 2.110 1.00 0.00 ATOM 159 CB THR 22 -23.776 -22.177 3.041 1.00 0.00 ATOM 160 CG2 THR 22 -23.963 -23.656 3.319 1.00 0.00 ATOM 161 OG1 THR 22 -23.476 -21.498 4.292 1.00 0.00 ATOM 162 O THR 22 -22.193 -23.787 0.620 1.00 0.00 ATOM 163 C THR 22 -22.742 -22.682 0.782 1.00 0.00 ATOM 164 N GLU 23 -23.510 -22.144 -0.162 1.00 0.00 ATOM 165 CA GLU 23 -23.713 -22.810 -1.454 1.00 0.00 ATOM 166 CB GLU 23 -24.855 -22.146 -2.241 1.00 0.00 ATOM 167 CG GLU 23 -26.241 -22.444 -1.648 1.00 0.00 ATOM 168 CD GLU 23 -27.384 -21.613 -2.243 1.00 0.00 ATOM 169 OE1 GLU 23 -27.136 -20.531 -2.821 1.00 0.00 ATOM 170 OE2 GLU 23 -28.552 -22.042 -2.107 1.00 0.00 ATOM 171 O GLU 23 -21.979 -23.813 -2.762 1.00 0.00 ATOM 172 C GLU 23 -22.411 -22.788 -2.238 1.00 0.00 ATOM 173 N LEU 24 -21.747 -21.633 -2.241 1.00 0.00 ATOM 174 CA LEU 24 -20.477 -21.472 -2.946 1.00 0.00 ATOM 175 CB LEU 24 -19.993 -20.036 -2.889 1.00 0.00 ATOM 176 CG LEU 24 -20.840 -19.046 -3.696 1.00 0.00 ATOM 177 CD1 LEU 24 -20.370 -17.631 -3.440 1.00 0.00 ATOM 178 CD2 LEU 24 -20.735 -19.382 -5.180 1.00 0.00 ATOM 179 O LEU 24 -18.635 -23.019 -3.129 1.00 0.00 ATOM 180 C LEU 24 -19.399 -22.405 -2.376 1.00 0.00 ATOM 181 N HIS 25 -19.346 -22.539 -1.040 1.00 0.00 ATOM 182 CA HIS 25 -18.378 -23.408 -0.419 1.00 0.00 ATOM 183 CB HIS 25 -18.246 -23.047 1.021 1.00 0.00 ATOM 184 CG HIS 25 -17.430 -21.797 1.159 1.00 0.00 ATOM 185 CD2 HIS 25 -17.929 -20.521 1.059 1.00 0.00 ATOM 186 ND1 HIS 25 -16.125 -21.707 1.325 1.00 0.00 ATOM 187 CE1 HIS 25 -15.808 -20.427 1.315 1.00 0.00 ATOM 188 NE2 HIS 25 -16.903 -19.727 1.156 1.00 0.00 ATOM 189 O HIS 25 -17.809 -25.660 -0.561 1.00 0.00 ATOM 190 C HIS 25 -18.732 -24.869 -0.543 1.00 0.00 ATOM 191 N GLY 26 -19.994 -25.278 -0.612 1.00 0.00 ATOM 192 CA GLY 26 -20.369 -26.669 -0.798 1.00 0.00 ATOM 193 O GLY 26 -19.410 -28.234 -2.402 1.00 0.00 ATOM 194 C GLY 26 -19.924 -27.115 -2.191 1.00 0.00 ATOM 195 N PHE 27 -20.057 -26.200 -3.179 1.00 0.00 ATOM 196 CA PHE 27 -19.644 -26.525 -4.544 1.00 0.00 ATOM 197 CB PHE 27 -20.072 -25.396 -5.510 1.00 0.00 ATOM 198 CG PHE 27 -19.587 -25.632 -6.944 1.00 0.00 ATOM 199 CD1 PHE 27 -20.272 -26.513 -7.770 1.00 0.00 ATOM 200 CD2 PHE 27 -18.446 -24.991 -7.416 1.00 0.00 ATOM 201 CE1 PHE 27 -19.820 -26.753 -9.057 1.00 0.00 ATOM 202 CE2 PHE 27 -18.000 -25.233 -8.709 1.00 0.00 ATOM 203 CZ PHE 27 -18.686 -26.119 -9.534 1.00 0.00 ATOM 204 O PHE 27 -17.578 -27.634 -5.181 1.00 0.00 ATOM 205 C PHE 27 -18.112 -26.704 -4.571 1.00 0.00 ATOM 206 N LEU 28 -17.324 -25.821 -3.949 1.00 0.00 ATOM 207 CA LEU 28 -15.868 -25.944 -3.944 1.00 0.00 ATOM 208 CB LEU 28 -15.215 -24.796 -3.179 1.00 0.00 ATOM 209 CG LEU 28 -15.383 -23.408 -3.804 1.00 0.00 ATOM 210 CD1 LEU 28 -14.850 -22.349 -2.865 1.00 0.00 ATOM 211 CD2 LEU 28 -14.644 -23.359 -5.136 1.00 0.00 ATOM 212 O LEU 28 -14.479 -27.888 -4.022 1.00 0.00 ATOM 213 C LEU 28 -15.341 -27.266 -3.400 1.00 0.00 ATOM 214 N SER 29 -15.857 -27.723 -2.264 1.00 0.00 ATOM 215 CA SER 29 -15.359 -28.989 -1.723 1.00 0.00 ATOM 216 CB SER 29 -15.936 -29.149 -0.314 1.00 0.00 ATOM 217 OG SER 29 -15.342 -28.181 0.548 1.00 0.00 ATOM 218 O SER 29 -15.011 -31.153 -2.691 1.00 0.00 ATOM 219 C SER 29 -15.766 -30.188 -2.575 1.00 0.00 ATOM 220 N GLY 30 -16.946 -30.104 -3.187 1.00 0.00 ATOM 221 CA GLY 30 -17.432 -31.176 -4.038 1.00 0.00 ATOM 222 O GLY 30 -16.370 -32.350 -5.818 1.00 0.00 ATOM 223 C GLY 30 -16.623 -31.261 -5.316 1.00 0.00 ATOM 224 N LEU 31 -16.197 -30.110 -5.831 1.00 0.00 ATOM 225 CA LEU 31 -15.398 -30.074 -7.054 1.00 0.00 ATOM 226 CB LEU 31 -15.281 -28.639 -7.602 1.00 0.00 ATOM 227 CG LEU 31 -14.403 -28.520 -8.838 1.00 0.00 ATOM 228 CD1 LEU 31 -14.588 -29.368 -9.930 1.00 0.00 ATOM 229 CD2 LEU 31 -13.371 -27.584 -8.902 1.00 0.00 ATOM 230 O LEU 31 -13.473 -31.393 -7.584 1.00 0.00 ATOM 231 C LEU 31 -14.010 -30.626 -6.783 1.00 0.00 ATOM 232 N LEU 32 -13.434 -30.227 -5.650 1.00 0.00 ATOM 233 CA LEU 32 -12.094 -30.667 -5.272 1.00 0.00 ATOM 234 CB LEU 32 -11.551 -29.894 -4.097 1.00 0.00 ATOM 235 CG LEU 32 -10.147 -30.351 -3.670 1.00 0.00 ATOM 236 CD1 LEU 32 -9.159 -29.697 -4.602 1.00 0.00 ATOM 237 CD2 LEU 32 -9.831 -29.914 -2.224 1.00 0.00 ATOM 238 O LEU 32 -11.095 -32.837 -5.389 1.00 0.00 ATOM 239 C LEU 32 -12.040 -32.162 -4.981 1.00 0.00 ATOM 240 N CYS 33 -13.057 -32.692 -4.311 1.00 0.00 ATOM 241 CA CYS 33 -13.050 -34.117 -4.001 1.00 0.00 ATOM 242 CB CYS 33 -13.865 -34.345 -2.677 1.00 0.00 ATOM 243 SG CYS 33 -12.930 -33.621 -1.318 1.00 0.00 ATOM 244 O CYS 33 -13.643 -36.254 -4.939 1.00 0.00 ATOM 245 C CYS 33 -13.599 -35.032 -5.107 1.00 0.00 ATOM 246 N GLY 34 -14.048 -34.438 -6.214 1.00 0.00 ATOM 247 CA GLY 34 -14.547 -35.230 -7.328 1.00 0.00 ATOM 248 O GLY 34 -16.409 -36.237 -8.411 1.00 0.00 ATOM 249 C GLY 34 -16.024 -35.562 -7.453 1.00 0.00 ATOM 250 N GLY 35 -16.857 -35.106 -6.523 1.00 0.00 ATOM 251 CA GLY 35 -18.287 -35.391 -6.606 1.00 0.00 ATOM 252 O GLY 35 -20.207 -34.777 -7.926 1.00 0.00 ATOM 253 C GLY 35 -19.057 -34.492 -7.573 1.00 0.00 ATOM 254 N LEU 36 -18.427 -33.391 -7.959 1.00 0.00 ATOM 255 CA LEU 36 -18.998 -32.457 -8.912 1.00 0.00 ATOM 256 CB LEU 36 -19.231 -31.136 -8.297 1.00 0.00 ATOM 257 CG LEU 36 -19.829 -30.980 -6.918 1.00 0.00 ATOM 258 CD1 LEU 36 -20.073 -29.507 -6.614 1.00 0.00 ATOM 259 CD2 LEU 36 -21.144 -31.728 -6.839 1.00 0.00 ATOM 260 O LEU 36 -16.950 -32.035 -10.107 1.00 0.00 ATOM 261 C LEU 36 -18.081 -32.526 -10.135 1.00 0.00 ATOM 262 N LYS 37 -18.533 -33.207 -11.205 1.00 0.00 ATOM 263 CA LYS 37 -17.754 -33.352 -12.441 1.00 0.00 ATOM 264 CB LYS 37 -18.620 -34.094 -13.481 1.00 0.00 ATOM 265 CG LYS 37 -19.030 -35.535 -13.135 1.00 0.00 ATOM 266 CD LYS 37 -19.920 -36.083 -14.226 1.00 0.00 ATOM 267 CE LYS 37 -20.353 -37.553 -13.975 1.00 0.00 ATOM 268 NZ LYS 37 -21.267 -37.895 -15.141 1.00 0.00 ATOM 269 O LYS 37 -18.082 -31.020 -12.884 1.00 0.00 ATOM 270 C LYS 37 -17.418 -32.030 -13.116 1.00 0.00 ATOM 271 N ASP 38 -16.354 -32.040 -13.916 1.00 0.00 ATOM 272 CA ASP 38 -15.914 -30.856 -14.639 1.00 0.00 ATOM 273 CB ASP 38 -14.673 -31.171 -15.472 1.00 0.00 ATOM 274 CG ASP 38 -13.447 -31.397 -14.616 1.00 0.00 ATOM 275 OD1 ASP 38 -13.388 -32.439 -13.930 1.00 0.00 ATOM 276 OD2 ASP 38 -12.549 -30.523 -14.604 1.00 0.00 ATOM 277 O ASP 38 -17.106 -29.023 -15.591 1.00 0.00 ATOM 278 C ASP 38 -16.998 -30.246 -15.527 1.00 0.00 ATOM 279 N GLN 39 -17.819 -31.083 -16.171 1.00 0.00 ATOM 280 CA GLN 39 -18.881 -30.577 -17.052 1.00 0.00 ATOM 281 CB GLN 39 -19.582 -31.716 -17.804 1.00 0.00 ATOM 282 CG GLN 39 -20.493 -32.627 -16.969 1.00 0.00 ATOM 283 CD GLN 39 -19.789 -33.805 -16.360 1.00 0.00 ATOM 284 OE1 GLN 39 -18.601 -33.745 -15.998 1.00 0.00 ATOM 285 NE2 GLN 39 -20.525 -34.905 -16.182 1.00 0.00 ATOM 286 O GLN 39 -20.587 -28.898 -17.005 1.00 0.00 ATOM 287 C GLN 39 -19.923 -29.706 -16.358 1.00 0.00 ATOM 288 N SER 40 -20.069 -29.871 -15.046 1.00 0.00 ATOM 289 CA SER 40 -21.001 -29.045 -14.283 1.00 0.00 ATOM 290 CB SER 40 -21.501 -29.857 -13.104 1.00 0.00 ATOM 291 OG SER 40 -22.373 -30.877 -13.587 1.00 0.00 ATOM 292 O SER 40 -20.893 -26.729 -13.682 1.00 0.00 ATOM 293 C SER 40 -20.288 -27.794 -13.792 1.00 0.00 ATOM 294 N TRP 41 -18.989 -27.920 -13.524 1.00 0.00 ATOM 295 CA TRP 41 -18.191 -26.791 -13.053 1.00 0.00 ATOM 296 CB TRP 41 -16.837 -27.390 -12.500 1.00 0.00 ATOM 297 CG TRP 41 -15.908 -26.317 -11.989 1.00 0.00 ATOM 298 CD1 TRP 41 -16.064 -25.568 -10.855 1.00 0.00 ATOM 299 CD2 TRP 41 -14.715 -25.836 -12.626 1.00 0.00 ATOM 300 CE2 TRP 41 -14.206 -24.785 -11.821 1.00 0.00 ATOM 301 CE3 TRP 41 -14.026 -26.183 -13.795 1.00 0.00 ATOM 302 NE1 TRP 41 -15.048 -24.644 -10.750 1.00 0.00 ATOM 303 CZ2 TRP 41 -13.043 -24.083 -12.153 1.00 0.00 ATOM 304 CZ3 TRP 41 -12.868 -25.482 -14.125 1.00 0.00 ATOM 305 CH2 TRP 41 -12.390 -24.444 -13.305 1.00 0.00 ATOM 306 O TRP 41 -17.838 -24.596 -13.965 1.00 0.00 ATOM 307 C TRP 41 -17.922 -25.803 -14.190 1.00 0.00 ATOM 308 N LEU 42 -17.728 -26.346 -15.402 1.00 0.00 ATOM 309 CA LEU 42 -17.483 -25.488 -16.556 1.00 0.00 ATOM 310 CB LEU 42 -16.922 -26.293 -17.743 1.00 0.00 ATOM 311 CG LEU 42 -16.287 -25.413 -18.815 1.00 0.00 ATOM 312 CD1 LEU 42 -15.048 -24.669 -18.366 1.00 0.00 ATOM 313 CD2 LEU 42 -15.979 -26.303 -19.995 1.00 0.00 ATOM 314 O LEU 42 -18.500 -23.429 -17.176 1.00 0.00 ATOM 315 C LEU 42 -18.688 -24.645 -16.923 1.00 0.00 ATOM 316 N PRO 43 -19.916 -25.161 -16.905 1.00 0.00 ATOM 317 CA PRO 43 -21.081 -24.252 -17.058 1.00 0.00 ATOM 318 CB PRO 43 -22.291 -25.189 -16.989 1.00 0.00 ATOM 319 CG PRO 43 -21.738 -26.546 -17.336 1.00 0.00 ATOM 320 CD PRO 43 -20.319 -26.575 -16.892 1.00 0.00 ATOM 321 O PRO 43 -21.558 -22.059 -16.309 1.00 0.00 ATOM 322 C PRO 43 -21.136 -23.188 -16.020 1.00 0.00 ATOM 323 N LEU 44 -20.745 -23.452 -14.770 1.00 0.00 ATOM 324 CA LEU 44 -20.739 -22.460 -13.748 1.00 0.00 ATOM 325 CB LEU 44 -20.467 -23.091 -12.380 1.00 0.00 ATOM 326 CG LEU 44 -20.530 -22.102 -11.226 1.00 0.00 ATOM 327 CD1 LEU 44 -21.918 -21.496 -11.015 1.00 0.00 ATOM 328 CD2 LEU 44 -20.131 -22.722 -9.894 1.00 0.00 ATOM 329 O LEU 44 -20.046 -20.161 -14.023 1.00 0.00 ATOM 330 C LEU 44 -19.762 -21.358 -14.096 1.00 0.00 ATOM 331 N LEU 45 -18.536 -21.712 -14.509 1.00 0.00 ATOM 332 CA LEU 45 -17.588 -20.694 -14.940 1.00 0.00 ATOM 333 CB LEU 45 -16.234 -21.305 -15.353 1.00 0.00 ATOM 334 CG LEU 45 -15.447 -21.966 -14.221 1.00 0.00 ATOM 335 CD1 LEU 45 -14.219 -22.602 -14.844 1.00 0.00 ATOM 336 CD2 LEU 45 -15.047 -20.988 -13.153 1.00 0.00 ATOM 337 O LEU 45 -17.925 -18.646 -16.131 1.00 0.00 ATOM 338 C LEU 45 -18.162 -19.874 -16.077 1.00 0.00 ATOM 339 N TYR 46 -18.844 -20.488 -17.023 1.00 0.00 ATOM 340 CA TYR 46 -19.370 -19.750 -18.175 1.00 0.00 ATOM 341 CB TYR 46 -19.838 -20.669 -19.296 1.00 0.00 ATOM 342 CG TYR 46 -20.077 -19.887 -20.574 1.00 0.00 ATOM 343 CD1 TYR 46 -19.001 -19.464 -21.345 1.00 0.00 ATOM 344 CD2 TYR 46 -21.352 -19.560 -20.993 1.00 0.00 ATOM 345 CE1 TYR 46 -19.194 -18.725 -22.502 1.00 0.00 ATOM 346 CE2 TYR 46 -21.559 -18.834 -22.158 1.00 0.00 ATOM 347 CZ TYR 46 -20.479 -18.399 -22.892 1.00 0.00 ATOM 348 OH TYR 46 -20.710 -17.673 -24.031 1.00 0.00 ATOM 349 O TYR 46 -20.692 -17.759 -18.106 1.00 0.00 ATOM 350 C TYR 46 -20.543 -18.908 -17.702 1.00 0.00 ATOM 351 N GLN 47 -21.350 -19.460 -16.801 1.00 0.00 ATOM 352 CA GLN 47 -22.482 -18.709 -16.253 1.00 0.00 ATOM 353 CB GLN 47 -23.372 -19.521 -15.305 1.00 0.00 ATOM 354 CG GLN 47 -24.064 -20.673 -16.043 1.00 0.00 ATOM 355 CD GLN 47 -25.026 -20.077 -17.079 1.00 0.00 ATOM 356 OE1 GLN 47 -24.818 -20.451 -18.327 1.00 0.00 ATOM 357 NE2 GLN 47 -25.882 -19.284 -16.693 1.00 0.00 ATOM 358 O GLN 47 -22.626 -16.385 -15.625 1.00 0.00 ATOM 359 C GLN 47 -21.994 -17.439 -15.525 1.00 0.00 ATOM 360 N PHE 48 -20.862 -17.539 -14.819 1.00 0.00 ATOM 361 CA PHE 48 -20.264 -16.388 -14.116 1.00 0.00 ATOM 362 CB PHE 48 -19.079 -16.801 -13.179 1.00 0.00 ATOM 363 CG PHE 48 -19.409 -17.826 -12.138 1.00 0.00 ATOM 364 CD1 PHE 48 -18.443 -18.748 -11.726 1.00 0.00 ATOM 365 CD2 PHE 48 -20.654 -17.841 -11.517 1.00 0.00 ATOM 366 CE1 PHE 48 -18.680 -19.668 -10.731 1.00 0.00 ATOM 367 CE2 PHE 48 -20.947 -18.790 -10.469 1.00 0.00 ATOM 368 CZ PHE 48 -19.933 -19.692 -10.106 1.00 0.00 ATOM 369 O PHE 48 -19.774 -14.153 -14.920 1.00 0.00 ATOM 370 C PHE 48 -19.716 -15.369 -15.135 1.00 0.00 ATOM 371 N SER 49 -19.144 -15.870 -16.225 1.00 0.00 ATOM 372 CA SER 49 -18.612 -14.998 -17.275 1.00 0.00 ATOM 373 CB SER 49 -17.970 -15.672 -18.426 1.00 0.00 ATOM 374 OG SER 49 -18.941 -16.268 -19.264 1.00 0.00 ATOM 375 O SER 49 -19.458 -12.901 -18.109 1.00 0.00 ATOM 376 C SER 49 -19.712 -14.063 -17.804 1.00 0.00 ATOM 377 N ASN 50 -20.938 -14.601 -17.854 1.00 0.00 ATOM 378 CA ASN 50 -22.058 -13.795 -18.368 1.00 0.00 ATOM 379 CB ASN 50 -23.314 -14.685 -18.352 1.00 0.00 ATOM 380 CG ASN 50 -23.198 -15.745 -19.433 1.00 0.00 ATOM 381 ND2 ASN 50 -23.879 -16.871 -19.286 1.00 0.00 ATOM 382 OD1 ASN 50 -22.511 -15.489 -20.424 1.00 0.00 ATOM 383 O ASN 50 -22.562 -11.511 -18.105 1.00 0.00 ATOM 384 C ASN 50 -22.335 -12.562 -17.550 1.00 0.00 ATOM 385 N ASP 51 -22.275 -12.602 -16.219 1.00 0.00 ATOM 386 CA ASP 51 -22.529 -11.413 -15.405 1.00 0.00 ATOM 387 CB ASP 51 -23.245 -11.800 -14.107 1.00 0.00 ATOM 388 CG ASP 51 -24.731 -12.043 -14.297 1.00 0.00 ATOM 389 OD1 ASP 51 -25.253 -11.789 -15.408 1.00 0.00 ATOM 390 OD2 ASP 51 -25.378 -12.471 -13.317 1.00 0.00 ATOM 391 O ASP 51 -20.808 -10.693 -13.888 1.00 0.00 ATOM 392 C ASP 51 -21.238 -10.681 -15.040 1.00 0.00 ATOM 393 N ASN 52 -20.591 -10.079 -16.039 1.00 0.00 ATOM 394 CA ASN 52 -19.503 -9.179 -15.790 1.00 0.00 ATOM 395 CB ASN 52 -19.940 -7.920 -15.029 1.00 0.00 ATOM 396 CG ASN 52 -19.213 -6.651 -15.468 1.00 0.00 ATOM 397 ND2 ASN 52 -18.087 -6.836 -16.148 1.00 0.00 ATOM 398 OD1 ASN 52 -19.670 -5.499 -15.220 1.00 0.00 ATOM 399 O ASN 52 -17.599 -9.203 -14.374 1.00 0.00 ATOM 400 C ASN 52 -18.306 -9.833 -15.140 1.00 0.00 ATOM 401 N HIS 53 -18.000 -11.063 -15.597 1.00 0.00 ATOM 402 CA HIS 53 -16.818 -11.783 -15.194 1.00 0.00 ATOM 403 CB HIS 53 -17.127 -13.100 -14.456 1.00 0.00 ATOM 404 CG HIS 53 -17.253 -12.988 -13.002 1.00 0.00 ATOM 405 CD2 HIS 53 -18.017 -12.131 -12.251 1.00 0.00 ATOM 406 ND1 HIS 53 -16.638 -13.879 -12.181 1.00 0.00 ATOM 407 CE1 HIS 53 -17.066 -13.610 -10.973 1.00 0.00 ATOM 408 NE2 HIS 53 -17.894 -12.543 -10.963 1.00 0.00 ATOM 409 O HIS 53 -15.531 -13.390 -16.341 1.00 0.00 ATOM 410 C HIS 53 -16.036 -12.259 -16.384 1.00 0.00 ATOM 411 N ALA 54 -15.892 -11.471 -17.416 1.00 0.00 ATOM 412 CA ALA 54 -15.070 -11.922 -18.557 1.00 0.00 ATOM 413 CB ALA 54 -15.218 -10.937 -19.692 1.00 0.00 ATOM 414 O ALA 54 -13.112 -11.101 -17.470 1.00 0.00 ATOM 415 C ALA 54 -13.592 -11.983 -18.177 1.00 0.00 ATOM 416 N TYR 55 -12.870 -12.995 -18.624 1.00 0.00 ATOM 417 CA TYR 55 -11.431 -13.073 -18.269 1.00 0.00 ATOM 418 CB TYR 55 -11.122 -14.499 -17.754 1.00 0.00 ATOM 419 CG TYR 55 -11.861 -14.801 -16.462 1.00 0.00 ATOM 420 CD1 TYR 55 -13.225 -15.062 -16.495 1.00 0.00 ATOM 421 CD2 TYR 55 -11.204 -14.808 -15.241 1.00 0.00 ATOM 422 CE1 TYR 55 -13.921 -15.336 -15.328 1.00 0.00 ATOM 423 CE2 TYR 55 -11.897 -15.079 -14.065 1.00 0.00 ATOM 424 CZ TYR 55 -13.250 -15.340 -14.125 1.00 0.00 ATOM 425 OH TYR 55 -13.961 -15.612 -12.975 1.00 0.00 ATOM 426 O TYR 55 -11.000 -13.039 -20.571 1.00 0.00 ATOM 427 C TYR 55 -10.597 -12.735 -19.434 1.00 0.00 ATOM 428 N PRO 56 -9.485 -12.085 -19.208 1.00 0.00 ATOM 429 CA PRO 56 -8.527 -11.841 -20.322 1.00 0.00 ATOM 430 CB PRO 56 -7.806 -10.573 -19.778 1.00 0.00 ATOM 431 CG PRO 56 -7.908 -10.683 -18.289 1.00 0.00 ATOM 432 CD PRO 56 -9.330 -11.153 -18.086 1.00 0.00 ATOM 433 O PRO 56 -7.406 -13.781 -19.434 1.00 0.00 ATOM 434 C PRO 56 -7.550 -12.993 -20.336 1.00 0.00 ATOM 435 N THR 57 -6.839 -13.070 -21.469 1.00 0.00 ATOM 436 CA THR 57 -6.006 -14.205 -21.780 1.00 0.00 ATOM 437 CB THR 57 -5.240 -14.241 -22.998 1.00 0.00 ATOM 438 CG2 THR 57 -6.181 -14.390 -24.172 1.00 0.00 ATOM 439 OG1 THR 57 -4.532 -13.023 -23.081 1.00 0.00 ATOM 440 O THR 57 -4.703 -15.526 -20.220 1.00 0.00 ATOM 441 C THR 57 -4.972 -14.422 -20.625 1.00 0.00 ATOM 442 N GLY 58 -4.430 -13.278 -20.136 1.00 0.00 ATOM 443 CA GLY 58 -3.438 -13.437 -19.074 1.00 0.00 ATOM 444 O GLY 58 -3.161 -14.507 -16.883 1.00 0.00 ATOM 445 C GLY 58 -3.935 -14.040 -17.778 1.00 0.00 ATOM 446 N LEU 59 -5.229 -14.009 -17.582 1.00 0.00 ATOM 447 CA LEU 59 -5.788 -14.593 -16.388 1.00 0.00 ATOM 448 CB LEU 59 -7.266 -13.874 -16.393 1.00 0.00 ATOM 449 CG LEU 59 -7.234 -12.387 -16.025 1.00 0.00 ATOM 450 CD1 LEU 59 -8.614 -11.785 -16.174 1.00 0.00 ATOM 451 CD2 LEU 59 -6.738 -12.230 -14.592 1.00 0.00 ATOM 452 O LEU 59 -6.142 -16.714 -15.470 1.00 0.00 ATOM 453 C LEU 59 -5.905 -16.096 -16.518 1.00 0.00 ATOM 454 N VAL 60 -5.780 -16.730 -17.684 1.00 0.00 ATOM 455 CA VAL 60 -6.090 -18.153 -17.721 1.00 0.00 ATOM 456 CB VAL 60 -6.067 -18.728 -19.138 1.00 0.00 ATOM 457 CG1 VAL 60 -6.218 -20.239 -19.125 1.00 0.00 ATOM 458 CG2 VAL 60 -7.193 -18.095 -19.968 1.00 0.00 ATOM 459 O VAL 60 -5.563 -19.819 -16.025 1.00 0.00 ATOM 460 C VAL 60 -5.155 -18.981 -16.834 1.00 0.00 ATOM 461 N GLN 61 -3.842 -18.722 -16.961 1.00 0.00 ATOM 462 CA GLN 61 -2.883 -19.439 -16.105 1.00 0.00 ATOM 463 CB GLN 61 -1.456 -19.105 -16.563 1.00 0.00 ATOM 464 CG GLN 61 -1.083 -19.814 -17.865 1.00 0.00 ATOM 465 CD GLN 61 0.266 -19.393 -18.422 1.00 0.00 ATOM 466 OE1 GLN 61 0.914 -20.156 -19.147 1.00 0.00 ATOM 467 NE2 GLN 61 0.690 -18.178 -18.100 1.00 0.00 ATOM 468 O GLN 61 -2.933 -19.899 -13.736 1.00 0.00 ATOM 469 C GLN 61 -3.108 -19.078 -14.639 1.00 0.00 ATOM 470 N PRO 62 -3.439 -17.835 -14.369 1.00 0.00 ATOM 471 CA PRO 62 -3.591 -17.353 -12.999 1.00 0.00 ATOM 472 CB PRO 62 -3.761 -15.872 -13.104 1.00 0.00 ATOM 473 CG PRO 62 -3.041 -15.522 -14.371 1.00 0.00 ATOM 474 CD PRO 62 -3.347 -16.677 -15.304 1.00 0.00 ATOM 475 O PRO 62 -4.609 -18.506 -11.147 1.00 0.00 ATOM 476 C PRO 62 -4.761 -18.034 -12.274 1.00 0.00 ATOM 477 N VAL 63 -5.917 -18.101 -12.930 1.00 0.00 ATOM 478 CA VAL 63 -7.098 -18.721 -12.332 1.00 0.00 ATOM 479 CB VAL 63 -8.320 -18.499 -13.292 1.00 0.00 ATOM 480 CG1 VAL 63 -9.522 -19.289 -12.811 1.00 0.00 ATOM 481 CG2 VAL 63 -8.664 -17.003 -13.354 1.00 0.00 ATOM 482 O VAL 63 -7.331 -20.727 -11.067 1.00 0.00 ATOM 483 C VAL 63 -6.898 -20.204 -12.095 1.00 0.00 ATOM 484 N THR 64 -6.208 -20.871 -13.018 1.00 0.00 ATOM 485 CA THR 64 -5.929 -22.299 -12.878 1.00 0.00 ATOM 486 CB THR 64 -5.232 -22.740 -14.200 1.00 0.00 ATOM 487 CG2 THR 64 -4.859 -24.209 -14.160 1.00 0.00 ATOM 488 OG1 THR 64 -6.192 -22.527 -15.269 1.00 0.00 ATOM 489 O THR 64 -5.167 -23.609 -11.016 1.00 0.00 ATOM 490 C THR 64 -5.043 -22.567 -11.663 1.00 0.00 ATOM 491 N GLU 65 -4.150 -21.633 -11.346 1.00 0.00 ATOM 492 CA GLU 65 -3.288 -21.785 -10.195 1.00 0.00 ATOM 493 CB GLU 65 -2.274 -20.603 -10.089 1.00 0.00 ATOM 494 CG GLU 65 -1.330 -20.809 -8.909 1.00 0.00 ATOM 495 CD GLU 65 -0.033 -20.041 -8.958 1.00 0.00 ATOM 496 OE1 GLU 65 0.129 -19.113 -9.776 1.00 0.00 ATOM 497 OE2 GLU 65 0.876 -20.368 -8.155 1.00 0.00 ATOM 498 O GLU 65 -3.769 -22.707 -8.061 1.00 0.00 ATOM 499 C GLU 65 -4.105 -21.892 -8.905 1.00 0.00 ATOM 500 N LEU 66 -5.167 -21.125 -8.695 1.00 0.00 ATOM 501 CA LEU 66 -5.924 -21.160 -7.467 1.00 0.00 ATOM 502 CB LEU 66 -7.016 -20.034 -7.562 1.00 0.00 ATOM 503 CG LEU 66 -7.975 -20.024 -6.363 1.00 0.00 ATOM 504 CD1 LEU 66 -7.219 -19.677 -5.082 1.00 0.00 ATOM 505 CD2 LEU 66 -9.080 -19.053 -6.625 1.00 0.00 ATOM 506 O LEU 66 -6.648 -22.992 -6.115 1.00 0.00 ATOM 507 C LEU 66 -6.574 -22.520 -7.260 1.00 0.00 ATOM 508 N TYR 67 -7.040 -23.181 -8.347 1.00 0.00 ATOM 509 CA TYR 67 -7.642 -24.509 -8.263 1.00 0.00 ATOM 510 CB TYR 67 -8.392 -24.947 -9.451 1.00 0.00 ATOM 511 CG TYR 67 -9.702 -24.230 -9.620 1.00 0.00 ATOM 512 CD1 TYR 67 -9.813 -23.116 -10.445 1.00 0.00 ATOM 513 CD2 TYR 67 -10.839 -24.657 -8.925 1.00 0.00 ATOM 514 CE1 TYR 67 -11.028 -22.443 -10.582 1.00 0.00 ATOM 515 CE2 TYR 67 -12.049 -23.990 -9.047 1.00 0.00 ATOM 516 CZ TYR 67 -12.135 -22.885 -9.881 1.00 0.00 ATOM 517 OH TYR 67 -13.336 -22.225 -10.029 1.00 0.00 ATOM 518 O TYR 67 -6.766 -26.425 -7.125 1.00 0.00 ATOM 519 C TYR 67 -6.558 -25.504 -7.919 1.00 0.00 ATOM 520 N GLU 68 -5.354 -25.325 -8.409 1.00 0.00 ATOM 521 CA GLU 68 -4.221 -26.142 -7.965 1.00 0.00 ATOM 522 CB GLU 68 -2.954 -25.803 -8.778 1.00 0.00 ATOM 523 CG GLU 68 -3.061 -26.357 -10.188 1.00 0.00 ATOM 524 CD GLU 68 -1.921 -25.926 -11.055 1.00 0.00 ATOM 525 OE1 GLU 68 -1.189 -24.949 -10.792 1.00 0.00 ATOM 526 OE2 GLU 68 -1.711 -26.609 -12.100 1.00 0.00 ATOM 527 O GLU 68 -3.670 -26.949 -5.760 1.00 0.00 ATOM 528 C GLU 68 -3.891 -25.946 -6.470 1.00 0.00 ATOM 529 N GLN 69 -3.838 -24.690 -5.966 1.00 0.00 ATOM 530 CA GLN 69 -3.617 -24.416 -4.563 1.00 0.00 ATOM 531 CB GLN 69 -3.546 -22.888 -4.328 1.00 0.00 ATOM 532 CG GLN 69 -3.106 -22.539 -2.920 1.00 0.00 ATOM 533 CD GLN 69 -4.205 -21.902 -2.100 1.00 0.00 ATOM 534 OE1 GLN 69 -5.225 -22.531 -1.800 1.00 0.00 ATOM 535 NE2 GLN 69 -4.002 -20.636 -1.724 1.00 0.00 ATOM 536 O GLN 69 -4.400 -25.667 -2.713 1.00 0.00 ATOM 537 C GLN 69 -4.715 -25.016 -3.712 1.00 0.00 ATOM 538 N ILE 70 -5.990 -24.884 -4.050 1.00 0.00 ATOM 539 CA ILE 70 -7.025 -25.464 -3.206 1.00 0.00 ATOM 540 CB ILE 70 -8.428 -24.933 -3.806 1.00 0.00 ATOM 541 CG1 ILE 70 -8.508 -23.395 -3.650 1.00 0.00 ATOM 542 CG2 ILE 70 -9.579 -25.650 -3.140 1.00 0.00 ATOM 543 CD1 ILE 70 -9.647 -22.789 -4.462 1.00 0.00 ATOM 544 O ILE 70 -7.277 -27.566 -2.100 1.00 0.00 ATOM 545 C ILE 70 -6.995 -26.999 -3.158 1.00 0.00 ATOM 546 N SER 71 -6.595 -27.712 -4.223 1.00 0.00 ATOM 547 CA SER 71 -6.545 -29.150 -4.180 1.00 0.00 ATOM 548 CB SER 71 -6.366 -29.762 -5.504 1.00 0.00 ATOM 549 OG SER 71 -7.555 -29.589 -6.272 1.00 0.00 ATOM 550 O SER 71 -5.606 -30.414 -2.432 1.00 0.00 ATOM 551 C SER 71 -5.385 -29.550 -3.279 1.00 0.00 ATOM 552 N GLN 72 -4.186 -28.989 -3.371 1.00 0.00 ATOM 553 CA GLN 72 -3.088 -29.454 -2.540 1.00 0.00 ATOM 554 CB GLN 72 -1.838 -28.645 -2.745 1.00 0.00 ATOM 555 CG GLN 72 -1.155 -28.863 -4.059 1.00 0.00 ATOM 556 CD GLN 72 0.187 -28.174 -4.068 1.00 0.00 ATOM 557 OE1 GLN 72 0.275 -26.968 -4.207 1.00 0.00 ATOM 558 NE2 GLN 72 1.243 -28.945 -3.868 1.00 0.00 ATOM 559 O GLN 72 -3.118 -30.220 -0.258 1.00 0.00 ATOM 560 C GLN 72 -3.464 -29.357 -1.064 1.00 0.00 ATOM 561 N THR 73 -4.181 -28.300 -0.705 1.00 0.00 ATOM 562 CA THR 73 -4.583 -28.108 0.678 1.00 0.00 ATOM 563 CB THR 73 -5.002 -26.655 0.905 1.00 0.00 ATOM 564 CG2 THR 73 -5.391 -26.415 2.350 1.00 0.00 ATOM 565 OG1 THR 73 -3.872 -25.802 0.574 1.00 0.00 ATOM 566 O THR 73 -5.538 -29.661 2.169 1.00 0.00 ATOM 567 C THR 73 -5.663 -29.044 1.125 1.00 0.00 ATOM 568 N LEU 74 -6.721 -29.159 0.342 1.00 0.00 ATOM 569 CA LEU 74 -7.817 -30.048 0.690 1.00 0.00 ATOM 570 CB LEU 74 -8.899 -30.053 -0.354 1.00 0.00 ATOM 571 CG LEU 74 -9.710 -28.755 -0.428 1.00 0.00 ATOM 572 CD1 LEU 74 -10.660 -28.805 -1.606 1.00 0.00 ATOM 573 CD2 LEU 74 -10.483 -28.565 0.871 1.00 0.00 ATOM 574 O LEU 74 -7.657 -32.161 1.826 1.00 0.00 ATOM 575 C LEU 74 -7.273 -31.457 0.899 1.00 0.00 ATOM 576 N SER 75 -6.337 -31.830 0.043 1.00 0.00 ATOM 577 CA SER 75 -5.673 -33.126 0.095 1.00 0.00 ATOM 578 CB SER 75 -4.645 -33.293 -0.978 1.00 0.00 ATOM 579 OG SER 75 -4.002 -34.551 -0.869 1.00 0.00 ATOM 580 O SER 75 -5.119 -34.321 2.115 1.00 0.00 ATOM 581 C SER 75 -5.022 -33.273 1.472 1.00 0.00 ATOM 582 N ASP 76 -4.378 -32.198 1.918 1.00 0.00 ATOM 583 CA ASP 76 -3.704 -32.153 3.211 1.00 0.00 ATOM 584 CB ASP 76 -2.607 -31.063 3.167 1.00 0.00 ATOM 585 CG ASP 76 -3.063 -29.646 2.993 1.00 0.00 ATOM 586 OD1 ASP 76 -4.289 -29.435 3.034 1.00 0.00 ATOM 587 OD2 ASP 76 -2.158 -28.791 2.768 1.00 0.00 ATOM 588 O ASP 76 -4.300 -31.485 5.442 1.00 0.00 ATOM 589 C ASP 76 -4.698 -31.857 4.345 1.00 0.00 ATOM 590 N VAL 77 -5.987 -32.018 4.060 1.00 0.00 ATOM 591 CA VAL 77 -7.068 -31.795 5.018 1.00 0.00 ATOM 592 CB VAL 77 -6.325 -32.945 6.134 1.00 0.00 ATOM 593 CG1 VAL 77 -6.937 -32.838 7.518 1.00 0.00 ATOM 594 CG2 VAL 77 -6.559 -34.353 5.564 1.00 0.00 ATOM 595 O VAL 77 -7.671 -30.155 6.695 1.00 0.00 ATOM 596 C VAL 77 -7.277 -30.380 5.538 1.00 0.00 ATOM 597 N GLU 78 -7.025 -29.431 4.650 1.00 0.00 ATOM 598 CA GLU 78 -7.212 -28.028 4.933 1.00 0.00 ATOM 599 CB GLU 78 -6.077 -27.159 4.751 1.00 0.00 ATOM 600 CG GLU 78 -4.884 -27.384 5.698 1.00 0.00 ATOM 601 CD GLU 78 -5.223 -27.164 7.179 1.00 0.00 ATOM 602 OE1 GLU 78 -6.229 -26.472 7.483 1.00 0.00 ATOM 603 OE2 GLU 78 -4.478 -27.688 8.046 1.00 0.00 ATOM 604 O GLU 78 -8.453 -27.919 2.874 1.00 0.00 ATOM 605 C GLU 78 -8.453 -27.727 4.096 1.00 0.00 ATOM 606 N GLY 79 -9.524 -27.315 4.770 1.00 0.00 ATOM 607 CA GLY 79 -10.800 -27.036 4.118 1.00 0.00 ATOM 608 O GLY 79 -12.329 -25.262 3.648 1.00 0.00 ATOM 609 C GLY 79 -11.284 -25.589 4.206 1.00 0.00 ATOM 610 N PHE 80 -10.546 -24.734 4.911 1.00 0.00 ATOM 611 CA PHE 80 -10.927 -23.334 5.055 1.00 0.00 ATOM 612 CB PHE 80 -10.113 -22.745 6.271 1.00 0.00 ATOM 613 CG PHE 80 -10.564 -21.366 6.677 1.00 0.00 ATOM 614 CD1 PHE 80 -10.288 -20.265 5.873 1.00 0.00 ATOM 615 CD2 PHE 80 -11.272 -21.172 7.863 1.00 0.00 ATOM 616 CE1 PHE 80 -10.713 -18.971 6.249 1.00 0.00 ATOM 617 CE2 PHE 80 -11.701 -19.889 8.249 1.00 0.00 ATOM 618 CZ PHE 80 -11.419 -18.789 7.436 1.00 0.00 ATOM 619 O PHE 80 -9.352 -22.511 3.433 1.00 0.00 ATOM 620 C PHE 80 -10.522 -22.529 3.819 1.00 0.00 ATOM 621 N THR 81 -11.512 -21.940 3.158 1.00 0.00 ATOM 622 CA THR 81 -11.271 -21.119 1.971 1.00 0.00 ATOM 623 CB THR 81 -12.457 -21.206 1.004 1.00 0.00 ATOM 624 CG2 THR 81 -12.212 -20.322 -0.208 1.00 0.00 ATOM 625 OG1 THR 81 -12.611 -22.564 0.574 1.00 0.00 ATOM 626 O THR 81 -11.923 -19.202 3.248 1.00 0.00 ATOM 627 C THR 81 -11.122 -19.674 2.438 1.00 0.00 ATOM 628 N PHE 82 -10.092 -18.987 1.948 1.00 0.00 ATOM 629 CA PHE 82 -9.849 -17.601 2.349 1.00 0.00 ATOM 630 CB PHE 82 -8.353 -17.447 2.873 1.00 0.00 ATOM 631 CG PHE 82 -8.246 -17.994 4.292 1.00 0.00 ATOM 632 CD1 PHE 82 -8.639 -17.236 5.391 1.00 0.00 ATOM 633 CD2 PHE 82 -7.810 -19.298 4.498 1.00 0.00 ATOM 634 CE1 PHE 82 -8.613 -17.764 6.677 1.00 0.00 ATOM 635 CE2 PHE 82 -7.742 -19.846 5.776 1.00 0.00 ATOM 636 CZ PHE 82 -8.158 -19.068 6.850 1.00 0.00 ATOM 637 O PHE 82 -9.465 -16.784 0.110 1.00 0.00 ATOM 638 C PHE 82 -9.984 -16.584 1.215 1.00 0.00 ATOM 639 N GLU 83 -10.676 -15.487 1.524 1.00 0.00 ATOM 640 CA GLU 83 -10.906 -14.377 0.593 1.00 0.00 ATOM 641 CB GLU 83 -12.429 -13.919 0.918 1.00 0.00 ATOM 642 CG GLU 83 -12.793 -12.674 0.159 1.00 0.00 ATOM 643 CD GLU 83 -14.087 -12.020 0.639 1.00 0.00 ATOM 644 OE1 GLU 83 -14.521 -12.273 1.792 1.00 0.00 ATOM 645 OE2 GLU 83 -14.646 -11.220 -0.139 1.00 0.00 ATOM 646 O GLU 83 -9.791 -13.003 2.262 1.00 0.00 ATOM 647 C GLU 83 -10.153 -13.114 1.085 1.00 0.00 ATOM 648 N LEU 84 -9.932 -12.178 0.153 1.00 0.00 ATOM 649 CA LEU 84 -9.226 -10.922 0.497 1.00 0.00 ATOM 650 CB LEU 84 -8.320 -10.523 -0.657 1.00 0.00 ATOM 651 CG LEU 84 -7.396 -11.576 -1.269 1.00 0.00 ATOM 652 CD1 LEU 84 -6.345 -10.959 -2.202 1.00 0.00 ATOM 653 CD2 LEU 84 -6.695 -12.375 -0.204 1.00 0.00 ATOM 654 O LEU 84 -9.807 -8.641 0.994 1.00 0.00 ATOM 655 C LEU 84 -10.190 -9.795 0.882 1.00 0.00 ATOM 656 N GLY 85 -11.475 -10.111 1.067 1.00 0.00 ATOM 657 CA GLY 85 -12.393 -9.116 1.572 1.00 0.00 ATOM 658 O GLY 85 -13.493 -7.123 0.828 1.00 0.00 ATOM 659 C GLY 85 -12.940 -8.182 0.525 1.00 0.00 ATOM 660 N LEU 86 -12.836 -8.527 -0.751 1.00 0.00 ATOM 661 CA LEU 86 -13.342 -7.656 -1.757 1.00 0.00 ATOM 662 CB LEU 86 -12.524 -7.761 -3.051 1.00 0.00 ATOM 663 CG LEU 86 -10.991 -7.387 -2.879 1.00 0.00 ATOM 664 CD1 LEU 86 -10.269 -7.617 -4.231 1.00 0.00 ATOM 665 CD2 LEU 86 -10.815 -5.912 -2.423 1.00 0.00 ATOM 666 O LEU 86 -15.168 -9.116 -2.088 1.00 0.00 ATOM 667 C LEU 86 -14.740 -7.962 -2.199 1.00 0.00 ATOM 668 N THR 87 -15.425 -6.976 -2.750 1.00 0.00 ATOM 669 CA THR 87 -16.754 -7.201 -3.313 1.00 0.00 ATOM 670 CB THR 87 -17.471 -5.874 -3.631 1.00 0.00 ATOM 671 CG2 THR 87 -17.585 -5.018 -2.379 1.00 0.00 ATOM 672 OG1 THR 87 -16.740 -5.153 -4.632 1.00 0.00 ATOM 673 O THR 87 -15.374 -8.001 -5.093 1.00 0.00 ATOM 674 C THR 87 -16.508 -7.952 -4.617 1.00 0.00 ATOM 675 N GLU 88 -17.544 -8.541 -5.205 1.00 0.00 ATOM 676 CA GLU 88 -17.337 -9.265 -6.454 1.00 0.00 ATOM 677 CB GLU 88 -18.609 -10.009 -6.876 1.00 0.00 ATOM 678 CG GLU 88 -19.062 -11.009 -5.829 1.00 0.00 ATOM 679 CD GLU 88 -20.184 -11.920 -6.294 1.00 0.00 ATOM 680 OE1 GLU 88 -20.967 -12.351 -5.425 1.00 0.00 ATOM 681 OE2 GLU 88 -20.282 -12.218 -7.503 1.00 0.00 ATOM 682 O GLU 88 -16.074 -8.730 -8.409 1.00 0.00 ATOM 683 C GLU 88 -16.867 -8.332 -7.557 1.00 0.00 ATOM 684 N ASP 89 -17.339 -7.088 -7.534 1.00 0.00 ATOM 685 CA ASP 89 -16.928 -6.106 -8.536 1.00 0.00 ATOM 686 CB ASP 89 -17.614 -4.798 -8.452 1.00 0.00 ATOM 687 CG ASP 89 -19.060 -4.768 -8.894 1.00 0.00 ATOM 688 OD1 ASP 89 -19.900 -4.212 -8.247 1.00 0.00 ATOM 689 OD2 ASP 89 -19.328 -5.420 -9.957 1.00 0.00 ATOM 690 O ASP 89 -14.691 -5.829 -9.365 1.00 0.00 ATOM 691 C ASP 89 -15.436 -5.816 -8.384 1.00 0.00 ATOM 692 N GLU 90 -14.994 -5.556 -7.159 1.00 0.00 ATOM 693 CA GLU 90 -13.585 -5.275 -6.895 1.00 0.00 ATOM 694 CB GLU 90 -13.368 -4.891 -5.426 1.00 0.00 ATOM 695 CG GLU 90 -14.223 -3.720 -4.946 1.00 0.00 ATOM 696 CD GLU 90 -15.692 -4.097 -4.762 1.00 0.00 ATOM 697 OE1 GLU 90 -16.005 -4.904 -3.859 1.00 0.00 ATOM 698 OE2 GLU 90 -16.540 -3.590 -5.524 1.00 0.00 ATOM 699 O GLU 90 -11.614 -6.362 -7.715 1.00 0.00 ATOM 700 C GLU 90 -12.737 -6.497 -7.232 1.00 0.00 ATOM 701 N ASN 91 -13.278 -7.684 -6.969 1.00 0.00 ATOM 702 CA ASN 91 -12.570 -8.929 -7.260 1.00 0.00 ATOM 703 CB ASN 91 -13.330 -10.113 -6.658 1.00 0.00 ATOM 704 CG ASN 91 -13.383 -10.062 -5.141 1.00 0.00 ATOM 705 ND2 ASN 91 -13.678 -11.199 -4.522 1.00 0.00 ATOM 706 OD1 ASN 91 -13.173 -9.012 -4.535 1.00 0.00 ATOM 707 O ASN 91 -11.324 -9.399 -9.276 1.00 0.00 ATOM 708 C ASN 91 -12.416 -9.118 -8.778 1.00 0.00 ATOM 709 N VAL 92 -13.519 -8.960 -9.505 1.00 0.00 ATOM 710 CA VAL 92 -13.511 -9.094 -10.957 1.00 0.00 ATOM 711 CB VAL 92 -14.920 -8.844 -11.528 1.00 0.00 ATOM 712 CG1 VAL 92 -14.900 -8.978 -13.046 1.00 0.00 ATOM 713 CG2 VAL 92 -15.909 -9.826 -10.907 1.00 0.00 ATOM 714 O VAL 92 -11.796 -8.465 -12.525 1.00 0.00 ATOM 715 C VAL 92 -12.529 -8.114 -11.595 1.00 0.00 ATOM 716 N PHE 93 -12.529 -6.882 -11.076 1.00 0.00 ATOM 717 CA PHE 93 -11.627 -5.858 -11.582 1.00 0.00 ATOM 718 CB PHE 93 -11.904 -4.512 -10.912 1.00 0.00 ATOM 719 CG PHE 93 -10.958 -3.430 -11.336 1.00 0.00 ATOM 720 CD1 PHE 93 -10.972 -2.946 -12.642 1.00 0.00 ATOM 721 CD2 PHE 93 -10.016 -2.927 -10.443 1.00 0.00 ATOM 722 CE1 PHE 93 -10.055 -1.974 -13.056 1.00 0.00 ATOM 723 CE2 PHE 93 -9.099 -1.961 -10.847 1.00 0.00 ATOM 724 CZ PHE 93 -9.118 -1.484 -12.155 1.00 0.00 ATOM 725 O PHE 93 -9.292 -5.763 -12.134 1.00 0.00 ATOM 726 C PHE 93 -10.155 -6.229 -11.391 1.00 0.00 ATOM 727 N THR 94 -9.859 -7.057 -10.396 1.00 0.00 ATOM 728 CA THR 94 -8.475 -7.455 -10.184 1.00 0.00 ATOM 729 CB THR 94 -8.339 -8.425 -8.994 1.00 0.00 ATOM 730 CG2 THR 94 -6.893 -8.861 -8.824 1.00 0.00 ATOM 731 OG1 THR 94 -8.767 -7.764 -7.798 1.00 0.00 ATOM 732 O THR 94 -6.855 -7.801 -11.919 1.00 0.00 ATOM 733 C THR 94 -7.942 -8.125 -11.448 1.00 0.00 ATOM 734 N GLN 95 -8.708 -9.044 -12.019 1.00 0.00 ATOM 735 CA GLN 95 -8.291 -9.739 -13.233 1.00 0.00 ATOM 736 CB GLN 95 -9.301 -10.823 -13.602 1.00 0.00 ATOM 737 CG GLN 95 -9.508 -11.824 -12.501 1.00 0.00 ATOM 738 CD GLN 95 -10.372 -12.986 -12.920 1.00 0.00 ATOM 739 OE1 GLN 95 -10.519 -13.276 -14.114 1.00 0.00 ATOM 740 NE2 GLN 95 -10.944 -13.671 -11.941 1.00 0.00 ATOM 741 O GLN 95 -7.320 -9.089 -15.315 1.00 0.00 ATOM 742 C GLN 95 -8.098 -8.798 -14.412 1.00 0.00 ATOM 743 N ALA 96 -8.800 -7.669 -14.393 1.00 0.00 ATOM 744 CA ALA 96 -8.706 -6.675 -15.458 1.00 0.00 ATOM 745 CB ALA 96 -9.900 -5.736 -15.397 1.00 0.00 ATOM 746 O ALA 96 -7.051 -5.186 -16.388 1.00 0.00 ATOM 747 C ALA 96 -7.393 -5.867 -15.415 1.00 0.00 ATOM 748 N ASP 97 -6.678 -5.945 -14.293 1.00 0.00 ATOM 749 CA ASP 97 -5.408 -5.226 -14.089 1.00 0.00 ATOM 750 CB ASP 97 -5.202 -4.907 -12.603 1.00 0.00 ATOM 751 CG ASP 97 -6.266 -3.994 -12.030 1.00 0.00 ATOM 752 OD1 ASP 97 -6.735 -3.083 -12.733 1.00 0.00 ATOM 753 OD2 ASP 97 -6.602 -4.166 -10.842 1.00 0.00 ATOM 754 O ASP 97 -3.071 -5.507 -14.499 1.00 0.00 ATOM 755 C ASP 97 -4.184 -6.026 -14.529 1.00 0.00 ATOM 756 N SER 98 -4.380 -7.288 -14.886 1.00 0.00 ATOM 757 CA SER 98 -3.277 -8.177 -15.263 1.00 0.00 ATOM 758 CB SER 98 -2.455 -7.590 -16.411 1.00 0.00 ATOM 759 OG SER 98 -1.392 -8.463 -16.766 1.00 0.00 ATOM 760 O SER 98 -2.110 -9.536 -13.673 1.00 0.00 ATOM 761 C SER 98 -2.380 -8.398 -14.053 1.00 0.00 ATOM 762 N LEU 99 -1.897 -7.328 -13.445 1.00 0.00 ATOM 763 CA LEU 99 -1.076 -7.393 -12.258 1.00 0.00 ATOM 764 CB LEU 99 -0.004 -6.260 -12.265 1.00 0.00 ATOM 765 CG LEU 99 1.069 -6.342 -13.339 1.00 0.00 ATOM 766 CD1 LEU 99 1.912 -5.043 -13.294 1.00 0.00 ATOM 767 CD2 LEU 99 1.945 -7.576 -13.129 1.00 0.00 ATOM 768 O LEU 99 -1.212 -7.771 -9.919 1.00 0.00 ATOM 769 C LEU 99 -1.744 -7.298 -10.942 1.00 0.00 ATOM 770 N SER 100 -2.927 -6.643 -10.918 1.00 0.00 ATOM 771 CA SER 100 -3.548 -6.325 -9.631 1.00 0.00 ATOM 772 CB SER 100 -4.579 -5.198 -9.761 1.00 0.00 ATOM 773 OG SER 100 -5.661 -5.623 -10.593 1.00 0.00 ATOM 774 O SER 100 -4.705 -7.416 -7.875 1.00 0.00 ATOM 775 C SER 100 -4.226 -7.551 -9.003 1.00 0.00 ATOM 776 N ASP 101 -4.263 -8.696 -9.683 1.00 0.00 ATOM 777 CA ASP 101 -5.049 -9.820 -9.193 1.00 0.00 ATOM 778 CB ASP 101 -5.638 -10.624 -10.345 1.00 0.00 ATOM 779 CG ASP 101 -6.837 -11.389 -9.917 1.00 0.00 ATOM 780 OD1 ASP 101 -7.327 -11.282 -8.794 1.00 0.00 ATOM 781 OD2 ASP 101 -7.403 -12.109 -10.738 1.00 0.00 ATOM 782 O ASP 101 -3.995 -11.825 -8.526 1.00 0.00 ATOM 783 C ASP 101 -4.293 -10.713 -8.146 1.00 0.00 ATOM 784 N TRP 102 -4.155 -10.126 -6.950 1.00 0.00 ATOM 785 CA TRP 102 -3.447 -10.950 -5.894 1.00 0.00 ATOM 786 CB TRP 102 -1.925 -10.738 -5.906 1.00 0.00 ATOM 787 CG TRP 102 -1.397 -9.394 -5.539 1.00 0.00 ATOM 788 CD1 TRP 102 -1.048 -8.385 -6.428 1.00 0.00 ATOM 789 CD2 TRP 102 -1.145 -8.841 -4.220 1.00 0.00 ATOM 790 CE2 TRP 102 -0.685 -7.530 -4.388 1.00 0.00 ATOM 791 CE3 TRP 102 -1.317 -9.349 -2.937 1.00 0.00 ATOM 792 NE1 TRP 102 -0.630 -7.272 -5.744 1.00 0.00 ATOM 793 CZ2 TRP 102 -0.313 -6.738 -3.303 1.00 0.00 ATOM 794 CZ3 TRP 102 -0.979 -8.558 -1.856 1.00 0.00 ATOM 795 CH2 TRP 102 -0.473 -7.289 -2.034 1.00 0.00 ATOM 796 O TRP 102 -4.590 -9.461 -4.262 1.00 0.00 ATOM 797 C TRP 102 -4.040 -10.553 -4.555 1.00 0.00 ATOM 798 N ALA 103 -3.973 -11.523 -3.602 1.00 0.00 ATOM 799 CA ALA 103 -4.404 -11.287 -2.231 1.00 0.00 ATOM 800 CB ALA 103 -5.915 -11.476 -2.012 1.00 0.00 ATOM 801 O ALA 103 -3.231 -13.385 -1.789 1.00 0.00 ATOM 802 C ALA 103 -3.622 -12.307 -1.323 1.00 0.00 ATOM 803 N ASN 104 -3.491 -11.887 -0.064 1.00 0.00 ATOM 804 CA ASN 104 -2.879 -12.744 0.946 1.00 0.00 ATOM 805 CB ASN 104 -2.049 -11.892 1.913 1.00 0.00 ATOM 806 CG ASN 104 -0.916 -11.166 1.222 1.00 0.00 ATOM 807 ND2 ASN 104 -0.470 -10.056 1.803 1.00 0.00 ATOM 808 OD1 ASN 104 -0.435 -11.611 0.185 1.00 0.00 ATOM 809 O ASN 104 -3.372 -14.659 2.280 1.00 0.00 ATOM 810 C ASN 104 -3.804 -13.640 1.749 1.00 0.00 ATOM 811 N GLN 105 -5.084 -13.292 1.847 1.00 0.00 ATOM 812 CA GLN 105 -6.043 -14.071 2.621 1.00 0.00 ATOM 813 CB GLN 105 -7.387 -13.346 2.691 1.00 0.00 ATOM 814 CG GLN 105 -7.306 -11.997 3.372 1.00 0.00 ATOM 815 CD GLN 105 -8.492 -11.725 4.277 1.00 0.00 ATOM 816 OE1 GLN 105 -8.449 -12.008 5.480 1.00 0.00 ATOM 817 NE2 GLN 105 -9.556 -11.163 3.708 1.00 0.00 ATOM 818 O GLN 105 -6.401 -16.445 2.799 1.00 0.00 ATOM 819 C GLN 105 -6.241 -15.476 2.051 1.00 0.00 ATOM 820 N PHE 106 -6.203 -15.582 0.729 1.00 0.00 ATOM 821 CA PHE 106 -6.370 -16.868 0.051 1.00 0.00 ATOM 822 CB PHE 106 -6.564 -16.639 -1.451 1.00 0.00 ATOM 823 CG PHE 106 -6.766 -17.864 -2.300 1.00 0.00 ATOM 824 CD1 PHE 106 -7.905 -18.622 -2.094 1.00 0.00 ATOM 825 CD2 PHE 106 -5.827 -18.270 -3.228 1.00 0.00 ATOM 826 CE1 PHE 106 -8.133 -19.777 -2.864 1.00 0.00 ATOM 827 CE2 PHE 106 -6.044 -19.395 -3.977 1.00 0.00 ATOM 828 CZ PHE 106 -7.193 -20.135 -3.774 1.00 0.00 ATOM 829 O PHE 106 -5.491 -19.034 0.605 1.00 0.00 ATOM 830 C PHE 106 -5.236 -17.863 0.332 1.00 0.00 ATOM 831 N LEU 107 -3.989 -17.413 0.237 1.00 0.00 ATOM 832 CA LEU 107 -2.857 -18.301 0.476 1.00 0.00 ATOM 833 CB LEU 107 -1.632 -17.478 -0.219 1.00 0.00 ATOM 834 CG LEU 107 -0.263 -18.143 -0.013 1.00 0.00 ATOM 835 CD1 LEU 107 -0.225 -19.503 -0.706 1.00 0.00 ATOM 836 CD2 LEU 107 0.807 -17.236 -0.532 1.00 0.00 ATOM 837 O LEU 107 -1.955 -19.568 2.317 1.00 0.00 ATOM 838 C LEU 107 -2.571 -18.558 1.962 1.00 0.00 ATOM 839 N LEU 108 -3.022 -17.649 2.825 1.00 0.00 ATOM 840 CA LEU 108 -2.825 -17.812 4.264 1.00 0.00 ATOM 841 CB LEU 108 -2.989 -16.348 4.849 1.00 0.00 ATOM 842 CG LEU 108 -1.803 -15.430 4.535 1.00 0.00 ATOM 843 CD1 LEU 108 -2.096 -14.024 5.008 1.00 0.00 ATOM 844 CD2 LEU 108 -0.549 -15.972 5.213 1.00 0.00 ATOM 845 O LEU 108 -3.704 -19.324 5.917 1.00 0.00 ATOM 846 C LEU 108 -3.884 -18.764 4.834 1.00 0.00 ATOM 847 N GLY 109 -4.968 -18.956 4.087 1.00 0.00 ATOM 848 CA GLY 109 -6.043 -19.841 4.505 1.00 0.00 ATOM 849 O GLY 109 -6.356 -22.202 4.807 1.00 0.00 ATOM 850 C GLY 109 -5.646 -21.312 4.341 1.00 0.00 ATOM 851 N ILE 110 -4.554 -21.571 3.628 1.00 0.00 ATOM 852 CA ILE 110 -4.091 -22.943 3.448 1.00 0.00 ATOM 853 CB ILE 110 -4.074 -22.865 1.741 1.00 0.00 ATOM 854 CG1 ILE 110 -5.546 -22.877 1.260 1.00 0.00 ATOM 855 CG2 ILE 110 -3.267 -24.013 1.186 1.00 0.00 ATOM 856 CD1 ILE 110 -5.673 -22.543 -0.220 1.00 0.00 ATOM 857 O ILE 110 -2.082 -24.157 3.938 1.00 0.00 ATOM 858 C ILE 110 -2.767 -23.160 4.169 1.00 0.00 ATOM 859 N GLY 111 -2.394 -22.200 5.010 1.00 0.00 ATOM 860 CA GLY 111 -1.177 -22.326 5.790 1.00 0.00 ATOM 861 O GLY 111 1.129 -21.821 5.978 1.00 0.00 ATOM 862 C GLY 111 0.077 -21.589 5.383 1.00 0.00 ATOM 863 N LEU 112 -0.028 -20.689 4.394 1.00 0.00 ATOM 864 CA LEU 112 1.186 -19.950 3.971 1.00 0.00 ATOM 865 CB LEU 112 0.898 -19.160 2.643 1.00 0.00 ATOM 866 CG LEU 112 0.707 -20.049 1.396 1.00 0.00 ATOM 867 CD1 LEU 112 0.090 -19.318 0.227 1.00 0.00 ATOM 868 CD2 LEU 112 2.094 -20.634 1.058 1.00 0.00 ATOM 869 O LEU 112 2.845 -18.873 5.361 1.00 0.00 ATOM 870 C LEU 112 1.635 -18.988 5.077 1.00 0.00 ATOM 871 N ALA 113 0.708 -18.285 5.686 1.00 0.00 ATOM 872 CA ALA 113 1.103 -17.286 6.736 1.00 0.00 ATOM 873 CB ALA 113 -0.096 -16.407 7.043 1.00 0.00 ATOM 874 O ALA 113 2.563 -17.458 8.619 1.00 0.00 ATOM 875 C ALA 113 1.659 -17.994 7.939 1.00 0.00 ATOM 876 N GLN 114 1.125 -19.190 8.245 1.00 0.00 ATOM 877 CA GLN 114 1.609 -19.938 9.414 1.00 0.00 ATOM 878 CB GLN 114 0.706 -21.185 9.705 1.00 0.00 ATOM 879 CG GLN 114 -0.563 -20.676 10.397 1.00 0.00 ATOM 880 CD GLN 114 -1.649 -21.666 10.639 1.00 0.00 ATOM 881 OE1 GLN 114 -2.608 -21.345 11.380 1.00 0.00 ATOM 882 NE2 GLN 114 -1.652 -22.878 10.106 1.00 0.00 ATOM 883 O GLN 114 3.883 -20.445 10.109 1.00 0.00 ATOM 884 C GLN 114 3.049 -20.475 9.168 1.00 0.00 ATOM 885 N PRO 115 3.296 -21.021 8.005 1.00 0.00 ATOM 886 CA PRO 115 4.624 -21.591 7.722 1.00 0.00 ATOM 887 CB PRO 115 4.444 -22.205 6.316 1.00 0.00 ATOM 888 CG PRO 115 3.447 -21.347 5.667 1.00 0.00 ATOM 889 CD PRO 115 2.482 -20.924 6.775 1.00 0.00 ATOM 890 O PRO 115 6.974 -21.034 7.972 1.00 0.00 ATOM 891 C PRO 115 5.828 -20.634 7.757 1.00 0.00 ATOM 892 N GLU 116 5.565 -19.363 7.503 1.00 0.00 ATOM 893 CA GLU 116 6.624 -18.393 7.447 1.00 0.00 ATOM 894 CB GLU 116 6.860 -17.886 6.002 1.00 0.00 ATOM 895 CG GLU 116 6.777 -18.997 4.921 1.00 0.00 ATOM 896 CD GLU 116 7.120 -18.499 3.481 1.00 0.00 ATOM 897 OE1 GLU 116 7.168 -17.241 3.274 1.00 0.00 ATOM 898 OE2 GLU 116 7.375 -19.368 2.572 1.00 0.00 ATOM 899 O GLU 116 7.035 -16.204 8.273 1.00 0.00 ATOM 900 C GLU 116 6.548 -17.306 8.488 1.00 0.00 ATOM 901 N LEU 117 5.947 -17.606 9.627 1.00 0.00 ATOM 902 CA LEU 117 5.945 -16.683 10.754 1.00 0.00 ATOM 903 CB LEU 117 5.102 -17.235 11.886 1.00 0.00 ATOM 904 CG LEU 117 3.591 -17.203 11.689 1.00 0.00 ATOM 905 CD1 LEU 117 2.917 -17.934 12.832 1.00 0.00 ATOM 906 CD2 LEU 117 3.100 -15.765 11.634 1.00 0.00 ATOM 907 O LEU 117 7.653 -15.305 11.706 1.00 0.00 ATOM 908 C LEU 117 7.336 -16.420 11.275 1.00 0.00 ATOM 909 N ALA 118 8.153 -17.469 11.193 1.00 0.00 ATOM 910 CA ALA 118 9.544 -17.335 11.653 1.00 0.00 ATOM 911 CB ALA 118 10.181 -18.738 11.710 1.00 0.00 ATOM 912 O ALA 118 10.107 -16.226 9.535 1.00 0.00 ATOM 913 C ALA 118 10.389 -16.448 10.729 1.00 0.00 ATOM 914 N LYS 119 11.468 -15.881 11.285 1.00 0.00 ATOM 915 CA LYS 119 12.393 -15.050 10.555 1.00 0.00 ATOM 916 CB LYS 119 13.403 -14.424 11.503 1.00 0.00 ATOM 917 CG LYS 119 14.150 -13.278 10.860 1.00 0.00 ATOM 918 CD LYS 119 15.142 -12.689 11.854 1.00 0.00 ATOM 919 CE LYS 119 16.402 -12.212 11.139 1.00 0.00 ATOM 920 NZ LYS 119 17.531 -11.940 12.122 1.00 0.00 ATOM 921 O LYS 119 13.159 -15.249 8.336 1.00 0.00 ATOM 922 C LYS 119 13.037 -15.843 9.415 1.00 0.00 ATOM 923 N GLU 120 13.315 -17.092 9.514 1.00 0.00 ATOM 924 CA GLU 120 13.827 -17.988 8.485 1.00 0.00 ATOM 925 CB GLU 120 14.167 -19.361 8.936 1.00 0.00 ATOM 926 CG GLU 120 15.320 -20.051 9.562 1.00 0.00 ATOM 927 CD GLU 120 15.050 -21.520 9.996 1.00 0.00 ATOM 928 OE1 GLU 120 14.173 -22.168 9.320 1.00 0.00 ATOM 929 OE2 GLU 120 15.654 -22.050 10.984 1.00 0.00 ATOM 930 O GLU 120 13.118 -18.503 6.232 1.00 0.00 ATOM 931 C GLU 120 12.775 -18.205 7.384 1.00 0.00 ATOM 932 N LYS 121 11.500 -18.065 7.654 1.00 0.00 ATOM 933 CA LYS 121 10.402 -18.215 6.758 1.00 0.00 ATOM 934 CB LYS 121 9.166 -18.809 7.406 1.00 0.00 ATOM 935 CG LYS 121 9.253 -20.104 8.085 1.00 0.00 ATOM 936 CD LYS 121 9.803 -21.203 7.262 1.00 0.00 ATOM 937 CE LYS 121 9.799 -22.516 8.015 1.00 0.00 ATOM 938 NZ LYS 121 10.108 -23.693 7.186 1.00 0.00 ATOM 939 O LYS 121 9.098 -16.909 5.238 1.00 0.00 ATOM 940 C LYS 121 9.994 -16.911 6.114 1.00 0.00 ATOM 941 N GLY 122 10.638 -15.805 6.513 1.00 0.00 ATOM 942 CA GLY 122 10.348 -14.487 5.942 1.00 0.00 ATOM 943 O GLY 122 9.944 -13.867 3.659 1.00 0.00 ATOM 944 C GLY 122 10.684 -14.455 4.453 1.00 0.00 ATOM 945 N GLU 123 11.792 -15.098 4.087 1.00 0.00 ATOM 946 CA GLU 123 12.232 -15.160 2.695 1.00 0.00 ATOM 947 CB GLU 123 13.546 -15.924 2.560 1.00 0.00 ATOM 948 CG GLU 123 14.761 -15.296 3.192 1.00 0.00 ATOM 949 CD GLU 123 16.018 -16.066 2.843 1.00 0.00 ATOM 950 OE1 GLU 123 16.216 -17.162 3.393 1.00 0.00 ATOM 951 OE2 GLU 123 16.797 -15.591 1.992 1.00 0.00 ATOM 952 O GLU 123 10.807 -15.382 0.787 1.00 0.00 ATOM 953 C GLU 123 11.184 -15.872 1.848 1.00 0.00 ATOM 954 N ILE 124 10.709 -17.019 2.332 1.00 0.00 ATOM 955 CA ILE 124 9.696 -17.795 1.615 1.00 0.00 ATOM 956 CB ILE 124 9.473 -19.144 2.437 1.00 0.00 ATOM 957 CG1 ILE 124 10.772 -19.960 2.480 1.00 0.00 ATOM 958 CG2 ILE 124 8.363 -19.981 1.801 1.00 0.00 ATOM 959 CD1 ILE 124 11.303 -20.354 1.111 1.00 0.00 ATOM 960 O ILE 124 7.707 -17.156 0.448 1.00 0.00 ATOM 961 C ILE 124 8.393 -17.016 1.452 1.00 0.00 ATOM 962 N GLY 125 8.047 -16.205 2.449 1.00 0.00 ATOM 963 CA GLY 125 6.821 -15.410 2.391 1.00 0.00 ATOM 964 O GLY 125 5.971 -14.276 0.451 1.00 0.00 ATOM 965 C GLY 125 6.901 -14.401 1.251 1.00 0.00 ATOM 966 N GLU 126 8.021 -13.686 1.192 1.00 0.00 ATOM 967 CA GLU 126 8.255 -12.680 0.160 1.00 0.00 ATOM 968 CB GLU 126 9.518 -11.903 0.465 1.00 0.00 ATOM 969 CG GLU 126 9.731 -10.710 -0.428 1.00 0.00 ATOM 970 CD GLU 126 10.505 -10.936 -1.695 1.00 0.00 ATOM 971 OE1 GLU 126 11.077 -12.037 -1.895 1.00 0.00 ATOM 972 OE2 GLU 126 10.562 -9.956 -2.468 1.00 0.00 ATOM 973 O GLU 126 7.660 -12.833 -2.164 1.00 0.00 ATOM 974 C GLU 126 8.284 -13.326 -1.221 1.00 0.00 ATOM 975 N ALA 127 9.018 -14.428 -1.340 1.00 0.00 ATOM 976 CA ALA 127 9.126 -15.143 -2.606 1.00 0.00 ATOM 977 CB ALA 127 10.036 -16.357 -2.454 1.00 0.00 ATOM 978 O ALA 127 7.494 -15.504 -4.316 1.00 0.00 ATOM 979 C ALA 127 7.756 -15.568 -3.122 1.00 0.00 ATOM 980 N VAL 128 6.880 -15.999 -2.218 1.00 0.00 ATOM 981 CA VAL 128 5.537 -16.416 -2.612 1.00 0.00 ATOM 982 CB VAL 128 4.718 -16.919 -1.419 1.00 0.00 ATOM 983 CG1 VAL 128 3.274 -17.161 -1.816 1.00 0.00 ATOM 984 CG2 VAL 128 5.340 -18.216 -0.879 1.00 0.00 ATOM 985 O VAL 128 4.170 -15.453 -4.346 1.00 0.00 ATOM 986 C VAL 128 4.786 -15.272 -3.292 1.00 0.00 ATOM 987 N ASP 129 4.877 -14.087 -2.723 1.00 0.00 ATOM 988 CA ASP 129 4.229 -12.937 -3.282 1.00 0.00 ATOM 989 CB ASP 129 4.625 -11.679 -2.514 1.00 0.00 ATOM 990 CG ASP 129 3.612 -11.184 -1.505 1.00 0.00 ATOM 991 OD1 ASP 129 2.392 -11.495 -1.843 1.00 0.00 ATOM 992 OD2 ASP 129 3.901 -10.507 -0.507 1.00 0.00 ATOM 993 O ASP 129 3.949 -12.393 -5.566 1.00 0.00 ATOM 994 C ASP 129 4.727 -12.721 -4.685 1.00 0.00 ATOM 995 N ASP 130 6.052 -12.765 -4.868 1.00 0.00 ATOM 996 CA ASP 130 6.626 -12.576 -6.192 1.00 0.00 ATOM 997 CB ASP 130 8.152 -12.628 -6.117 1.00 0.00 ATOM 998 CG ASP 130 8.810 -12.051 -7.353 1.00 0.00 ATOM 999 OD1 ASP 130 8.414 -10.938 -7.764 1.00 0.00 ATOM 1000 OD2 ASP 130 9.720 -12.701 -7.904 1.00 0.00 ATOM 1001 O ASP 130 5.785 -13.343 -8.305 1.00 0.00 ATOM 1002 C ASP 130 6.104 -13.640 -7.154 1.00 0.00 ATOM 1003 N LEU 131 6.005 -14.879 -6.680 1.00 0.00 ATOM 1004 CA LEU 131 5.504 -15.971 -7.509 1.00 0.00 ATOM 1005 CB LEU 131 5.707 -17.316 -6.807 1.00 0.00 ATOM 1006 CG LEU 131 7.045 -18.031 -7.000 1.00 0.00 ATOM 1007 CD1 LEU 131 7.115 -19.246 -6.084 1.00 0.00 ATOM 1008 CD2 LEU 131 7.192 -18.449 -8.455 1.00 0.00 ATOM 1009 O LEU 131 3.611 -15.928 -8.981 1.00 0.00 ATOM 1010 C LEU 131 4.025 -15.796 -7.830 1.00 0.00 ATOM 1011 N GLN 132 3.246 -15.491 -6.798 1.00 0.00 ATOM 1012 CA GLN 132 1.790 -15.326 -6.985 1.00 0.00 ATOM 1013 CB GLN 132 1.159 -14.933 -5.627 1.00 0.00 ATOM 1014 CG GLN 132 -0.344 -14.665 -5.702 1.00 0.00 ATOM 1015 CD GLN 132 -0.910 -14.415 -4.345 1.00 0.00 ATOM 1016 OE1 GLN 132 -0.841 -15.228 -3.405 1.00 0.00 ATOM 1017 NE2 GLN 132 -1.476 -13.238 -4.062 1.00 0.00 ATOM 1018 O GLN 132 0.692 -14.408 -8.949 1.00 0.00 ATOM 1019 C GLN 132 1.539 -14.229 -8.030 1.00 0.00 ATOM 1020 N ASP 133 2.290 -13.133 -7.921 1.00 0.00 ATOM 1021 CA ASP 133 2.077 -11.969 -8.822 1.00 0.00 ATOM 1022 CB ASP 133 2.886 -10.771 -8.317 1.00 0.00 ATOM 1023 CG ASP 133 2.323 -10.131 -7.052 1.00 0.00 ATOM 1024 OD1 ASP 133 1.218 -10.401 -6.594 1.00 0.00 ATOM 1025 OD2 ASP 133 3.123 -9.298 -6.529 1.00 0.00 ATOM 1026 O ASP 133 1.740 -11.984 -11.190 1.00 0.00 ATOM 1027 C ASP 133 2.472 -12.341 -10.226 1.00 0.00 ATOM 1028 N ILE 134 3.557 -13.075 -10.427 1.00 0.00 ATOM 1029 CA ILE 134 4.005 -13.494 -11.750 1.00 0.00 ATOM 1030 CB ILE 134 5.301 -14.332 -11.613 1.00 0.00 ATOM 1031 CG1 ILE 134 6.480 -13.422 -11.267 1.00 0.00 ATOM 1032 CG2 ILE 134 5.569 -15.160 -12.874 1.00 0.00 ATOM 1033 CD1 ILE 134 7.698 -14.167 -10.787 1.00 0.00 ATOM 1034 O ILE 134 2.614 -14.215 -13.564 1.00 0.00 ATOM 1035 C ILE 134 2.907 -14.340 -12.384 1.00 0.00 ATOM 1036 N CYS 135 2.299 -15.207 -11.590 1.00 0.00 ATOM 1037 CA CYS 135 1.221 -16.068 -12.068 1.00 0.00 ATOM 1038 CB CYS 135 0.833 -17.100 -10.983 1.00 0.00 ATOM 1039 SG CYS 135 2.116 -18.322 -10.572 1.00 0.00 ATOM 1040 O CYS 135 -0.602 -15.570 -13.568 1.00 0.00 ATOM 1041 C CYS 135 -0.013 -15.268 -12.518 1.00 0.00 ATOM 1042 N GLN 136 -0.390 -14.245 -11.746 1.00 0.00 ATOM 1043 CA GLN 136 -1.543 -13.409 -12.091 1.00 0.00 ATOM 1044 CB GLN 136 -1.812 -12.366 -11.018 1.00 0.00 ATOM 1045 CG GLN 136 -1.932 -12.894 -9.596 1.00 0.00 ATOM 1046 CD GLN 136 -2.112 -11.773 -8.553 1.00 0.00 ATOM 1047 OE1 GLN 136 -1.884 -11.987 -7.354 1.00 0.00 ATOM 1048 NE2 GLN 136 -2.521 -10.575 -9.010 1.00 0.00 ATOM 1049 O GLN 136 -2.156 -12.545 -14.237 1.00 0.00 ATOM 1050 C GLN 136 -1.278 -12.645 -13.376 1.00 0.00 ATOM 1051 N LEU 137 -0.069 -12.092 -13.487 1.00 0.00 ATOM 1052 CA LEU 137 0.321 -11.302 -14.656 1.00 0.00 ATOM 1053 CB LEU 137 1.328 -10.279 -13.757 1.00 0.00 ATOM 1054 CG LEU 137 0.529 -9.218 -12.992 1.00 0.00 ATOM 1055 CD1 LEU 137 1.453 -8.400 -12.120 1.00 0.00 ATOM 1056 CD2 LEU 137 -0.200 -8.319 -13.986 1.00 0.00 ATOM 1057 O LEU 137 1.786 -11.658 -16.537 1.00 0.00 ATOM 1058 C LEU 137 1.010 -12.163 -15.717 1.00 0.00 ATOM 1059 N GLY 138 0.714 -13.459 -15.698 1.00 0.00 ATOM 1060 CA GLY 138 1.305 -14.420 -16.632 1.00 0.00 ATOM 1061 O GLY 138 2.304 -14.127 -18.791 1.00 0.00 ATOM 1062 C GLY 138 1.307 -13.966 -18.090 1.00 0.00 ATOM 1063 N TYR 139 0.187 -13.403 -18.540 1.00 0.00 ATOM 1064 CA TYR 139 0.049 -12.954 -19.926 1.00 0.00 ATOM 1065 CB TYR 139 -1.280 -12.527 -20.367 1.00 0.00 ATOM 1066 CG TYR 139 -1.799 -11.340 -19.587 1.00 0.00 ATOM 1067 CD1 TYR 139 -1.381 -10.033 -19.874 1.00 0.00 ATOM 1068 CD2 TYR 139 -2.716 -11.518 -18.546 1.00 0.00 ATOM 1069 CE1 TYR 139 -1.865 -8.940 -19.153 1.00 0.00 ATOM 1070 CE2 TYR 139 -3.205 -10.428 -17.820 1.00 0.00 ATOM 1071 CZ TYR 139 -2.772 -9.141 -18.132 1.00 0.00 ATOM 1072 OH TYR 139 -3.245 -8.062 -17.434 1.00 0.00 ATOM 1073 O TYR 139 1.365 -11.801 -21.558 1.00 0.00 ATOM 1074 C TYR 139 1.064 -11.907 -20.368 1.00 0.00 ATOM 1075 N ASP 140 1.601 -11.153 -19.412 1.00 0.00 ATOM 1076 CA ASP 140 2.582 -10.115 -19.725 1.00 0.00 ATOM 1077 CB ASP 140 2.527 -8.983 -18.689 1.00 0.00 ATOM 1078 CG ASP 140 1.267 -8.143 -18.795 1.00 0.00 ATOM 1079 OD1 ASP 140 0.598 -8.186 -19.846 1.00 0.00 ATOM 1080 OD2 ASP 140 0.951 -7.421 -17.822 1.00 0.00 ATOM 1081 O ASP 140 4.967 -9.908 -19.878 1.00 0.00 ATOM 1082 C ASP 140 4.006 -10.666 -19.775 1.00 0.00 ATOM 1083 N GLU 141 4.134 -11.988 -19.692 1.00 0.00 ATOM 1084 CA GLU 141 5.443 -12.638 -19.728 1.00 0.00 ATOM 1085 CB GLU 141 5.444 -14.058 -19.432 1.00 0.00 ATOM 1086 CG GLU 141 4.787 -14.460 -18.150 1.00 0.00 ATOM 1087 CD GLU 141 4.837 -15.982 -17.972 1.00 0.00 ATOM 1088 OE1 GLU 141 4.547 -16.699 -18.974 1.00 0.00 ATOM 1089 OE2 GLU 141 5.164 -16.463 -16.851 1.00 0.00 ATOM 1090 O GLU 141 7.218 -12.193 -21.285 1.00 0.00 ATOM 1091 C GLU 141 6.029 -12.473 -21.123 1.00 0.00 ATOM 1092 N ASP 142 5.165 -12.630 -22.120 1.00 0.00 ATOM 1093 CA ASP 142 5.534 -12.515 -23.521 1.00 0.00 ATOM 1094 CB ASP 142 6.668 -13.371 -23.953 1.00 0.00 ATOM 1095 CG ASP 142 6.316 -14.839 -23.816 1.00 0.00 ATOM 1096 OD1 ASP 142 5.115 -15.170 -23.749 1.00 0.00 ATOM 1097 OD2 ASP 142 7.250 -15.667 -23.792 1.00 0.00 ATOM 1098 O ASP 142 3.237 -13.035 -24.005 1.00 0.00 ATOM 1099 C ASP 142 4.283 -12.499 -24.388 1.00 0.00 ATOM 1100 N ASP 143 4.399 -11.890 -25.563 1.00 0.00 ATOM 1101 CA ASP 143 3.287 -11.836 -26.504 1.00 0.00 ATOM 1102 CB ASP 143 3.203 -10.846 -27.515 1.00 0.00 ATOM 1103 CG ASP 143 4.410 -10.859 -28.412 1.00 0.00 ATOM 1104 OD1 ASP 143 5.082 -11.895 -28.551 1.00 0.00 ATOM 1105 OD2 ASP 143 4.718 -9.784 -29.003 1.00 0.00 ATOM 1106 O ASP 143 2.076 -13.569 -27.657 1.00 0.00 ATOM 1107 C ASP 143 3.150 -13.207 -27.172 1.00 0.00 ATOM 1108 N ASN 144 4.251 -13.954 -27.185 1.00 0.00 ATOM 1109 CA ASN 144 4.295 -15.298 -27.756 1.00 0.00 ATOM 1110 CB ASN 144 5.745 -15.734 -28.018 1.00 0.00 ATOM 1111 CG ASN 144 5.852 -17.220 -28.400 1.00 0.00 ATOM 1112 ND2 ASN 144 7.062 -17.774 -28.331 1.00 0.00 ATOM 1113 OD1 ASN 144 4.847 -17.859 -28.725 1.00 0.00 ATOM 1114 O ASN 144 4.166 -16.501 -25.686 1.00 0.00 ATOM 1115 C ASN 144 3.627 -16.247 -26.761 1.00 0.00 ATOM 1116 N GLU 145 2.454 -16.760 -27.127 1.00 0.00 ATOM 1117 CA GLU 145 1.704 -17.673 -26.271 1.00 0.00 ATOM 1118 CB GLU 145 0.359 -18.008 -26.911 1.00 0.00 ATOM 1119 CG GLU 145 -0.579 -16.804 -27.015 1.00 0.00 ATOM 1120 CD GLU 145 -1.777 -17.042 -27.927 1.00 0.00 ATOM 1121 OE1 GLU 145 -2.400 -16.044 -28.346 1.00 0.00 ATOM 1122 OE2 GLU 145 -2.096 -18.216 -28.228 1.00 0.00 ATOM 1123 O GLU 145 2.336 -19.496 -24.854 1.00 0.00 ATOM 1124 C GLU 145 2.473 -18.947 -25.944 1.00 0.00 ATOM 1125 N GLU 146 3.269 -19.418 -26.900 1.00 0.00 ATOM 1126 CA GLU 146 4.076 -20.619 -26.720 1.00 0.00 ATOM 1127 CB GLU 146 4.724 -21.011 -28.051 1.00 0.00 ATOM 1128 CG GLU 146 5.676 -22.192 -27.992 1.00 0.00 ATOM 1129 CD GLU 146 6.279 -22.535 -29.350 1.00 0.00 ATOM 1130 OE1 GLU 146 5.790 -23.483 -29.999 1.00 0.00 ATOM 1131 OE2 GLU 146 7.248 -21.861 -29.769 1.00 0.00 ATOM 1132 O GLU 146 5.389 -21.182 -24.792 1.00 0.00 ATOM 1133 C GLU 146 5.142 -20.350 -25.661 1.00 0.00 ATOM 1134 N GLU 147 5.731 -19.157 -25.713 1.00 0.00 ATOM 1135 CA GLU 147 6.758 -18.786 -24.756 1.00 0.00 ATOM 1136 CB GLU 147 7.525 -17.560 -25.244 1.00 0.00 ATOM 1137 CG GLU 147 8.524 -17.863 -26.338 1.00 0.00 ATOM 1138 CD GLU 147 9.279 -16.635 -26.792 1.00 0.00 ATOM 1139 OE1 GLU 147 9.455 -15.704 -25.981 1.00 0.00 ATOM 1140 OE2 GLU 147 9.699 -16.601 -27.965 1.00 0.00 ATOM 1141 O GLU 147 6.768 -18.742 -22.368 1.00 0.00 ATOM 1142 C GLU 147 6.146 -18.495 -23.399 1.00 0.00 ATOM 1143 N LEU 148 4.932 -17.977 -23.406 1.00 0.00 ATOM 1144 CA LEU 148 4.248 -17.656 -22.155 1.00 0.00 ATOM 1145 CB LEU 148 2.911 -16.955 -22.423 1.00 0.00 ATOM 1146 CG LEU 148 2.217 -16.354 -21.194 1.00 0.00 ATOM 1147 CD1 LEU 148 3.096 -15.258 -20.589 1.00 0.00 ATOM 1148 CD2 LEU 148 0.849 -15.798 -21.575 1.00 0.00 ATOM 1149 O LEU 148 4.189 -18.950 -20.131 1.00 0.00 ATOM 1150 C LEU 148 4.026 -18.937 -21.353 1.00 0.00 ATOM 1151 N ALA 149 3.701 -20.024 -22.050 1.00 0.00 ATOM 1152 CA ALA 149 3.471 -21.310 -21.401 1.00 0.00 ATOM 1153 CB ALA 149 2.900 -22.306 -22.397 1.00 0.00 ATOM 1154 O ALA 149 4.715 -22.501 -19.718 1.00 0.00 ATOM 1155 C ALA 149 4.754 -21.854 -20.771 1.00 0.00 ATOM 1156 N GLU 150 5.879 -21.604 -21.434 1.00 0.00 ATOM 1157 CA GLU 150 7.165 -22.049 -20.899 1.00 0.00 ATOM 1158 CB GLU 150 8.283 -21.809 -21.915 1.00 0.00 ATOM 1159 CG GLU 150 8.085 -22.661 -23.158 1.00 0.00 ATOM 1160 CD GLU 150 9.211 -22.561 -24.155 1.00 0.00 ATOM 1161 OE1 GLU 150 9.708 -21.440 -24.405 1.00 0.00 ATOM 1162 OE2 GLU 150 9.580 -23.613 -24.708 1.00 0.00 ATOM 1163 O GLU 150 7.865 -21.986 -18.598 1.00 0.00 ATOM 1164 C GLU 150 7.455 -21.351 -19.574 1.00 0.00 ATOM 1165 N ALA 151 7.150 -20.059 -19.512 1.00 0.00 ATOM 1166 CA ALA 151 7.359 -19.285 -18.294 1.00 0.00 ATOM 1167 CB ALA 151 7.067 -17.805 -18.543 1.00 0.00 ATOM 1168 O ALA 151 6.904 -19.881 -16.027 1.00 0.00 ATOM 1169 C ALA 151 6.478 -19.814 -17.170 1.00 0.00 ATOM 1170 N LEU 152 5.244 -20.198 -17.502 1.00 0.00 ATOM 1171 CA LEU 152 4.322 -20.711 -16.495 1.00 0.00 ATOM 1172 CB LEU 152 2.915 -20.909 -17.082 1.00 0.00 ATOM 1173 CG LEU 152 1.858 -21.414 -16.102 1.00 0.00 ATOM 1174 CD1 LEU 152 1.629 -20.429 -14.959 1.00 0.00 ATOM 1175 CD2 LEU 152 0.565 -21.633 -16.860 1.00 0.00 ATOM 1176 O LEU 152 4.645 -22.201 -14.640 1.00 0.00 ATOM 1177 C LEU 152 4.811 -22.014 -15.843 1.00 0.00 ATOM 1178 N GLU 153 5.396 -22.909 -16.632 1.00 0.00 ATOM 1179 CA GLU 153 5.891 -24.174 -16.090 1.00 0.00 ATOM 1180 CB GLU 153 6.599 -24.996 -17.170 1.00 0.00 ATOM 1181 CG GLU 153 5.664 -25.656 -18.148 1.00 0.00 ATOM 1182 CD GLU 153 4.715 -26.626 -17.458 1.00 0.00 ATOM 1183 OE1 GLU 153 5.177 -27.713 -17.050 1.00 0.00 ATOM 1184 OE2 GLU 153 3.521 -26.295 -17.311 1.00 0.00 ATOM 1185 O GLU 153 6.815 -24.448 -13.900 1.00 0.00 ATOM 1186 C GLU 153 6.882 -23.874 -14.987 1.00 0.00 ATOM 1187 N GLU 154 7.804 -22.951 -15.296 1.00 0.00 ATOM 1188 CA GLU 154 8.831 -22.527 -14.357 1.00 0.00 ATOM 1189 CB GLU 154 9.667 -21.448 -15.067 1.00 0.00 ATOM 1190 CG GLU 154 10.526 -22.020 -16.157 1.00 0.00 ATOM 1191 CD GLU 154 11.297 -20.982 -16.981 1.00 0.00 ATOM 1192 OE1 GLU 154 12.207 -20.359 -16.423 1.00 0.00 ATOM 1193 OE2 GLU 154 10.979 -20.797 -18.197 1.00 0.00 ATOM 1194 O GLU 154 8.668 -22.250 -11.980 1.00 0.00 ATOM 1195 C GLU 154 8.238 -21.924 -13.092 1.00 0.00 ATOM 1196 N ILE 155 7.259 -21.034 -13.258 1.00 0.00 ATOM 1197 CA ILE 155 6.619 -20.417 -12.099 1.00 0.00 ATOM 1198 CB ILE 155 5.679 -19.255 -12.523 1.00 0.00 ATOM 1199 CG1 ILE 155 6.519 -18.093 -13.067 1.00 0.00 ATOM 1200 CG2 ILE 155 4.848 -18.777 -11.344 1.00 0.00 ATOM 1201 CD1 ILE 155 5.722 -17.030 -13.801 1.00 0.00 ATOM 1202 O ILE 155 5.929 -21.575 -10.114 1.00 0.00 ATOM 1203 C ILE 155 5.846 -21.494 -11.337 1.00 0.00 ATOM 1204 N ILE 156 5.161 -22.364 -12.075 1.00 0.00 ATOM 1205 CA ILE 156 4.408 -23.426 -11.452 1.00 0.00 ATOM 1206 CB ILE 156 3.736 -24.212 -12.563 1.00 0.00 ATOM 1207 CG1 ILE 156 2.493 -23.441 -13.003 1.00 0.00 ATOM 1208 CG2 ILE 156 3.360 -25.605 -12.080 1.00 0.00 ATOM 1209 CD1 ILE 156 1.911 -23.996 -14.302 1.00 0.00 ATOM 1210 O ILE 156 5.082 -24.695 -9.528 1.00 0.00 ATOM 1211 C ILE 156 5.355 -24.315 -10.668 1.00 0.00 ATOM 1212 N GLU 157 6.483 -24.644 -11.269 1.00 0.00 ATOM 1213 CA GLU 157 7.460 -25.498 -10.601 1.00 0.00 ATOM 1214 CB GLU 157 8.575 -25.880 -11.574 1.00 0.00 ATOM 1215 CG GLU 157 9.633 -26.804 -10.989 1.00 0.00 ATOM 1216 CD GLU 157 10.597 -27.317 -12.043 1.00 0.00 ATOM 1217 OE1 GLU 157 11.185 -26.489 -12.773 1.00 0.00 ATOM 1218 OE2 GLU 157 10.761 -28.551 -12.149 1.00 0.00 ATOM 1219 O GLU 157 8.180 -25.374 -8.306 1.00 0.00 ATOM 1220 C GLU 157 8.035 -24.781 -9.378 1.00 0.00 ATOM 1221 N TYR 158 8.302 -23.487 -9.566 1.00 0.00 ATOM 1222 CA TYR 158 8.847 -22.651 -8.478 1.00 0.00 ATOM 1223 CB TYR 158 9.293 -21.325 -9.069 1.00 0.00 ATOM 1224 CG TYR 158 9.850 -20.308 -8.136 1.00 0.00 ATOM 1225 CD1 TYR 158 11.127 -20.489 -7.661 1.00 0.00 ATOM 1226 CD2 TYR 158 9.170 -19.160 -7.728 1.00 0.00 ATOM 1227 CE1 TYR 158 11.781 -19.607 -6.815 1.00 0.00 ATOM 1228 CE2 TYR 158 9.788 -18.265 -6.851 1.00 0.00 ATOM 1229 CZ TYR 158 11.081 -18.484 -6.390 1.00 0.00 ATOM 1230 OH TYR 158 11.606 -17.575 -5.536 1.00 0.00 ATOM 1231 O TYR 158 8.222 -22.672 -6.160 1.00 0.00 ATOM 1232 C TYR 158 7.823 -22.503 -7.345 1.00 0.00 ATOM 1233 N VAL 159 6.546 -22.259 -7.732 1.00 0.00 ATOM 1234 CA VAL 159 5.569 -22.139 -6.601 1.00 0.00 ATOM 1235 CB VAL 159 4.195 -21.677 -7.076 1.00 0.00 ATOM 1236 CG1 VAL 159 3.107 -21.825 -6.028 1.00 0.00 ATOM 1237 CG2 VAL 159 4.178 -20.244 -7.560 1.00 0.00 ATOM 1238 O VAL 159 5.476 -23.643 -4.694 1.00 0.00 ATOM 1239 C VAL 159 5.509 -23.514 -5.938 1.00 0.00 ATOM 1240 N ARG 160 5.393 -24.601 -6.683 1.00 0.00 ATOM 1241 CA ARG 160 5.317 -25.930 -6.082 1.00 0.00 ATOM 1242 CB ARG 160 5.152 -26.992 -7.132 1.00 0.00 ATOM 1243 CG ARG 160 5.178 -28.410 -6.571 1.00 0.00 ATOM 1244 CD ARG 160 5.206 -29.363 -7.719 1.00 0.00 ATOM 1245 NE ARG 160 4.755 -30.668 -7.280 1.00 0.00 ATOM 1246 CZ ARG 160 5.269 -31.814 -7.739 1.00 0.00 ATOM 1247 NH1 ARG 160 6.347 -31.847 -8.535 1.00 0.00 ATOM 1248 NH2 ARG 160 4.626 -32.944 -7.430 1.00 0.00 ATOM 1249 O ARG 160 6.332 -26.779 -4.134 1.00 0.00 ATOM 1250 C ARG 160 6.525 -26.243 -5.214 1.00 0.00 ATOM 1251 N THR 161 7.787 -25.950 -5.597 1.00 0.00 ATOM 1252 CA THR 161 8.925 -26.296 -4.749 1.00 0.00 ATOM 1253 CB THR 161 10.347 -26.009 -5.407 1.00 0.00 ATOM 1254 CG2 THR 161 11.556 -26.241 -4.488 1.00 0.00 ATOM 1255 OG1 THR 161 10.287 -26.845 -6.558 1.00 0.00 ATOM 1256 O THR 161 9.031 -26.145 -2.388 1.00 0.00 ATOM 1257 C THR 161 8.850 -25.524 -3.420 1.00 0.00 ATOM 1258 N ILE 162 8.627 -24.255 -3.408 1.00 0.00 ATOM 1259 CA ILE 162 8.587 -23.472 -2.180 1.00 0.00 ATOM 1260 CB ILE 162 8.470 -21.955 -2.508 1.00 0.00 ATOM 1261 CG1 ILE 162 9.779 -21.394 -3.134 1.00 0.00 ATOM 1262 CG2 ILE 162 8.128 -21.141 -1.220 1.00 0.00 ATOM 1263 CD1 ILE 162 9.540 -20.112 -3.953 1.00 0.00 ATOM 1264 O ILE 162 7.608 -24.046 -0.065 1.00 0.00 ATOM 1265 C ILE 162 7.445 -23.949 -1.289 1.00 0.00 ATOM 1266 N ALA 163 6.271 -24.067 -1.878 1.00 0.00 ATOM 1267 CA ALA 163 5.058 -24.494 -1.180 1.00 0.00 ATOM 1268 CB ALA 163 3.961 -24.558 -2.229 1.00 0.00 ATOM 1269 O ALA 163 4.967 -26.012 0.723 1.00 0.00 ATOM 1270 C ALA 163 5.297 -25.814 -0.468 1.00 0.00 ATOM 1271 N MET 164 5.815 -26.773 -1.248 1.00 0.00 ATOM 1272 CA MET 164 6.110 -28.061 -0.639 1.00 0.00 ATOM 1273 CB MET 164 6.592 -29.096 -1.695 1.00 0.00 ATOM 1274 CG MET 164 7.081 -30.436 -1.145 1.00 0.00 ATOM 1275 SD MET 164 8.751 -30.520 -0.370 1.00 0.00 ATOM 1276 CE MET 164 9.799 -30.451 -1.862 1.00 0.00 ATOM 1277 O MET 164 7.062 -28.538 1.506 1.00 0.00 ATOM 1278 C MET 164 7.157 -27.916 0.470 1.00 0.00 ATOM 1279 N LEU 165 8.213 -27.138 0.253 1.00 0.00 ATOM 1280 CA LEU 165 9.258 -27.047 1.283 1.00 0.00 ATOM 1281 CB LEU 165 10.538 -26.403 0.693 1.00 0.00 ATOM 1282 CG LEU 165 11.239 -27.271 -0.338 1.00 0.00 ATOM 1283 CD1 LEU 165 12.285 -26.451 -1.090 1.00 0.00 ATOM 1284 CD2 LEU 165 11.900 -28.433 0.383 1.00 0.00 ATOM 1285 O LEU 165 9.178 -26.799 3.707 1.00 0.00 ATOM 1286 C LEU 165 8.821 -26.370 2.606 1.00 0.00 ATOM 1287 N PHE 166 8.072 -25.273 2.476 1.00 0.00 ATOM 1288 CA PHE 166 7.586 -24.555 3.654 1.00 0.00 ATOM 1289 CB PHE 166 7.431 -23.058 3.365 1.00 0.00 ATOM 1290 CG PHE 166 8.462 -22.197 4.047 1.00 0.00 ATOM 1291 CD1 PHE 166 9.813 -22.337 3.744 1.00 0.00 ATOM 1292 CD2 PHE 166 8.084 -21.262 5.010 1.00 0.00 ATOM 1293 CE1 PHE 166 10.776 -21.557 4.389 1.00 0.00 ATOM 1294 CE2 PHE 166 9.039 -20.477 5.660 1.00 0.00 ATOM 1295 CZ PHE 166 10.386 -20.626 5.349 1.00 0.00 ATOM 1296 O PHE 166 5.779 -24.896 5.210 1.00 0.00 ATOM 1297 C PHE 166 6.243 -25.143 4.095 1.00 0.00 ATOM 1298 N TYR 167 5.628 -25.918 3.203 1.00 0.00 ATOM 1299 CA TYR 167 4.352 -26.577 3.463 1.00 0.00 ATOM 1300 CB TYR 167 3.208 -25.820 2.778 1.00 0.00 ATOM 1301 CG TYR 167 3.063 -24.395 3.264 1.00 0.00 ATOM 1302 CD1 TYR 167 3.843 -23.367 2.732 1.00 0.00 ATOM 1303 CD2 TYR 167 2.176 -24.081 4.296 1.00 0.00 ATOM 1304 CE1 TYR 167 3.749 -22.063 3.219 1.00 0.00 ATOM 1305 CE2 TYR 167 2.074 -22.781 4.791 1.00 0.00 ATOM 1306 CZ TYR 167 2.862 -21.777 4.251 1.00 0.00 ATOM 1307 OH TYR 167 2.771 -20.494 4.743 1.00 0.00 ATOM 1308 O TYR 167 5.494 -28.399 2.420 1.00 0.00 ATOM 1309 C TYR 167 4.443 -27.998 2.919 1.00 0.00 ATOM 1310 N SER 168 3.354 -28.759 3.034 1.00 0.00 ATOM 1311 CA SER 168 3.335 -30.131 2.531 1.00 0.00 ATOM 1312 CB SER 168 3.562 -31.145 3.648 1.00 0.00 ATOM 1313 OG SER 168 2.469 -31.124 4.547 1.00 0.00 ATOM 1314 O SER 168 0.979 -29.818 2.206 1.00 0.00 ATOM 1315 C SER 168 2.004 -30.427 1.866 1.00 0.00 ATOM 1316 N HIS 169 2.030 -31.344 0.913 1.00 0.00 ATOM 1317 CA HIS 169 0.834 -31.754 0.198 1.00 0.00 ATOM 1318 CB HIS 169 0.791 -31.123 -1.194 1.00 0.00 ATOM 1319 CG HIS 169 0.543 -29.647 -1.195 1.00 0.00 ATOM 1320 CD2 HIS 169 1.389 -28.595 -1.308 1.00 0.00 ATOM 1321 ND1 HIS 169 -0.726 -29.106 -1.104 1.00 0.00 ATOM 1322 CE1 HIS 169 -0.645 -27.785 -1.163 1.00 0.00 ATOM 1323 NE2 HIS 169 0.627 -27.454 -1.287 1.00 0.00 ATOM 1324 O HIS 169 1.896 -33.864 -0.184 1.00 0.00 ATOM 1325 C HIS 169 0.843 -33.261 0.018 1.00 0.00 ATOM 1326 N PHE 170 -0.337 -33.850 0.158 1.00 0.00 ATOM 1327 CA PHE 170 -0.502 -35.292 -0.086 1.00 0.00 ATOM 1328 CB PHE 170 -1.819 -35.807 0.475 1.00 0.00 ATOM 1329 CG PHE 170 -1.972 -35.995 1.961 1.00 0.00 ATOM 1330 CD1 PHE 170 -1.025 -35.587 2.890 1.00 0.00 ATOM 1331 CD2 PHE 170 -3.114 -36.618 2.453 1.00 0.00 ATOM 1332 CE1 PHE 170 -1.230 -35.808 4.235 1.00 0.00 ATOM 1333 CE2 PHE 170 -3.331 -36.837 3.797 1.00 0.00 ATOM 1334 CZ PHE 170 -2.379 -36.417 4.714 1.00 0.00 ATOM 1335 O PHE 170 -1.087 -34.931 -2.397 1.00 0.00 ATOM 1336 C PHE 170 -0.443 -35.604 -1.581 1.00 0.00 ATOM 1337 N ASN 171 0.309 -36.627 -1.970 1.00 0.00 ATOM 1338 CA ASN 171 0.402 -37.003 -3.381 1.00 0.00 ATOM 1339 CB ASN 171 1.471 -38.052 -3.642 1.00 0.00 ATOM 1340 CG ASN 171 2.886 -37.540 -3.499 1.00 0.00 ATOM 1341 ND2 ASN 171 3.868 -38.404 -3.742 1.00 0.00 ATOM 1342 OD1 ASN 171 3.097 -36.360 -3.185 1.00 0.00 ATOM 1343 O ASN 171 -1.411 -37.227 -4.957 1.00 0.00 ATOM 1344 C ASN 171 -0.949 -37.531 -3.857 1.00 0.00 ATOM 1345 N GLU 172 -1.533 -38.412 -3.054 1.00 0.00 ATOM 1346 CA GLU 172 -2.825 -38.982 -3.384 1.00 0.00 ATOM 1347 CB GLU 172 -3.285 -40.018 -2.345 1.00 0.00 ATOM 1348 CG GLU 172 -2.596 -41.353 -2.493 1.00 0.00 ATOM 1349 CD GLU 172 -2.899 -42.216 -3.714 1.00 0.00 ATOM 1350 OE1 GLU 172 -3.851 -41.889 -4.427 1.00 0.00 ATOM 1351 OE2 GLU 172 -2.149 -43.188 -3.946 1.00 0.00 ATOM 1352 O GLU 172 -4.736 -37.943 -4.425 1.00 0.00 ATOM 1353 C GLU 172 -3.865 -37.891 -3.515 1.00 0.00 ATOM 1354 N GLY 173 -3.828 -36.875 -2.657 1.00 0.00 ATOM 1355 CA GLY 173 -4.804 -35.813 -2.738 1.00 0.00 ATOM 1356 O GLY 173 -5.683 -34.684 -4.669 1.00 0.00 ATOM 1357 C GLY 173 -4.669 -35.061 -4.039 1.00 0.00 ATOM 1358 N GLU 174 -3.453 -34.830 -4.497 1.00 0.00 ATOM 1359 CA GLU 174 -3.226 -34.133 -5.754 1.00 0.00 ATOM 1360 CB GLU 174 -1.784 -33.741 -5.902 1.00 0.00 ATOM 1361 CG GLU 174 -1.367 -32.601 -4.969 1.00 0.00 ATOM 1362 CD GLU 174 0.112 -32.461 -4.754 1.00 0.00 ATOM 1363 OE1 GLU 174 0.923 -33.373 -4.979 1.00 0.00 ATOM 1364 OE2 GLU 174 0.500 -31.299 -4.392 1.00 0.00 ATOM 1365 O GLU 174 -4.409 -34.463 -7.843 1.00 0.00 ATOM 1366 C GLU 174 -3.744 -34.983 -6.931 1.00 0.00 ATOM 1367 N ILE 175 -3.465 -36.274 -6.931 1.00 0.00 ATOM 1368 CA ILE 175 -3.958 -37.144 -7.999 1.00 0.00 ATOM 1369 CB ILE 175 -3.214 -38.548 -7.820 1.00 0.00 ATOM 1370 CG1 ILE 175 -1.702 -38.359 -8.087 1.00 0.00 ATOM 1371 CG2 ILE 175 -3.842 -39.583 -8.721 1.00 0.00 ATOM 1372 CD1 ILE 175 -0.880 -39.566 -7.645 1.00 0.00 ATOM 1373 O ILE 175 -6.141 -37.413 -8.978 1.00 0.00 ATOM 1374 C ILE 175 -5.481 -37.288 -7.951 1.00 0.00 ATOM 1375 N GLU 176 -6.030 -37.260 -6.746 1.00 0.00 ATOM 1376 CA GLU 176 -7.467 -37.360 -6.550 1.00 0.00 ATOM 1377 CB GLU 176 -7.905 -37.467 -5.136 1.00 0.00 ATOM 1378 CG GLU 176 -7.600 -38.843 -4.590 1.00 0.00 ATOM 1379 CD GLU 176 -7.915 -39.004 -3.116 1.00 0.00 ATOM 1380 OE1 GLU 176 -8.587 -38.121 -2.530 1.00 0.00 ATOM 1381 OE2 GLU 176 -7.471 -40.051 -2.595 1.00 0.00 ATOM 1382 O GLU 176 -9.133 -36.150 -7.816 1.00 0.00 ATOM 1383 C GLU 176 -8.105 -36.096 -7.147 1.00 0.00 ATOM 1384 N SER 177 -7.481 -34.950 -6.897 1.00 0.00 ATOM 1385 CA SER 177 -7.977 -33.684 -7.414 1.00 0.00 ATOM 1386 CB SER 177 -7.254 -32.530 -6.820 1.00 0.00 ATOM 1387 OG SER 177 -7.604 -32.411 -5.443 1.00 0.00 ATOM 1388 O SER 177 -8.748 -33.208 -9.628 1.00 0.00 ATOM 1389 C SER 177 -7.837 -33.645 -8.926 1.00 0.00 ATOM 1390 N LYS 178 -6.686 -34.097 -9.422 1.00 0.00 ATOM 1391 CA LYS 178 -6.409 -34.108 -10.857 1.00 0.00 ATOM 1392 CB LYS 178 -4.995 -34.675 -11.091 1.00 0.00 ATOM 1393 CG LYS 178 -4.517 -34.576 -12.535 1.00 0.00 ATOM 1394 CD LYS 178 -3.091 -35.097 -12.666 1.00 0.00 ATOM 1395 CE LYS 178 -2.546 -34.881 -14.073 1.00 0.00 ATOM 1396 NZ LYS 178 -3.322 -35.621 -15.103 1.00 0.00 ATOM 1397 O LYS 178 -7.959 -34.507 -12.631 1.00 0.00 ATOM 1398 C LYS 178 -7.446 -34.929 -11.599 1.00 0.00 ATOM 1399 N PRO 179 -7.757 -36.107 -11.063 1.00 0.00 ATOM 1400 CA PRO 179 -8.728 -37.005 -11.674 1.00 0.00 ATOM 1401 CB PRO 179 -8.573 -38.281 -10.835 1.00 0.00 ATOM 1402 CG PRO 179 -7.153 -38.222 -10.362 1.00 0.00 ATOM 1403 CD PRO 179 -6.919 -36.750 -10.075 1.00 0.00 ATOM 1404 O PRO 179 -10.902 -36.603 -12.629 1.00 0.00 ATOM 1405 C PRO 179 -10.150 -36.455 -11.655 1.00 0.00 ATOM 1406 N VAL 180 -10.538 -35.823 -10.555 1.00 0.00 ATOM 1407 CA VAL 180 -11.885 -35.282 -10.477 1.00 0.00 ATOM 1408 CB VAL 180 -12.196 -34.774 -9.052 1.00 0.00 ATOM 1409 CG1 VAL 180 -13.522 -34.038 -9.020 1.00 0.00 ATOM 1410 CG2 VAL 180 -12.231 -35.958 -8.075 1.00 0.00 ATOM 1411 O VAL 180 -13.098 -34.096 -12.161 1.00 0.00 ATOM 1412 C VAL 180 -12.082 -34.151 -11.470 1.00 0.00 ATOM 1413 N LEU 181 -11.115 -33.263 -11.548 1.00 0.00 ATOM 1414 CA LEU 181 -11.194 -32.085 -12.475 1.00 0.00 ATOM 1415 CB LEU 181 -10.081 -31.121 -12.117 1.00 0.00 ATOM 1416 CG LEU 181 -10.228 -30.314 -10.807 1.00 0.00 ATOM 1417 CD1 LEU 181 -8.943 -29.534 -10.556 1.00 0.00 ATOM 1418 CD2 LEU 181 -11.430 -29.347 -10.946 1.00 0.00 ATOM 1419 O LEU 181 -12.025 -32.120 -14.757 1.00 0.00 ATOM 1420 C LEU 181 -11.174 -32.590 -13.953 1.00 0.00 ATOM 1421 N HIS 182 -10.280 -33.534 -14.239 1.00 0.00 ATOM 1422 CA HIS 182 -10.126 -34.067 -15.602 1.00 0.00 ATOM 1423 CB HIS 182 -8.797 -33.590 -16.197 1.00 0.00 ATOM 1424 CG HIS 182 -8.751 -33.704 -17.681 1.00 0.00 ATOM 1425 CD2 HIS 182 -9.252 -34.636 -18.530 1.00 0.00 ATOM 1426 ND1 HIS 182 -8.157 -32.729 -18.436 1.00 0.00 ATOM 1427 CE1 HIS 182 -8.293 -33.061 -19.695 1.00 0.00 ATOM 1428 NE2 HIS 182 -8.940 -34.208 -19.822 1.00 0.00 ATOM 1429 O HIS 182 -9.392 -36.197 -14.819 1.00 0.00 ATOM 1430 C HIS 182 -10.214 -35.597 -15.514 1.00 0.00 TER END ################################ # # # END # # # ################################ From mailer@bialko.llnl.gov Mon Aug 26 14:31:08 2002 Date: Mon, 26 Aug 2002 14:31:02 -0700 (PDT) From: Automatic Reply To: karplus@cse.ucsc.edu X-SpamBouncer: 1.4 (10/07/01) X-SBPass: NoBounce X-SBClass: OK # # Protein Structure Prediction Center, LLNL, Livermore, CA # Verification system Mon Aug 26 14:02:48 PDT 2002 by Adam Zemla # # The PIN number of your submission is: PIN_262152_35043 # (PIN number is not an ACCESSION CODE) # Thank you for your submission. Your prediction has been accepted with an ACCESSION CODE: T0129TS001_4 Current information on models submitted in prediction T0129TS001 MODEL_INDEX PIN CODE DATE E-mail T0129TS001_4 PIN_262152_35043 4069-6308-1312 08/26/02 14:02:48 karplus@cse.ucsc.edu T0129TS001_3 PIN_260251_35042 4069-6308-1312 08/26/02 14:02:29 karplus@cse.ucsc.edu T0129TS001_2 PIN_258350_35041 4069-6308-1312 08/26/02 14:02:10 karplus@cse.ucsc.edu T0129TS001_1 PIN_739324_34603 4069-6308-1312 08/26/02 09:50:29 karplus@cse.ucsc.edu PLEASE NOTE: Submission of a duplicate prediction (same target, format, model index) will REPLACE an existing submission (ACCESSION CODE), provided it is received before the target has expired. The current status of models accepted for target T0129 MODEL_INDEX PIN CODE DATE E-mail T0129TS001_1 PIN_739324_34603 4069-6308-1312 08/26/02 09:50:29 karplus@cse.ucsc.edu T0129TS001_2 PIN_258350_35041 4069-6308-1312 08/26/02 14:02:10 karplus@cse.ucsc.edu T0129TS001_3 PIN_260251_35042 4069-6308-1312 08/26/02 14:02:29 karplus@cse.ucsc.edu T0129TS001_4 PIN_262152_35043 4069-6308-1312 08/26/02 14:02:48 karplus@cse.ucsc.edu T0129SS001_1 PIN_123526_15892 4069-6308-1312 07/26/02 15:00:20 karplus@bray.cse.ucsc.edu For more information on accepted models submitted to CASP5 see: http://PredictionCenter.llnl.gov/casp5/models/casp5-models.html Please check below if the verified data of your submission is correct. # Reading prediction format TS PFRMAT TS TARGET T0129 AUTHOR 4069-6308-1312 # Reading MODEL 4 PARENT N/A # Reading prediction format TS (DONE) # Checking the TS prediction MODEL 4 # Checking the TS prediction MODEL 4 (DONE) # MODEL index: 4 # Target name: T0129 # Total number of residues in target: 182 # Total number of residues in model: 182 # Total number of atoms in model: 1430 # Number of atoms with 1.0 occupancy: 1430 # Number of fragments in model: 1 # Number of METHOD records: 109 # No errors. ################################ # # # SUBMISSION # # # ################################ # # # BEGIN # # # ################################ PFRMAT TS TARGET T0129 AUTHOR 4069-6308-1312 METHOD The SAM-T02 human predictions start with the same method as the METHOD SAM-T02 server: METHOD METHOD Use the SAM-T2K method for finding homologs of the target and METHOD aligning them. METHOD METHOD Make local structure predictions using neural nets and the METHOD multiple alignment. We currently have 5 local-structure METHOD alphabets: METHOD DSSP METHOD STRIDE METHOD STR an extended version of DSSP that splits the beta strands METHOD into multiple classes (parallel/antiparallel/mixed, METHOD edge/center) METHOD ALPHA an discretization of the alpha torsion angle: METHOD CA(i-i), CA(i), CA(i+1), CA(i+2) METHOD DSSP_EHL2 CASP's collapse of the DSSP alphabet METHOD METHOD DSSP_EHL2 is not predicted directly by a neural net, but is METHOD computed as a weighted average of the other 4 networks (each METHOD probability vector output is multiplied by conditional METHOD probability matrix P(E|letter) P(H|letter) P(L|letter)). The METHOD weights for the averaging are the mutual information between the METHOD local structure alphabet and the DSSP_EHL2 alphabet in a large METHOD training set. METHOD METHOD METHOD We make four 2-track HMMs (1.0 amino acid + 0.3 local structure) METHOD and use them to score a template library of about 6200 templates. METHOD We also used a single-track HMM to score not just the template METHOD library, but a non-redundant copy of the entire PDB. METHOD METHOD [Difference from server: the web server did not include the ALPHA METHOD alphabet in either the DSSP_EHL2 computation or the 2-track HMMS.] METHOD METHOD One-track HMMs built from the template library multiple alignments METHOD were used to score the target sequence. METHOD METHOD All the logs of e-values were combined in a weighted average (with METHOD rather arbitrary weights, since we did not have time to METHOD optimize them), and the best templates ranked. METHOD METHOD Alignments of the target to the top templates were made using METHOD several different alignment methods (all using the SAM hmmscore METHOD program). METHOD METHOD After the large set of alignments were made the "human" methods and METHOD the server diverge significantly. The server just picks the METHOD best-scoring templates (after removing redundancy) and reports the METHOD local posterior-decoding alignments made with the 2-track AA+STR METHOD target HMM. METHOD METHOD The hand method used SAM's "fragfinder" program and the 2-track AA+STR METHOD HMM to find short fragments (9 residues long) for each position in the METHOD sequence (6 fragments were kept for each position). METHOD METHOD Then the "undertaker" program (named because it optimizes burial) is METHOD used to try to combine the alignments and the fragments into a METHOD consistent 3D model. No single alignment or parent template was used, METHOD though in many cases one had much more influence than the others. The METHOD alignment scores were not passed to undertaker, but were used only to METHOD pike the set of alignments and fragments that undertaker would see. METHOD METHOD A genetic algorithm with about 16 different operators were used to METHOD optimize a score function. The score function was hand-tweaked for METHOD each target (mainly by adding constraints to keep beta sheets METHOD together, but also by adjusting what terms were included in the score METHOD function and what weights were used). Undertaker was undergoing METHOD extensive modification during CASP season, so may have had quite METHOD different features available for different targets. METHOD METHOD Bower and Dunbrack's SCWRL was run on some of the intermediate METHOD conformations generated by undertaker, but the final conformation was METHOD chosen entirely by the undertaker score function. METHOD METHOD Optimization was generally done in many passes, with hand inspection METHOD of the best conformation after each pass, followed (often) by tweaking METHOD the score function to move the conformation in a direction we desired. METHOD METHOD In a few cases, when we started getting a decent structure that did METHOD not correspond well to our input alignments, we submitted the METHOD structure to VAST to get structure-structure alignments, to try to METHOD find some other possible templates to use as a base. METHOD METHOD In some cases, when several conformations had good parts, different METHOD conformations were manually cut-and-pasted, with undertaker run to try METHOD to smooth out the transitions. METHOD METHOD Because undertaker does not (yet) handle multimers, we often added METHOD "scaffolding" constraints by hand to try to retain structure in METHOD dimerization interfaces. This is a crude hack that we hope to get rid METHOD of when we have multimers implemented. METHOD METHOD Because undertaker does not (yet) have a hydrogen-bond scoring METHOD function, we often had to add constraints to hold beta sheets METHOD together. In some cases where the register was not obvious, we had to METHOD guess or try several different registers. METHOD METHOD In some cases, when we got desperate for initial starting points, we METHOD threw the Robetta ab-initio models into the undertaker pool, and METHOD optimized from them as well as the ones undertaker started with. METHOD METHOD For multiple-domain models, we generally broke the sequence into METHOD chunks (often somewhat arbitrary overlapping chunks), and did the full METHOD SAM-T02 method for each subchain. The alignments found were all METHOD tossed into the undertaker conformation search. In some cases, we METHOD performed undertaker runs for the subchains, and cut-and-pasted the METHOD pieces into one PDB file (with bad breaks) and let undertaker try to METHOD assemble the pieces. MODEL 4 PARENT N/A ATOM 1 N MET 1 3.557 -13.951 0.751 1.00 0.00 ATOM 2 CA MET 1 4.112 -13.753 -0.551 1.00 0.00 ATOM 3 CB MET 1 5.655 -13.809 -0.573 1.00 0.00 ATOM 4 CG MET 1 6.100 -15.254 -0.774 1.00 0.00 ATOM 5 SD MET 1 6.707 -16.322 0.527 1.00 0.00 ATOM 6 CE MET 1 5.469 -16.029 1.830 1.00 0.00 ATOM 7 O MET 1 3.997 -15.078 -2.468 1.00 0.00 ATOM 8 C MET 1 3.552 -14.925 -1.326 1.00 0.00 ATOM 9 N LEU 2 2.595 -15.680 -0.736 1.00 0.00 ATOM 10 CA LEU 2 1.948 -16.780 -1.448 1.00 0.00 ATOM 11 CB LEU 2 2.355 -18.188 -1.009 1.00 0.00 ATOM 12 CG LEU 2 3.844 -18.522 -1.027 1.00 0.00 ATOM 13 CD1 LEU 2 4.049 -19.853 -0.281 1.00 0.00 ATOM 14 CD2 LEU 2 4.432 -18.487 -2.439 1.00 0.00 ATOM 15 O LEU 2 -0.052 -15.918 -0.540 1.00 0.00 ATOM 16 C LEU 2 0.425 -16.607 -1.423 1.00 0.00 ATOM 17 N ILE 3 -0.330 -17.195 -2.367 1.00 0.00 ATOM 18 CA ILE 3 -1.818 -17.079 -2.398 1.00 0.00 ATOM 19 CB ILE 3 -2.535 -18.472 -2.665 1.00 0.00 ATOM 20 CG1 ILE 3 -1.804 -19.320 -3.706 1.00 0.00 ATOM 21 CG2 ILE 3 -4.005 -18.311 -3.062 1.00 0.00 ATOM 22 CD1 ILE 3 -2.015 -18.879 -5.131 1.00 0.00 ATOM 23 O ILE 3 -3.342 -16.814 -0.491 1.00 0.00 ATOM 24 C ILE 3 -2.498 -17.501 -1.099 1.00 0.00 ATOM 25 N SER 4 -2.079 -18.675 -0.603 1.00 0.00 ATOM 26 CA SER 4 -2.594 -19.152 0.653 1.00 0.00 ATOM 27 CB SER 4 -1.943 -20.484 1.027 1.00 0.00 ATOM 28 OG SER 4 -2.309 -21.505 0.115 1.00 0.00 ATOM 29 O SER 4 -3.170 -17.801 2.629 1.00 0.00 ATOM 30 C SER 4 -2.328 -18.176 1.797 1.00 0.00 ATOM 31 N HIS 5 -1.069 -17.744 1.860 1.00 0.00 ATOM 32 CA HIS 5 -0.654 -16.824 2.920 1.00 0.00 ATOM 33 CB HIS 5 0.871 -16.750 2.997 1.00 0.00 ATOM 34 CG HIS 5 1.515 -18.023 3.450 1.00 0.00 ATOM 35 CD2 HIS 5 1.758 -18.664 4.735 1.00 0.00 ATOM 36 ND1 HIS 5 2.066 -18.931 2.572 1.00 0.00 ATOM 37 CE1 HIS 5 2.564 -19.970 3.269 1.00 0.00 ATOM 38 NE2 HIS 5 2.383 -19.813 4.567 1.00 0.00 ATOM 39 O HIS 5 -0.945 -14.477 3.477 1.00 0.00 ATOM 40 C HIS 5 -1.181 -15.393 2.678 1.00 0.00 ATOM 41 N SER 6 -1.904 -15.223 1.573 1.00 0.00 ATOM 42 CA SER 6 -2.513 -13.948 1.241 1.00 0.00 ATOM 43 CB SER 6 -2.859 -13.891 -0.247 1.00 0.00 ATOM 44 OG SER 6 -1.691 -13.967 -1.045 1.00 0.00 ATOM 45 O SER 6 -4.340 -12.685 2.165 1.00 0.00 ATOM 46 C SER 6 -3.790 -13.789 2.068 1.00 0.00 ATOM 47 N ASP 7 -4.268 -14.906 2.620 1.00 0.00 ATOM 48 CA ASP 7 -5.476 -14.889 3.468 1.00 0.00 ATOM 49 CB ASP 7 -5.833 -16.303 3.926 1.00 0.00 ATOM 50 CG ASP 7 -6.390 -17.154 2.802 1.00 0.00 ATOM 51 OD1 ASP 7 -6.855 -18.279 3.083 1.00 0.00 ATOM 52 OD2 ASP 7 -6.362 -16.698 1.638 1.00 0.00 ATOM 53 O ASP 7 -6.123 -13.313 5.176 1.00 0.00 ATOM 54 C ASP 7 -5.232 -14.014 4.716 1.00 0.00 ATOM 55 N LEU 8 -4.037 -14.112 5.285 1.00 0.00 ATOM 56 CA LEU 8 -3.683 -13.289 6.449 1.00 0.00 ATOM 57 CB LEU 8 -2.279 -13.637 6.944 1.00 0.00 ATOM 58 CG LEU 8 -2.119 -14.997 7.626 1.00 0.00 ATOM 59 CD1 LEU 8 -0.658 -15.266 7.954 1.00 0.00 ATOM 60 CD2 LEU 8 -2.912 -15.044 8.922 1.00 0.00 ATOM 61 O LEU 8 -4.264 -10.980 6.724 1.00 0.00 ATOM 62 C LEU 8 -3.727 -11.828 6.026 1.00 0.00 ATOM 63 N ASN 9 -3.178 -11.566 4.843 1.00 0.00 ATOM 64 CA ASN 9 -3.125 -10.210 4.315 1.00 0.00 ATOM 65 CB ASN 9 -2.437 -10.194 2.948 1.00 0.00 ATOM 66 CG ASN 9 -0.938 -10.388 3.048 1.00 0.00 ATOM 67 ND2 ASN 9 -0.460 -10.684 4.251 1.00 0.00 ATOM 68 OD1 ASN 9 -0.219 -10.273 2.055 1.00 0.00 ATOM 69 O ASN 9 -4.835 -8.530 4.504 1.00 0.00 ATOM 70 C ASN 9 -4.547 -9.675 4.164 1.00 0.00 ATOM 71 N GLN 10 -5.433 -10.530 3.642 1.00 0.00 ATOM 72 CA GLN 10 -6.813 -10.129 3.466 1.00 0.00 ATOM 73 CB GLN 10 -7.592 -11.593 3.241 1.00 0.00 ATOM 74 CG GLN 10 -8.707 -11.811 2.283 1.00 0.00 ATOM 75 CD GLN 10 -9.227 -13.241 2.339 1.00 0.00 ATOM 76 OE1 GLN 10 -8.454 -14.194 2.518 1.00 0.00 ATOM 77 NE2 GLN 10 -10.536 -13.399 2.174 1.00 0.00 ATOM 78 O GLN 10 -8.264 -8.985 4.951 1.00 0.00 ATOM 79 C GLN 10 -7.495 -9.917 4.806 1.00 0.00 ATOM 80 N GLN 11 -7.214 -10.776 5.781 1.00 0.00 ATOM 81 CA GLN 11 -7.827 -10.648 7.098 1.00 0.00 ATOM 82 CB GLN 11 -7.472 -11.852 7.972 1.00 0.00 ATOM 83 CG GLN 11 -8.104 -13.158 7.517 1.00 0.00 ATOM 84 CD GLN 11 -7.677 -14.340 8.366 1.00 0.00 ATOM 85 OE1 GLN 11 -6.882 -14.194 9.295 1.00 0.00 ATOM 86 NE2 GLN 11 -8.206 -15.516 8.050 1.00 0.00 ATOM 87 O GLN 11 -8.116 -8.676 8.417 1.00 0.00 ATOM 88 C GLN 11 -7.343 -9.385 7.803 1.00 0.00 ATOM 89 N LEU 12 -6.057 -9.102 7.677 1.00 0.00 ATOM 90 CA LEU 12 -5.470 -7.940 8.292 1.00 0.00 ATOM 91 CB LEU 12 -3.956 -7.930 8.084 1.00 0.00 ATOM 92 CG LEU 12 -3.156 -8.973 8.868 1.00 0.00 ATOM 93 CD1 LEU 12 -1.688 -8.934 8.473 1.00 0.00 ATOM 94 CD2 LEU 12 -3.253 -8.712 10.364 1.00 0.00 ATOM 95 O LEU 12 -6.521 -5.787 8.371 1.00 0.00 ATOM 96 C LEU 12 -6.076 -6.684 7.654 1.00 0.00 ATOM 97 N LYS 13 -6.183 -6.650 6.328 1.00 0.00 ATOM 98 CA LYS 13 -6.711 -5.485 5.623 1.00 0.00 ATOM 99 CB LYS 13 -6.941 -6.068 4.046 1.00 0.00 ATOM 100 CG LYS 13 -7.105 -5.048 2.929 1.00 0.00 ATOM 101 CD LYS 13 -8.035 -5.536 1.826 1.00 0.00 ATOM 102 CE LYS 13 -8.310 -4.418 0.826 1.00 0.00 ATOM 103 NZ LYS 13 -9.402 -4.744 -0.135 1.00 0.00 ATOM 104 O LYS 13 -8.644 -4.154 6.115 1.00 0.00 ATOM 105 C LYS 13 -8.200 -5.279 5.905 1.00 0.00 ATOM 106 N SER 14 -8.958 -6.377 5.913 1.00 0.00 ATOM 107 CA SER 14 -10.394 -6.346 6.177 1.00 0.00 ATOM 108 CB SER 14 -10.997 -7.745 6.030 1.00 0.00 ATOM 109 OG SER 14 -10.915 -8.195 4.689 1.00 0.00 ATOM 110 O SER 14 -11.657 -5.067 7.729 1.00 0.00 ATOM 111 C SER 14 -10.742 -5.865 7.565 1.00 0.00 ATOM 112 N ALA 15 -10.021 -6.352 8.574 1.00 0.00 ATOM 113 CA ALA 15 -10.248 -5.955 9.952 1.00 0.00 ATOM 114 CB ALA 15 -9.693 -7.001 10.903 1.00 0.00 ATOM 115 O ALA 15 -9.472 -4.313 11.510 1.00 0.00 ATOM 116 C ALA 15 -9.597 -4.626 10.329 1.00 0.00 ATOM 117 N GLY 16 -9.179 -3.860 9.323 1.00 0.00 ATOM 118 CA GLY 16 -8.584 -2.552 9.548 1.00 0.00 ATOM 119 O GLY 16 -6.892 -1.477 10.839 1.00 0.00 ATOM 120 C GLY 16 -7.219 -2.483 10.206 1.00 0.00 ATOM 121 N ILE 17 -6.409 -3.523 10.049 1.00 0.00 ATOM 122 CA ILE 17 -5.071 -3.559 10.624 1.00 0.00 ATOM 123 CB ILE 17 -4.911 -4.831 11.450 1.00 0.00 ATOM 124 CG1 ILE 17 -5.698 -4.643 12.755 1.00 0.00 ATOM 125 CG2 ILE 17 -3.454 -5.041 11.752 1.00 0.00 ATOM 126 CD1 ILE 17 -5.857 -5.916 13.577 1.00 0.00 ATOM 127 O ILE 17 -4.295 -4.764 8.700 1.00 0.00 ATOM 128 C ILE 17 -4.117 -3.809 9.463 1.00 0.00 ATOM 129 N GLY 18 -3.113 -2.911 9.368 1.00 0.00 ATOM 130 CA GLY 18 -2.187 -3.099 8.234 1.00 0.00 ATOM 131 O GLY 18 -0.580 -2.232 9.709 1.00 0.00 ATOM 132 C GLY 18 -0.890 -2.435 8.522 1.00 0.00 ATOM 133 N PHE 19 -1.307 -2.386 6.080 1.00 0.00 ATOM 134 CA PHE 19 -0.335 -3.342 5.572 1.00 0.00 ATOM 135 CB PHE 19 -0.451 -3.217 4.141 1.00 0.00 ATOM 136 CG PHE 19 -1.169 -4.511 3.876 1.00 0.00 ATOM 137 CD1 PHE 19 -2.506 -4.531 3.489 1.00 0.00 ATOM 138 CD2 PHE 19 -0.512 -5.721 4.067 1.00 0.00 ATOM 139 CE1 PHE 19 -3.179 -5.738 3.296 1.00 0.00 ATOM 140 CE2 PHE 19 -1.171 -6.932 3.875 1.00 0.00 ATOM 141 CZ PHE 19 -2.504 -6.940 3.493 1.00 0.00 ATOM 142 O PHE 19 1.116 -1.437 5.242 1.00 0.00 ATOM 143 C PHE 19 1.034 -2.643 5.494 1.00 0.00 ATOM 144 N ASN 20 2.098 -3.394 5.757 1.00 0.00 ATOM 145 CA ASN 20 3.450 -2.851 5.700 1.00 0.00 ATOM 146 CB ASN 20 4.393 -3.667 6.646 1.00 0.00 ATOM 147 CG ASN 20 4.041 -3.452 8.115 1.00 0.00 ATOM 148 ND2 ASN 20 3.888 -4.517 8.882 1.00 0.00 ATOM 149 OD1 ASN 20 3.844 -2.287 8.513 1.00 0.00 ATOM 150 O ASN 20 3.374 -3.521 3.380 1.00 0.00 ATOM 151 C ASN 20 3.927 -2.819 4.244 1.00 0.00 ATOM 152 N ALA 21 4.923 -1.985 3.972 1.00 0.00 ATOM 153 CA ALA 21 5.470 -1.888 2.621 1.00 0.00 ATOM 154 CB ALA 21 6.889 -1.132 2.973 1.00 0.00 ATOM 155 O ALA 21 5.830 -3.628 0.997 1.00 0.00 ATOM 156 C ALA 21 6.051 -3.218 2.141 1.00 0.00 ATOM 157 N THR 22 6.790 -3.891 3.029 1.00 0.00 ATOM 158 CA THR 22 7.402 -5.169 2.693 1.00 0.00 ATOM 159 CB THR 22 8.338 -5.656 3.815 1.00 0.00 ATOM 160 CG2 THR 22 8.935 -7.010 3.458 1.00 0.00 ATOM 161 OG1 THR 22 9.400 -4.715 4.000 1.00 0.00 ATOM 162 O THR 22 6.442 -6.994 1.468 1.00 0.00 ATOM 163 C THR 22 6.372 -6.268 2.464 1.00 0.00 ATOM 164 N GLU 23 5.409 -6.395 3.381 1.00 0.00 ATOM 165 CA GLU 23 4.393 -7.434 3.214 1.00 0.00 ATOM 166 CB GLU 23 3.434 -7.444 4.407 1.00 0.00 ATOM 167 CG GLU 23 4.065 -7.920 5.705 1.00 0.00 ATOM 168 CD GLU 23 3.102 -7.867 6.875 1.00 0.00 ATOM 169 OE1 GLU 23 1.959 -7.404 6.683 1.00 0.00 ATOM 170 OE2 GLU 23 3.493 -8.284 7.986 1.00 0.00 ATOM 171 O GLU 23 3.185 -8.268 1.294 1.00 0.00 ATOM 172 C GLU 23 3.527 -7.274 1.971 1.00 0.00 ATOM 173 N LEU 24 3.169 -6.043 1.670 1.00 0.00 ATOM 174 CA LEU 24 2.459 -5.746 0.448 1.00 0.00 ATOM 175 CB LEU 24 2.082 -4.263 0.390 1.00 0.00 ATOM 176 CG LEU 24 1.305 -3.809 -0.843 1.00 0.00 ATOM 177 CD1 LEU 24 -0.046 -4.501 -0.913 1.00 0.00 ATOM 178 CD2 LEU 24 1.068 -2.308 -0.806 1.00 0.00 ATOM 179 O LEU 24 2.892 -6.755 -1.710 1.00 0.00 ATOM 180 C LEU 24 3.316 -6.065 -0.792 1.00 0.00 ATOM 181 N HIS 25 4.523 -5.558 -0.793 1.00 0.00 ATOM 182 CA HIS 25 5.460 -5.786 -1.916 1.00 0.00 ATOM 183 CB HIS 25 6.822 -5.156 -1.617 1.00 0.00 ATOM 184 CG HIS 25 7.830 -5.353 -2.704 1.00 0.00 ATOM 185 CD2 HIS 25 8.930 -6.279 -2.948 1.00 0.00 ATOM 186 ND1 HIS 25 7.882 -4.554 -3.826 1.00 0.00 ATOM 187 CE1 HIS 25 8.886 -4.970 -4.615 1.00 0.00 ATOM 188 NE2 HIS 25 9.520 -6.005 -4.095 1.00 0.00 ATOM 189 O HIS 25 5.619 -7.692 -3.382 1.00 0.00 ATOM 190 C HIS 25 5.707 -7.244 -2.208 1.00 0.00 ATOM 191 N GLY 26 6.403 -8.214 -1.034 1.00 0.00 ATOM 192 CA GLY 26 6.577 -9.657 -1.059 1.00 0.00 ATOM 193 O GLY 26 5.666 -11.198 -2.674 1.00 0.00 ATOM 194 C GLY 26 5.436 -10.292 -1.862 1.00 0.00 ATOM 195 N PHE 27 4.215 -9.786 -1.664 1.00 0.00 ATOM 196 CA PHE 27 3.031 -10.302 -2.353 1.00 0.00 ATOM 197 CB PHE 27 1.771 -9.584 -1.863 1.00 0.00 ATOM 198 CG PHE 27 0.516 -10.017 -2.566 1.00 0.00 ATOM 199 CD1 PHE 27 -0.103 -11.209 -2.238 1.00 0.00 ATOM 200 CD2 PHE 27 -0.046 -9.230 -3.557 1.00 0.00 ATOM 201 CE1 PHE 27 -1.258 -11.607 -2.883 1.00 0.00 ATOM 202 CE2 PHE 27 -1.201 -9.630 -4.204 1.00 0.00 ATOM 203 CZ PHE 27 -1.808 -10.812 -3.869 1.00 0.00 ATOM 204 O PHE 27 2.998 -11.077 -4.633 1.00 0.00 ATOM 205 C PHE 27 3.103 -10.111 -3.865 1.00 0.00 ATOM 206 N LEU 28 3.297 -8.850 -4.268 1.00 0.00 ATOM 207 CA LEU 28 3.356 -8.558 -5.698 1.00 0.00 ATOM 208 CB LEU 28 4.071 -7.056 -5.792 1.00 0.00 ATOM 209 CG LEU 28 3.597 -5.840 -6.584 1.00 0.00 ATOM 210 CD1 LEU 28 2.215 -5.374 -6.147 1.00 0.00 ATOM 211 CD2 LEU 28 4.596 -4.697 -6.442 1.00 0.00 ATOM 212 O LEU 28 4.467 -9.672 -7.507 1.00 0.00 ATOM 213 C LEU 28 4.513 -9.258 -6.357 1.00 0.00 ATOM 214 N SER 29 5.615 -9.321 -5.642 1.00 0.00 ATOM 215 CA SER 29 6.783 -9.979 -6.178 1.00 0.00 ATOM 216 CB SER 29 7.940 -9.918 -5.179 1.00 0.00 ATOM 217 OG SER 29 8.371 -8.583 -4.984 1.00 0.00 ATOM 218 O SER 29 6.851 -11.997 -7.485 1.00 0.00 ATOM 219 C SER 29 6.445 -11.440 -6.462 1.00 0.00 ATOM 220 N GLY 30 5.722 -12.070 -5.549 1.00 0.00 ATOM 221 CA GLY 30 5.399 -13.479 -5.755 1.00 0.00 ATOM 222 O GLY 30 4.622 -14.669 -7.671 1.00 0.00 ATOM 223 C GLY 30 4.468 -13.705 -6.920 1.00 0.00 ATOM 224 N LEU 31 3.467 -12.824 -7.007 1.00 0.00 ATOM 225 CA LEU 31 2.485 -12.877 -8.075 1.00 0.00 ATOM 226 CB LEU 31 1.605 -11.701 -8.120 1.00 0.00 ATOM 227 CG LEU 31 0.513 -11.655 -7.049 1.00 0.00 ATOM 228 CD1 LEU 31 -0.156 -10.292 -7.058 1.00 0.00 ATOM 229 CD2 LEU 31 -0.494 -12.766 -7.298 1.00 0.00 ATOM 230 O LEU 31 2.969 -13.407 -10.285 1.00 0.00 ATOM 231 C LEU 31 3.179 -12.654 -9.374 1.00 0.00 ATOM 232 N LEU 32 4.043 -11.633 -9.384 1.00 0.00 ATOM 233 CA LEU 32 4.855 -11.308 -10.557 1.00 0.00 ATOM 234 CB LEU 32 5.625 -10.006 -10.327 1.00 0.00 ATOM 235 CG LEU 32 4.794 -8.722 -10.307 1.00 0.00 ATOM 236 CD1 LEU 32 5.664 -7.524 -9.947 1.00 0.00 ATOM 237 CD2 LEU 32 4.170 -8.463 -11.669 1.00 0.00 ATOM 238 O LEU 32 6.067 -12.741 -12.033 1.00 0.00 ATOM 239 C LEU 32 5.874 -12.396 -10.867 1.00 0.00 ATOM 240 N CYS 33 6.500 -12.962 -9.841 1.00 0.00 ATOM 241 CA CYS 33 7.492 -14.001 -10.092 1.00 0.00 ATOM 242 CB CYS 33 8.503 -14.063 -8.945 1.00 0.00 ATOM 243 SG CYS 33 9.557 -12.601 -8.797 1.00 0.00 ATOM 244 O CYS 33 7.683 -16.376 -10.444 1.00 0.00 ATOM 245 C CYS 33 6.926 -15.420 -10.236 1.00 0.00 ATOM 246 N GLY 34 5.609 -15.569 -10.094 1.00 0.00 ATOM 247 CA GLY 34 4.984 -16.868 -10.256 1.00 0.00 ATOM 248 O GLY 34 4.222 -18.881 -9.238 1.00 0.00 ATOM 249 C GLY 34 4.753 -17.781 -9.062 1.00 0.00 ATOM 250 N GLY 35 5.129 -17.359 -7.860 1.00 0.00 ATOM 251 CA GLY 35 4.919 -18.194 -6.680 1.00 0.00 ATOM 252 O GLY 35 3.117 -18.994 -5.297 1.00 0.00 ATOM 253 C GLY 35 3.496 -18.157 -6.124 1.00 0.00 ATOM 254 N LEU 36 2.738 -17.158 -6.555 1.00 0.00 ATOM 255 CA LEU 36 1.348 -17.010 -6.162 1.00 0.00 ATOM 256 CB LEU 36 1.088 -15.630 -5.553 1.00 0.00 ATOM 257 CG LEU 36 -0.327 -15.331 -5.031 1.00 0.00 ATOM 258 CD1 LEU 36 -0.773 -16.332 -3.963 1.00 0.00 ATOM 259 CD2 LEU 36 -0.349 -13.934 -4.469 1.00 0.00 ATOM 260 O LEU 36 0.543 -16.338 -8.330 1.00 0.00 ATOM 261 C LEU 36 0.544 -17.203 -7.452 1.00 0.00 ATOM 262 N LYS 37 -0.091 -18.377 -7.608 1.00 0.00 ATOM 263 CA LYS 37 -0.891 -18.691 -8.799 1.00 0.00 ATOM 264 CB LYS 37 -1.477 -20.104 -8.694 1.00 0.00 ATOM 265 CG LYS 37 -0.436 -21.209 -8.747 1.00 0.00 ATOM 266 CD LYS 37 -1.086 -22.582 -8.652 1.00 0.00 ATOM 267 CE LYS 37 -0.047 -23.690 -8.705 1.00 0.00 ATOM 268 NZ LYS 37 -0.666 -25.038 -8.599 1.00 0.00 ATOM 269 O LYS 37 -2.522 -17.088 -8.086 1.00 0.00 ATOM 270 C LYS 37 -2.065 -17.748 -9.017 1.00 0.00 ATOM 271 N ASP 38 -2.516 -17.658 -10.266 1.00 0.00 ATOM 272 CA ASP 38 -3.636 -16.809 -10.630 1.00 0.00 ATOM 273 CB ASP 38 -3.988 -16.986 -12.107 1.00 0.00 ATOM 274 CG ASP 38 -2.956 -16.369 -13.030 1.00 0.00 ATOM 275 OD1 ASP 38 -3.205 -16.318 -14.254 1.00 0.00 ATOM 276 OD2 ASP 38 -1.898 -15.930 -12.533 1.00 0.00 ATOM 277 O ASP 38 -5.610 -16.166 -9.457 1.00 0.00 ATOM 278 C ASP 38 -4.908 -17.101 -9.836 1.00 0.00 ATOM 279 N GLN 39 -5.182 -18.378 -9.546 1.00 0.00 ATOM 280 CA GLN 39 -6.389 -18.745 -8.794 1.00 0.00 ATOM 281 CB GLN 39 -6.504 -20.351 -8.929 1.00 0.00 ATOM 282 CG GLN 39 -6.621 -20.942 -10.314 1.00 0.00 ATOM 283 CD GLN 39 -6.481 -22.440 -10.264 1.00 0.00 ATOM 284 OE1 GLN 39 -6.581 -23.023 -9.186 1.00 0.00 ATOM 285 NE2 GLN 39 -6.227 -23.083 -11.410 1.00 0.00 ATOM 286 O GLN 39 -7.553 -18.024 -6.829 1.00 0.00 ATOM 287 C GLN 39 -6.462 -18.159 -7.388 1.00 0.00 ATOM 288 N SER 40 -5.314 -17.818 -6.814 1.00 0.00 ATOM 289 CA SER 40 -5.288 -17.197 -5.492 1.00 0.00 ATOM 290 CB SER 40 -3.672 -17.819 -5.130 1.00 0.00 ATOM 291 OG SER 40 -2.852 -16.833 -5.733 1.00 0.00 ATOM 292 O SER 40 -5.949 -15.005 -4.788 1.00 0.00 ATOM 293 C SER 40 -5.376 -15.686 -5.640 1.00 0.00 ATOM 294 N TRP 41 -4.825 -15.163 -6.735 1.00 0.00 ATOM 295 CA TRP 41 -4.852 -13.725 -6.995 1.00 0.00 ATOM 296 CB TRP 41 -3.881 -13.365 -8.120 1.00 0.00 ATOM 297 CG TRP 41 -3.841 -11.902 -8.434 1.00 0.00 ATOM 298 CD1 TRP 41 -3.089 -10.949 -7.807 1.00 0.00 ATOM 299 CD2 TRP 41 -4.586 -11.222 -9.451 1.00 0.00 ATOM 300 CE2 TRP 41 -4.235 -9.859 -9.383 1.00 0.00 ATOM 301 CE3 TRP 41 -5.515 -11.630 -10.413 1.00 0.00 ATOM 302 NE1 TRP 41 -3.318 -9.718 -8.371 1.00 0.00 ATOM 303 CZ2 TRP 41 -4.779 -8.902 -10.240 1.00 0.00 ATOM 304 CZ3 TRP 41 -6.053 -10.679 -11.259 1.00 0.00 ATOM 305 CH2 TRP 41 -5.685 -9.332 -11.170 1.00 0.00 ATOM 306 O TRP 41 -6.666 -12.154 -7.097 1.00 0.00 ATOM 307 C TRP 41 -6.254 -13.271 -7.405 1.00 0.00 ATOM 308 N LEU 42 -6.954 -14.121 -8.157 1.00 0.00 ATOM 309 CA LEU 42 -8.318 -13.815 -8.603 1.00 0.00 ATOM 310 CB LEU 42 -8.812 -14.879 -9.585 1.00 0.00 ATOM 311 CG LEU 42 -8.152 -14.884 -10.967 1.00 0.00 ATOM 312 CD1 LEU 42 -8.643 -16.064 -11.791 1.00 0.00 ATOM 313 CD2 LEU 42 -8.481 -13.607 -11.723 1.00 0.00 ATOM 314 O LEU 42 -10.138 -12.913 -7.331 1.00 0.00 ATOM 315 C LEU 42 -9.265 -13.779 -7.404 1.00 0.00 ATOM 316 N PRO 43 -9.080 -14.706 -6.467 1.00 0.00 ATOM 317 CA PRO 43 -9.898 -14.751 -5.253 1.00 0.00 ATOM 318 CB PRO 43 -9.523 -15.970 -4.517 1.00 0.00 ATOM 319 CG PRO 43 -9.228 -16.916 -5.627 1.00 0.00 ATOM 320 CD PRO 43 -8.451 -16.097 -6.624 1.00 0.00 ATOM 321 O PRO 43 -10.619 -12.841 -3.986 1.00 0.00 ATOM 322 C PRO 43 -9.664 -13.472 -4.436 1.00 0.00 ATOM 323 N LEU 44 -8.386 -13.078 -4.290 1.00 0.00 ATOM 324 CA LEU 44 -8.087 -11.855 -3.539 1.00 0.00 ATOM 325 CB LEU 44 -6.573 -11.647 -3.433 1.00 0.00 ATOM 326 CG LEU 44 -5.820 -12.616 -2.519 1.00 0.00 ATOM 327 CD1 LEU 44 -4.320 -12.378 -2.606 1.00 0.00 ATOM 328 CD2 LEU 44 -6.246 -12.433 -1.073 1.00 0.00 ATOM 329 O LEU 44 -9.194 -9.714 -3.586 1.00 0.00 ATOM 330 C LEU 44 -8.690 -10.647 -4.233 1.00 0.00 ATOM 331 N LEU 45 -8.663 -10.628 -5.538 1.00 0.00 ATOM 332 CA LEU 45 -9.227 -9.479 -6.264 1.00 0.00 ATOM 333 CB LEU 45 -8.938 -9.597 -7.762 1.00 0.00 ATOM 334 CG LEU 45 -9.411 -8.433 -8.638 1.00 0.00 ATOM 335 CD1 LEU 45 -8.692 -7.148 -8.256 1.00 0.00 ATOM 336 CD2 LEU 45 -9.130 -8.717 -10.105 1.00 0.00 ATOM 337 O LEU 45 -11.332 -8.346 -5.899 1.00 0.00 ATOM 338 C LEU 45 -10.749 -9.416 -6.066 1.00 0.00 ATOM 339 N TYR 46 -11.377 -10.578 -6.072 1.00 0.00 ATOM 340 CA TYR 46 -12.831 -10.687 -5.867 1.00 0.00 ATOM 341 CB TYR 46 -13.274 -12.150 -5.940 1.00 0.00 ATOM 342 CG TYR 46 -14.751 -12.355 -5.693 1.00 0.00 ATOM 343 CD1 TYR 46 -15.681 -12.085 -6.688 1.00 0.00 ATOM 344 CD2 TYR 46 -15.210 -12.819 -4.468 1.00 0.00 ATOM 345 CE1 TYR 46 -17.034 -12.270 -6.473 1.00 0.00 ATOM 346 CE2 TYR 46 -16.558 -13.009 -4.232 1.00 0.00 ATOM 347 CZ TYR 46 -17.473 -12.731 -5.249 1.00 0.00 ATOM 348 OH TYR 46 -18.818 -12.917 -5.031 1.00 0.00 ATOM 349 O TYR 46 -14.162 -9.345 -4.363 1.00 0.00 ATOM 350 C TYR 46 -13.224 -10.128 -4.492 1.00 0.00 ATOM 351 N GLN 47 -12.496 -10.568 -3.472 1.00 0.00 ATOM 352 CA GLN 47 -12.703 -10.147 -2.091 1.00 0.00 ATOM 353 CB GLN 47 -11.711 -10.849 -1.163 1.00 0.00 ATOM 354 CG GLN 47 -11.964 -12.339 -0.995 1.00 0.00 ATOM 355 CD GLN 47 -13.320 -12.633 -0.385 1.00 0.00 ATOM 356 OE1 GLN 47 -13.652 -12.130 0.689 1.00 0.00 ATOM 357 NE2 GLN 47 -14.110 -13.453 -1.070 1.00 0.00 ATOM 358 O GLN 47 -13.342 -7.988 -1.283 1.00 0.00 ATOM 359 C GLN 47 -12.516 -8.642 -1.915 1.00 0.00 ATOM 360 N PHE 48 -11.445 -8.088 -2.453 1.00 0.00 ATOM 361 CA PHE 48 -11.148 -6.656 -2.370 1.00 0.00 ATOM 362 CB PHE 48 -9.865 -6.327 -3.135 1.00 0.00 ATOM 363 CG PHE 48 -8.612 -6.767 -2.436 1.00 0.00 ATOM 364 CD1 PHE 48 -8.641 -7.139 -1.101 1.00 0.00 ATOM 365 CD2 PHE 48 -7.404 -6.812 -3.107 1.00 0.00 ATOM 366 CE1 PHE 48 -7.488 -7.545 -0.457 1.00 0.00 ATOM 367 CE2 PHE 48 -6.251 -7.217 -2.463 1.00 0.00 ATOM 368 CZ PHE 48 -6.290 -7.583 -1.143 1.00 0.00 ATOM 369 O PHE 48 -12.727 -4.825 -2.428 1.00 0.00 ATOM 370 C PHE 48 -12.297 -5.849 -2.972 1.00 0.00 ATOM 371 N SER 49 -12.733 -6.358 -4.102 1.00 0.00 ATOM 372 CA SER 49 -13.828 -5.758 -4.879 1.00 0.00 ATOM 373 CB SER 49 -14.088 -6.566 -6.150 1.00 0.00 ATOM 374 OG SER 49 -12.985 -6.496 -7.036 1.00 0.00 ATOM 375 O SER 49 -15.615 -4.677 -3.679 1.00 0.00 ATOM 376 C SER 49 -15.095 -5.748 -4.017 1.00 0.00 ATOM 377 N ASN 50 -15.531 -6.945 -3.676 1.00 0.00 ATOM 378 CA ASN 50 -16.735 -7.143 -2.857 1.00 0.00 ATOM 379 CB ASN 50 -16.863 -8.608 -2.437 1.00 0.00 ATOM 380 CG ASN 50 -18.146 -8.885 -1.677 1.00 0.00 ATOM 381 ND2 ASN 50 -18.011 -9.355 -0.442 1.00 0.00 ATOM 382 OD1 ASN 50 -19.244 -8.680 -2.195 1.00 0.00 ATOM 383 O ASN 50 -17.704 -5.735 -1.177 1.00 0.00 ATOM 384 C ASN 50 -16.669 -6.289 -1.605 1.00 0.00 ATOM 385 N ASP 51 -15.487 -6.174 -1.027 1.00 0.00 ATOM 386 CA ASP 51 -15.295 -5.370 0.179 1.00 0.00 ATOM 387 CB ASP 51 -15.558 -5.361 1.330 1.00 0.00 ATOM 388 CG ASP 51 -15.662 -6.624 2.139 1.00 0.00 ATOM 389 OD1 ASP 51 -16.092 -7.666 1.634 1.00 0.00 ATOM 390 OD2 ASP 51 -15.282 -6.537 3.348 1.00 0.00 ATOM 391 O ASP 51 -13.007 -5.372 -0.533 1.00 0.00 ATOM 392 C ASP 51 -13.846 -4.882 0.222 1.00 0.00 ATOM 393 N ASN 52 -13.576 -3.862 1.035 1.00 0.00 ATOM 394 CA ASN 52 -12.219 -3.373 1.197 1.00 0.00 ATOM 395 CB ASN 52 -12.066 -1.993 0.550 1.00 0.00 ATOM 396 CG ASN 52 -12.931 -0.940 1.210 1.00 0.00 ATOM 397 ND2 ASN 52 -13.967 -1.383 1.913 1.00 0.00 ATOM 398 OD1 ASN 52 -12.670 0.256 1.091 1.00 0.00 ATOM 399 O ASN 52 -12.825 -3.567 3.499 1.00 0.00 ATOM 400 C ASN 52 -11.941 -3.278 2.692 1.00 0.00 ATOM 401 N HIS 53 -10.730 -2.869 3.065 1.00 0.00 ATOM 402 CA HIS 53 -10.367 -2.802 4.483 1.00 0.00 ATOM 403 CB HIS 53 -8.850 -3.774 4.170 1.00 0.00 ATOM 404 CG HIS 53 -7.747 -2.823 3.961 1.00 0.00 ATOM 405 CD2 HIS 53 -7.161 -2.374 2.814 1.00 0.00 ATOM 406 ND1 HIS 53 -7.105 -2.123 5.003 1.00 0.00 ATOM 407 CE1 HIS 53 -6.187 -1.350 4.455 1.00 0.00 ATOM 408 NE2 HIS 53 -6.176 -1.524 3.130 1.00 0.00 ATOM 409 O HIS 53 -10.334 -1.181 6.295 1.00 0.00 ATOM 410 C HIS 53 -10.634 -1.445 5.118 1.00 0.00 ATOM 411 N ALA 54 -11.189 -0.512 4.339 1.00 0.00 ATOM 412 CA ALA 54 -11.412 0.844 4.826 1.00 0.00 ATOM 413 CB ALA 54 -11.693 1.756 3.662 1.00 0.00 ATOM 414 O ALA 54 -13.615 0.132 5.384 1.00 0.00 ATOM 415 C ALA 54 -12.719 0.950 5.610 1.00 0.00 ATOM 416 N TYR 55 -12.784 1.945 6.479 1.00 0.00 ATOM 417 CA TYR 55 -13.951 2.465 7.159 1.00 0.00 ATOM 418 CB TYR 55 -13.667 2.958 8.579 1.00 0.00 ATOM 419 CG TYR 55 -13.327 1.819 9.538 1.00 0.00 ATOM 420 CD1 TYR 55 -11.996 1.409 9.626 1.00 0.00 ATOM 421 CD2 TYR 55 -14.313 1.245 10.346 1.00 0.00 ATOM 422 CE1 TYR 55 -11.668 0.366 10.502 1.00 0.00 ATOM 423 CE2 TYR 55 -14.008 0.197 11.206 1.00 0.00 ATOM 424 CZ TYR 55 -12.678 -0.219 11.252 1.00 0.00 ATOM 425 OH TYR 55 -12.328 -1.293 12.101 1.00 0.00 ATOM 426 O TYR 55 -13.678 4.609 6.205 1.00 0.00 ATOM 427 C TYR 55 -14.484 3.695 6.422 1.00 0.00 ATOM 428 N PRO 56 -15.779 3.661 6.067 1.00 0.00 ATOM 429 CA PRO 56 -16.392 4.845 5.462 1.00 0.00 ATOM 430 CB PRO 56 -17.768 4.353 5.008 1.00 0.00 ATOM 431 CG PRO 56 -18.086 3.224 5.926 1.00 0.00 ATOM 432 CD PRO 56 -16.808 2.448 6.088 1.00 0.00 ATOM 433 O PRO 56 -16.896 7.114 5.893 1.00 0.00 ATOM 434 C PRO 56 -16.556 6.032 6.382 1.00 0.00 ATOM 435 N THR 57 -16.292 5.903 7.670 1.00 0.00 ATOM 436 CA THR 57 -16.315 7.037 8.577 1.00 0.00 ATOM 437 CB THR 57 -16.606 6.598 10.023 1.00 0.00 ATOM 438 CG2 THR 57 -17.944 5.881 10.102 1.00 0.00 ATOM 439 OG1 THR 57 -15.577 5.707 10.472 1.00 0.00 ATOM 440 O THR 57 -14.973 8.837 9.268 1.00 0.00 ATOM 441 C THR 57 -15.012 7.797 8.621 1.00 0.00 ATOM 442 N GLY 58 -13.896 7.191 8.154 1.00 0.00 ATOM 443 CA GLY 58 -12.637 7.895 8.087 1.00 0.00 ATOM 444 O GLY 58 -12.658 7.593 5.737 1.00 0.00 ATOM 445 C GLY 58 -12.001 7.867 6.725 1.00 0.00 ATOM 446 N LEU 59 -10.600 7.709 6.398 1.00 0.00 ATOM 447 CA LEU 59 -9.970 7.949 5.104 1.00 0.00 ATOM 448 CB LEU 59 -8.447 7.997 5.250 1.00 0.00 ATOM 449 CG LEU 59 -7.881 9.164 6.061 1.00 0.00 ATOM 450 CD1 LEU 59 -6.378 9.017 6.232 1.00 0.00 ATOM 451 CD2 LEU 59 -8.154 10.488 5.363 1.00 0.00 ATOM 452 O LEU 59 -9.991 7.022 2.924 1.00 0.00 ATOM 453 C LEU 59 -10.300 6.864 4.097 1.00 0.00 ATOM 454 N VAL 60 -10.957 5.797 4.567 1.00 0.00 ATOM 455 CA VAL 60 -11.377 4.694 3.697 1.00 0.00 ATOM 456 CB VAL 60 -10.978 3.366 4.857 1.00 0.00 ATOM 457 CG1 VAL 60 -9.944 3.741 5.920 1.00 0.00 ATOM 458 CG2 VAL 60 -12.372 3.191 5.487 1.00 0.00 ATOM 459 O VAL 60 -13.245 4.169 2.378 1.00 0.00 ATOM 460 C VAL 60 -12.569 5.095 2.832 1.00 0.00 ATOM 461 N GLN 61 -13.196 6.211 3.182 1.00 0.00 ATOM 462 CA GLN 61 -14.419 6.653 2.502 1.00 0.00 ATOM 463 CB GLN 61 -14.889 7.996 3.066 1.00 0.00 ATOM 464 CG GLN 61 -16.196 8.494 2.469 1.00 0.00 ATOM 465 CD GLN 61 -16.662 9.794 3.096 1.00 0.00 ATOM 466 OE1 GLN 61 -16.001 10.344 3.976 1.00 0.00 ATOM 467 NE2 GLN 61 -17.808 10.291 2.642 1.00 0.00 ATOM 468 O GLN 61 -15.195 6.999 0.319 1.00 0.00 ATOM 469 C GLN 61 -14.190 6.824 1.005 1.00 0.00 ATOM 470 N PRO 62 -13.051 7.464 0.679 1.00 0.00 ATOM 471 CA PRO 62 -12.767 7.659 -0.740 1.00 0.00 ATOM 472 CB PRO 62 -11.771 8.820 -0.764 1.00 0.00 ATOM 473 CG PRO 62 -11.059 8.725 0.545 1.00 0.00 ATOM 474 CD PRO 62 -12.108 8.395 1.567 1.00 0.00 ATOM 475 O PRO 62 -11.792 5.447 -0.498 1.00 0.00 ATOM 476 C PRO 62 -12.163 6.333 -1.281 1.00 0.00 ATOM 477 N VAL 63 -11.979 5.519 0.336 1.00 0.00 ATOM 478 CA VAL 63 -11.395 4.196 0.527 1.00 0.00 ATOM 479 CB VAL 63 -11.342 3.811 2.025 1.00 0.00 ATOM 480 CG1 VAL 63 -10.953 2.341 2.186 1.00 0.00 ATOM 481 CG2 VAL 63 -10.358 4.703 2.770 1.00 0.00 ATOM 482 O VAL 63 -11.592 2.336 -0.992 1.00 0.00 ATOM 483 C VAL 63 -12.178 3.128 -0.252 1.00 0.00 ATOM 484 N THR 64 -13.512 3.130 -0.106 1.00 0.00 ATOM 485 CA THR 64 -14.304 2.124 -0.814 1.00 0.00 ATOM 486 CB THR 64 -15.806 2.259 -0.539 1.00 0.00 ATOM 487 CG2 THR 64 -16.569 1.166 -1.285 1.00 0.00 ATOM 488 OG1 THR 64 -16.093 2.097 0.857 1.00 0.00 ATOM 489 O THR 64 -13.866 1.255 -3.008 1.00 0.00 ATOM 490 C THR 64 -14.068 2.257 -2.315 1.00 0.00 ATOM 491 N GLU 65 -14.086 3.477 -2.850 1.00 0.00 ATOM 492 CA GLU 65 -13.861 3.660 -4.278 1.00 0.00 ATOM 493 CB GLU 65 -14.172 5.104 -4.679 1.00 0.00 ATOM 494 CG GLU 65 -13.956 5.423 -6.158 1.00 0.00 ATOM 495 CD GLU 65 -14.762 4.528 -7.085 1.00 0.00 ATOM 496 OE1 GLU 65 -15.948 4.274 -6.791 1.00 0.00 ATOM 497 OE2 GLU 65 -14.213 4.088 -8.119 1.00 0.00 ATOM 498 O GLU 65 -12.123 2.712 -5.618 1.00 0.00 ATOM 499 C GLU 65 -12.409 3.330 -4.597 1.00 0.00 ATOM 500 N LEU 66 -11.489 3.727 -3.718 1.00 0.00 ATOM 501 CA LEU 66 -10.082 3.423 -3.937 1.00 0.00 ATOM 502 CB LEU 66 -9.243 4.000 -2.764 1.00 0.00 ATOM 503 CG LEU 66 -7.719 3.890 -2.864 1.00 0.00 ATOM 504 CD1 LEU 66 -7.218 4.716 -4.033 1.00 0.00 ATOM 505 CD2 LEU 66 -7.088 4.368 -1.560 1.00 0.00 ATOM 506 O LEU 66 -9.156 1.427 -4.893 1.00 0.00 ATOM 507 C LEU 66 -9.897 1.911 -4.043 1.00 0.00 ATOM 508 N TYR 67 -9.287 1.719 -6.198 1.00 0.00 ATOM 509 CA TYR 67 -8.804 0.479 -6.803 1.00 0.00 ATOM 510 CB TYR 67 -8.455 -0.648 -5.855 1.00 0.00 ATOM 511 CG TYR 67 -7.358 -0.253 -4.875 1.00 0.00 ATOM 512 CD1 TYR 67 -6.212 0.412 -5.318 1.00 0.00 ATOM 513 CD2 TYR 67 -7.465 -0.557 -3.522 1.00 0.00 ATOM 514 CE1 TYR 67 -5.219 0.779 -4.423 1.00 0.00 ATOM 515 CE2 TYR 67 -6.476 -0.172 -2.619 1.00 0.00 ATOM 516 CZ TYR 67 -5.357 0.477 -3.088 1.00 0.00 ATOM 517 OH TYR 67 -4.364 0.797 -2.217 1.00 0.00 ATOM 518 O TYR 67 -9.446 -0.447 -8.916 1.00 0.00 ATOM 519 C TYR 67 -9.811 0.026 -7.837 1.00 0.00 ATOM 520 N GLU 68 -11.085 0.229 -7.610 1.00 0.00 ATOM 521 CA GLU 68 -12.095 -0.016 -8.646 1.00 0.00 ATOM 522 CB GLU 68 -13.502 0.212 -8.089 1.00 0.00 ATOM 523 CG GLU 68 -14.616 -0.058 -9.088 1.00 0.00 ATOM 524 CD GLU 68 -15.994 0.129 -8.484 1.00 0.00 ATOM 525 OE1 GLU 68 -16.079 0.474 -7.287 1.00 0.00 ATOM 526 OE2 GLU 68 -16.991 -0.068 -9.212 1.00 0.00 ATOM 527 O GLU 68 -12.006 0.429 -11.017 1.00 0.00 ATOM 528 C GLU 68 -11.928 0.916 -9.870 1.00 0.00 ATOM 529 N GLN 69 -11.720 2.235 -9.641 1.00 0.00 ATOM 530 CA GLN 69 -11.474 3.142 -10.754 1.00 0.00 ATOM 531 CB GLN 69 -11.040 4.571 -9.950 1.00 0.00 ATOM 532 CG GLN 69 -11.506 4.725 -8.513 1.00 0.00 ATOM 533 CD GLN 69 -10.720 5.775 -7.756 1.00 0.00 ATOM 534 OE1 GLN 69 -10.981 6.031 -6.582 1.00 0.00 ATOM 535 NE2 GLN 69 -9.750 6.387 -8.424 1.00 0.00 ATOM 536 O GLN 69 -10.014 3.058 -12.671 1.00 0.00 ATOM 537 C GLN 69 -10.148 2.874 -11.451 1.00 0.00 ATOM 538 N ILE 70 -9.133 2.475 -10.677 1.00 0.00 ATOM 539 CA ILE 70 -7.824 2.209 -11.273 1.00 0.00 ATOM 540 CB ILE 70 -6.722 2.137 -10.196 1.00 0.00 ATOM 541 CG1 ILE 70 -6.471 3.440 -9.462 1.00 0.00 ATOM 542 CG2 ILE 70 -5.441 1.588 -10.794 1.00 0.00 ATOM 543 CD1 ILE 70 -5.737 3.347 -8.141 1.00 0.00 ATOM 544 O ILE 70 -7.456 0.884 -13.255 1.00 0.00 ATOM 545 C ILE 70 -7.928 0.923 -12.096 1.00 0.00 ATOM 546 N SER 71 -8.521 -0.109 -11.507 1.00 0.00 ATOM 547 CA SER 71 -8.753 -1.347 -12.280 1.00 0.00 ATOM 548 CB SER 71 -9.337 -2.438 -11.380 1.00 0.00 ATOM 549 OG SER 71 -8.405 -2.833 -10.387 1.00 0.00 ATOM 550 O SER 71 -9.431 -1.585 -14.539 1.00 0.00 ATOM 551 C SER 71 -9.736 -1.087 -13.425 1.00 0.00 ATOM 552 N GLN 72 -10.792 -0.304 -13.231 1.00 0.00 ATOM 553 CA GLN 72 -11.716 -0.002 -14.315 1.00 0.00 ATOM 554 CB GLN 72 -12.887 0.843 -13.804 1.00 0.00 ATOM 555 CG GLN 72 -13.923 1.171 -14.865 1.00 0.00 ATOM 556 CD GLN 72 -15.098 1.951 -14.307 1.00 0.00 ATOM 557 OE1 GLN 72 -15.139 2.267 -13.117 1.00 0.00 ATOM 558 NE2 GLN 72 -16.060 2.265 -15.168 1.00 0.00 ATOM 559 O GLN 72 -11.113 0.452 -16.592 1.00 0.00 ATOM 560 C GLN 72 -10.998 0.772 -15.407 1.00 0.00 ATOM 561 N THR 73 -10.194 1.804 -15.055 1.00 0.00 ATOM 562 CA THR 73 -9.471 2.597 -16.032 1.00 0.00 ATOM 563 CB THR 73 -8.919 3.894 -15.408 1.00 0.00 ATOM 564 CG2 THR 73 -8.136 4.688 -16.440 1.00 0.00 ATOM 565 OG1 THR 73 -10.004 4.697 -14.932 1.00 0.00 ATOM 566 O THR 73 -8.024 1.862 -17.800 1.00 0.00 ATOM 567 C THR 73 -8.293 1.824 -16.599 1.00 0.00 ATOM 568 N LEU 74 -7.587 1.084 -15.731 1.00 0.00 ATOM 569 CA LEU 74 -6.406 0.358 -16.168 1.00 0.00 ATOM 570 CB LEU 74 -5.147 0.998 -15.520 1.00 0.00 ATOM 571 CG LEU 74 -4.982 2.481 -15.653 1.00 0.00 ATOM 572 CD1 LEU 74 -3.730 2.947 -14.869 1.00 0.00 ATOM 573 CD2 LEU 74 -4.913 2.874 -17.087 1.00 0.00 ATOM 574 O LEU 74 -7.141 -1.671 -15.126 1.00 0.00 ATOM 575 C LEU 74 -6.751 -1.131 -16.153 1.00 0.00 ATOM 576 N SER 75 -6.626 -1.797 -17.297 1.00 0.00 ATOM 577 CA SER 75 -6.923 -3.220 -17.395 1.00 0.00 ATOM 578 CB SER 75 -7.358 -3.583 -18.817 1.00 0.00 ATOM 579 OG SER 75 -6.297 -3.394 -19.736 1.00 0.00 ATOM 580 O SER 75 -5.777 -5.206 -16.671 1.00 0.00 ATOM 581 C SER 75 -5.678 -4.039 -17.037 1.00 0.00 ATOM 582 N ASP 76 -4.511 -3.398 -17.135 1.00 0.00 ATOM 583 CA ASP 76 -3.234 -4.051 -16.845 1.00 0.00 ATOM 584 CB ASP 76 -2.043 -3.561 -17.252 1.00 0.00 ATOM 585 CG ASP 76 -1.719 -4.277 -18.556 1.00 0.00 ATOM 586 OD1 ASP 76 -2.203 -5.427 -18.726 1.00 0.00 ATOM 587 OD2 ASP 76 -1.016 -3.782 -19.457 1.00 0.00 ATOM 588 O ASP 76 -3.372 -4.100 -14.457 1.00 0.00 ATOM 589 C ASP 76 -3.147 -4.732 -15.481 1.00 0.00 ATOM 590 N VAL 77 -2.769 -6.006 -15.486 1.00 0.00 ATOM 591 CA VAL 77 -2.619 -6.798 -14.266 1.00 0.00 ATOM 592 CB VAL 77 -3.985 -7.483 -13.879 1.00 0.00 ATOM 593 CG1 VAL 77 -4.484 -8.325 -15.076 1.00 0.00 ATOM 594 CG2 VAL 77 -3.819 -8.384 -12.630 1.00 0.00 ATOM 595 O VAL 77 -1.258 -8.427 -15.402 1.00 0.00 ATOM 596 C VAL 77 -1.397 -7.701 -14.412 1.00 0.00 ATOM 597 N GLU 78 0.249 -7.898 -13.629 1.00 0.00 ATOM 598 CA GLU 78 0.144 -9.271 -13.128 1.00 0.00 ATOM 599 CB GLU 78 1.531 -9.902 -13.001 1.00 0.00 ATOM 600 CG GLU 78 2.237 -10.125 -14.329 1.00 0.00 ATOM 601 CD GLU 78 3.629 -10.703 -14.160 1.00 0.00 ATOM 602 OE1 GLU 78 4.062 -10.880 -13.002 1.00 0.00 ATOM 603 OE2 GLU 78 4.285 -10.979 -15.186 1.00 0.00 ATOM 604 O GLU 78 -0.519 -10.397 -11.182 1.00 0.00 ATOM 605 C GLU 78 -0.520 -9.307 -11.754 1.00 0.00 ATOM 606 N GLY 79 -0.391 -8.214 -11.012 1.00 0.00 ATOM 607 CA GLY 79 -0.948 -8.131 -9.658 1.00 0.00 ATOM 608 O GLY 79 -1.090 -5.837 -10.120 1.00 0.00 ATOM 609 C GLY 79 -1.130 -6.679 -9.225 1.00 0.00 ATOM 610 N PHE 80 -1.964 -6.466 -8.221 1.00 0.00 ATOM 611 CA PHE 80 -2.262 -5.120 -7.712 1.00 0.00 ATOM 612 CB PHE 80 -3.741 -4.753 -7.937 1.00 0.00 ATOM 613 CG PHE 80 -4.135 -4.577 -9.372 1.00 0.00 ATOM 614 CD1 PHE 80 -4.484 -5.674 -10.159 1.00 0.00 ATOM 615 CD2 PHE 80 -4.248 -3.301 -9.917 1.00 0.00 ATOM 616 CE1 PHE 80 -4.938 -5.495 -11.463 1.00 0.00 ATOM 617 CE2 PHE 80 -4.701 -3.108 -11.218 1.00 0.00 ATOM 618 CZ PHE 80 -5.049 -4.207 -11.996 1.00 0.00 ATOM 619 O PHE 80 -2.438 -6.028 -5.492 1.00 0.00 ATOM 620 C PHE 80 -2.048 -5.094 -6.199 1.00 0.00 ATOM 621 N THR 81 -1.435 -4.025 -5.697 1.00 0.00 ATOM 622 CA THR 81 -1.234 -3.876 -4.257 1.00 0.00 ATOM 623 CB THR 81 0.174 -3.363 -3.902 1.00 0.00 ATOM 624 CG2 THR 81 0.311 -3.204 -2.390 1.00 0.00 ATOM 625 OG1 THR 81 1.159 -4.302 -4.363 1.00 0.00 ATOM 626 O THR 81 -2.145 -1.658 -4.191 1.00 0.00 ATOM 627 C THR 81 -2.279 -2.838 -3.862 1.00 0.00 ATOM 628 N PHE 82 -3.340 -3.282 -3.200 1.00 0.00 ATOM 629 CA PHE 82 -4.438 -2.412 -2.810 1.00 0.00 ATOM 630 CB PHE 82 -5.595 -3.372 -2.596 1.00 0.00 ATOM 631 CG PHE 82 -6.330 -3.467 -3.906 1.00 0.00 ATOM 632 CD1 PHE 82 -5.821 -4.225 -4.960 1.00 0.00 ATOM 633 CD2 PHE 82 -7.536 -2.789 -4.089 1.00 0.00 ATOM 634 CE1 PHE 82 -6.499 -4.310 -6.178 1.00 0.00 ATOM 635 CE2 PHE 82 -8.219 -2.866 -5.301 1.00 0.00 ATOM 636 CZ PHE 82 -7.689 -3.634 -6.349 1.00 0.00 ATOM 637 O PHE 82 -4.039 -3.108 -0.524 1.00 0.00 ATOM 638 C PHE 82 -4.305 -2.162 -1.287 1.00 0.00 ATOM 639 N GLU 83 -3.793 -0.400 -0.321 1.00 0.00 ATOM 640 CA GLU 83 -4.575 -0.472 0.912 1.00 0.00 ATOM 641 CB GLU 83 -3.659 -0.390 2.134 1.00 0.00 ATOM 642 CG GLU 83 -2.691 -1.555 2.264 1.00 0.00 ATOM 643 CD GLU 83 -1.445 -1.377 1.420 1.00 0.00 ATOM 644 OE1 GLU 83 -1.334 -0.333 0.740 1.00 0.00 ATOM 645 OE2 GLU 83 -0.580 -2.276 1.439 1.00 0.00 ATOM 646 O GLU 83 -5.525 1.582 0.003 1.00 0.00 ATOM 647 C GLU 83 -5.552 0.719 0.902 1.00 0.00 ATOM 648 N LEU 84 -6.509 0.694 1.814 1.00 0.00 ATOM 649 CA LEU 84 -7.539 1.730 1.876 1.00 0.00 ATOM 650 CB LEU 84 -8.716 0.505 2.625 1.00 0.00 ATOM 651 CG LEU 84 -8.395 -0.967 2.414 1.00 0.00 ATOM 652 CD1 LEU 84 -9.317 -1.852 3.277 1.00 0.00 ATOM 653 CD2 LEU 84 -8.410 -1.420 0.965 1.00 0.00 ATOM 654 O LEU 84 -7.685 4.136 2.221 1.00 0.00 ATOM 655 C LEU 84 -7.024 3.083 2.407 1.00 0.00 ATOM 656 N GLY 85 -5.872 3.071 3.087 1.00 0.00 ATOM 657 CA GLY 85 -5.327 4.308 3.626 1.00 0.00 ATOM 658 O GLY 85 -5.639 5.791 5.493 1.00 0.00 ATOM 659 C GLY 85 -5.692 4.608 5.077 1.00 0.00 ATOM 660 N LEU 86 -6.039 3.564 5.839 1.00 0.00 ATOM 661 CA LEU 86 -6.522 3.739 7.215 1.00 0.00 ATOM 662 CB LEU 86 -7.232 2.472 7.698 1.00 0.00 ATOM 663 CG LEU 86 -7.892 2.551 9.078 1.00 0.00 ATOM 664 CD1 LEU 86 -9.006 3.585 9.083 1.00 0.00 ATOM 665 CD2 LEU 86 -8.489 1.205 9.463 1.00 0.00 ATOM 666 O LEU 86 -4.416 3.354 8.228 1.00 0.00 ATOM 667 C LEU 86 -5.448 4.035 8.257 1.00 0.00 ATOM 668 N THR 87 -5.801 4.962 9.107 1.00 0.00 ATOM 669 CA THR 87 -4.930 5.341 10.225 1.00 0.00 ATOM 670 CB THR 87 -4.772 6.869 10.325 1.00 0.00 ATOM 671 CG2 THR 87 -4.091 7.415 9.080 1.00 0.00 ATOM 672 OG1 THR 87 -6.061 7.478 10.456 1.00 0.00 ATOM 673 O THR 87 -6.658 5.172 11.807 1.00 0.00 ATOM 674 C THR 87 -5.497 4.848 11.554 1.00 0.00 ATOM 675 N GLU 88 -5.090 3.648 11.961 1.00 0.00 ATOM 676 CA GLU 88 -5.577 3.049 13.203 1.00 0.00 ATOM 677 CB GLU 88 -6.066 1.566 12.737 1.00 0.00 ATOM 678 CG GLU 88 -7.489 1.485 12.181 1.00 0.00 ATOM 679 CD GLU 88 -8.560 1.534 13.273 1.00 0.00 ATOM 680 OE1 GLU 88 -8.807 0.484 13.981 1.00 0.00 ATOM 681 OE2 GLU 88 -9.215 2.625 13.485 1.00 0.00 ATOM 682 O GLU 88 -5.016 3.138 15.479 1.00 0.00 ATOM 683 C GLU 88 -5.014 3.772 14.423 1.00 0.00 ATOM 684 N ASP 89 -3.996 4.598 14.196 1.00 0.00 ATOM 685 CA ASP 89 -3.399 5.395 15.271 1.00 0.00 ATOM 686 CB ASP 89 -2.151 5.567 15.527 1.00 0.00 ATOM 687 CG ASP 89 -1.874 4.660 16.705 1.00 0.00 ATOM 688 OD1 ASP 89 -2.842 4.138 17.297 1.00 0.00 ATOM 689 OD2 ASP 89 -0.688 4.479 17.050 1.00 0.00 ATOM 690 O ASP 89 -4.470 7.217 14.252 1.00 0.00 ATOM 691 C ASP 89 -3.987 6.802 15.308 1.00 0.00 ATOM 692 N GLU 90 -4.583 7.159 16.443 1.00 0.00 ATOM 693 CA GLU 90 -5.260 8.452 16.586 1.00 0.00 ATOM 694 CB GLU 90 -5.786 8.630 18.012 1.00 0.00 ATOM 695 CG GLU 90 -6.540 9.929 18.238 1.00 0.00 ATOM 696 CD GLU 90 -7.086 10.045 19.648 1.00 0.00 ATOM 697 OE1 GLU 90 -6.874 9.109 20.446 1.00 0.00 ATOM 698 OE2 GLU 90 -7.729 11.072 19.953 1.00 0.00 ATOM 699 O GLU 90 -4.830 10.720 16.169 1.00 0.00 ATOM 700 C GLU 90 -4.309 9.608 16.283 1.00 0.00 ATOM 701 N ASN 91 -3.064 9.541 16.846 1.00 0.00 ATOM 702 CA ASN 91 -2.131 10.623 16.562 1.00 0.00 ATOM 703 CB ASN 91 -0.963 10.647 17.549 1.00 0.00 ATOM 704 CG ASN 91 -1.416 11.234 18.890 1.00 0.00 ATOM 705 ND2 ASN 91 -0.488 11.966 19.496 1.00 0.00 ATOM 706 OD1 ASN 91 -2.547 11.074 19.375 1.00 0.00 ATOM 707 O ASN 91 -1.364 11.638 14.510 1.00 0.00 ATOM 708 C ASN 91 -1.628 10.593 15.132 1.00 0.00 ATOM 709 N VAL 92 -1.492 9.404 14.534 1.00 0.00 ATOM 710 CA VAL 92 -1.079 9.305 13.134 1.00 0.00 ATOM 711 CB VAL 92 -0.970 7.837 12.681 1.00 0.00 ATOM 712 CG1 VAL 92 -0.744 7.759 11.178 1.00 0.00 ATOM 713 CG2 VAL 92 0.194 7.149 13.379 1.00 0.00 ATOM 714 O VAL 92 -1.725 10.674 11.283 1.00 0.00 ATOM 715 C VAL 92 -2.100 10.008 12.242 1.00 0.00 ATOM 716 N PHE 93 -3.393 9.856 12.516 1.00 0.00 ATOM 717 CA PHE 93 -4.394 10.542 11.704 1.00 0.00 ATOM 718 CB PHE 93 -5.787 10.370 12.312 1.00 0.00 ATOM 719 CG PHE 93 -6.893 10.919 11.461 1.00 0.00 ATOM 720 CD1 PHE 93 -7.351 10.219 10.356 1.00 0.00 ATOM 721 CD2 PHE 93 -7.480 12.136 11.761 1.00 0.00 ATOM 722 CE1 PHE 93 -8.371 10.724 9.572 1.00 0.00 ATOM 723 CE2 PHE 93 -8.500 12.643 10.975 1.00 0.00 ATOM 724 CZ PHE 93 -8.944 11.941 9.885 1.00 0.00 ATOM 725 O PHE 93 -4.516 12.575 10.493 1.00 0.00 ATOM 726 C PHE 93 -4.192 12.034 11.550 1.00 0.00 ATOM 727 N THR 94 -3.634 12.702 12.570 1.00 0.00 ATOM 728 CA THR 94 -3.438 14.157 12.478 1.00 0.00 ATOM 729 CB THR 94 -3.036 14.758 13.838 1.00 0.00 ATOM 730 CG2 THR 94 -4.112 14.492 14.877 1.00 0.00 ATOM 731 OG1 THR 94 -1.808 14.164 14.281 1.00 0.00 ATOM 732 O THR 94 -2.217 15.732 11.159 1.00 0.00 ATOM 733 C THR 94 -2.343 14.546 11.483 1.00 0.00 ATOM 734 N GLN 95 -1.586 13.555 11.005 1.00 0.00 ATOM 735 CA GLN 95 -0.525 13.790 10.019 1.00 0.00 ATOM 736 CB GLN 95 0.714 12.960 10.360 1.00 0.00 ATOM 737 CG GLN 95 1.356 13.320 11.691 1.00 0.00 ATOM 738 CD GLN 95 2.539 12.436 12.028 1.00 0.00 ATOM 739 OE1 GLN 95 2.879 11.523 11.274 1.00 0.00 ATOM 740 NE2 GLN 95 3.173 12.703 13.162 1.00 0.00 ATOM 741 O GLN 95 -0.236 13.583 7.625 1.00 0.00 ATOM 742 C GLN 95 -0.978 13.399 8.605 1.00 0.00 ATOM 743 N ALA 96 -2.194 12.867 8.483 1.00 0.00 ATOM 744 CA ALA 96 -2.689 12.435 7.182 1.00 0.00 ATOM 745 CB ALA 96 -4.072 11.818 7.317 1.00 0.00 ATOM 746 O ALA 96 -2.350 13.531 5.042 1.00 0.00 ATOM 747 C ALA 96 -2.787 13.623 6.205 1.00 0.00 ATOM 748 N ASP 97 -3.291 14.778 6.668 1.00 0.00 ATOM 749 CA ASP 97 -3.392 15.959 5.816 1.00 0.00 ATOM 750 CB ASP 97 -3.995 17.130 6.594 1.00 0.00 ATOM 751 CG ASP 97 -5.477 16.949 6.864 1.00 0.00 ATOM 752 OD1 ASP 97 -6.111 17.902 7.361 1.00 0.00 ATOM 753 OD2 ASP 97 -6.002 15.851 6.581 1.00 0.00 ATOM 754 O ASP 97 -1.839 16.685 4.143 1.00 0.00 ATOM 755 C ASP 97 -2.008 16.372 5.315 1.00 0.00 ATOM 756 N SER 98 -1.029 16.375 6.215 1.00 0.00 ATOM 757 CA SER 98 0.335 16.745 5.875 1.00 0.00 ATOM 758 CB SER 98 1.223 16.729 7.119 1.00 0.00 ATOM 759 OG SER 98 0.834 17.736 8.038 1.00 0.00 ATOM 760 O SER 98 1.403 16.217 3.792 1.00 0.00 ATOM 761 C SER 98 0.953 15.795 4.856 1.00 0.00 ATOM 762 N LEU 99 0.967 14.508 5.201 1.00 0.00 ATOM 763 CA LEU 99 1.536 13.501 4.313 1.00 0.00 ATOM 764 CB LEU 99 1.503 12.121 4.975 1.00 0.00 ATOM 765 CG LEU 99 2.468 11.907 6.145 1.00 0.00 ATOM 766 CD1 LEU 99 2.238 10.547 6.785 1.00 0.00 ATOM 767 CD2 LEU 99 3.911 11.971 5.668 1.00 0.00 ATOM 768 O LEU 99 1.403 13.205 1.934 1.00 0.00 ATOM 769 C LEU 99 0.784 13.380 2.979 1.00 0.00 ATOM 770 N SER 100 -0.538 13.464 3.010 1.00 0.00 ATOM 771 CA SER 100 -1.342 13.366 1.793 1.00 0.00 ATOM 772 CB SER 100 -2.833 13.405 2.130 1.00 0.00 ATOM 773 OG SER 100 -3.205 14.668 2.654 1.00 0.00 ATOM 774 O SER 100 -1.468 14.384 -0.374 1.00 0.00 ATOM 775 C SER 100 -1.088 14.495 0.791 1.00 0.00 ATOM 776 N ASP 101 -0.454 15.581 1.247 1.00 0.00 ATOM 777 CA ASP 101 -0.154 16.707 0.355 1.00 0.00 ATOM 778 CB ASP 101 0.486 17.855 1.138 1.00 0.00 ATOM 779 CG ASP 101 0.557 19.140 0.333 1.00 0.00 ATOM 780 OD1 ASP 101 -0.508 19.631 -0.095 1.00 0.00 ATOM 781 OD2 ASP 101 1.678 19.653 0.135 1.00 0.00 ATOM 782 O ASP 101 0.775 16.845 -1.850 1.00 0.00 ATOM 783 C ASP 101 0.815 16.291 -0.755 1.00 0.00 ATOM 784 N TRP 102 1.709 15.342 -0.428 1.00 0.00 ATOM 785 CA TRP 102 2.735 14.972 -1.381 1.00 0.00 ATOM 786 CB TRP 102 4.119 14.786 -0.304 1.00 0.00 ATOM 787 CG TRP 102 4.225 15.610 0.927 1.00 0.00 ATOM 788 CD1 TRP 102 3.941 15.205 2.195 1.00 0.00 ATOM 789 CD2 TRP 102 4.640 16.984 1.027 1.00 0.00 ATOM 790 CE2 TRP 102 4.580 17.340 2.389 1.00 0.00 ATOM 791 CE3 TRP 102 5.059 17.951 0.095 1.00 0.00 ATOM 792 NE1 TRP 102 4.151 16.233 3.072 1.00 0.00 ATOM 793 CZ2 TRP 102 4.921 18.618 2.854 1.00 0.00 ATOM 794 CZ3 TRP 102 5.398 19.225 0.557 1.00 0.00 ATOM 795 CH2 TRP 102 5.325 19.545 1.928 1.00 0.00 ATOM 796 O TRP 102 3.179 13.394 -3.149 1.00 0.00 ATOM 797 C TRP 102 2.456 13.705 -2.206 1.00 0.00 ATOM 798 N ALA 103 1.438 12.966 -1.802 1.00 0.00 ATOM 799 CA ALA 103 1.069 11.745 -2.484 1.00 0.00 ATOM 800 CB ALA 103 0.029 10.981 -1.681 1.00 0.00 ATOM 801 O ALA 103 0.824 11.354 -4.829 1.00 0.00 ATOM 802 C ALA 103 0.483 12.035 -3.866 1.00 0.00 ATOM 803 N ASN 104 -0.387 13.032 -3.990 1.00 0.00 ATOM 804 CA ASN 104 -0.905 13.403 -5.308 1.00 0.00 ATOM 805 CB ASN 104 -1.913 14.547 -5.188 1.00 0.00 ATOM 806 CG ASN 104 -3.239 14.097 -4.611 1.00 0.00 ATOM 807 ND2 ASN 104 -3.298 12.848 -4.166 1.00 0.00 ATOM 808 OD1 ASN 104 -4.200 14.866 -4.566 1.00 0.00 ATOM 809 O ASN 104 0.269 13.505 -7.394 1.00 0.00 ATOM 810 C ASN 104 0.241 13.854 -6.220 1.00 0.00 ATOM 811 N GLN 105 1.163 14.655 -5.701 1.00 0.00 ATOM 812 CA GLN 105 2.266 15.148 -6.502 1.00 0.00 ATOM 813 CB GLN 105 3.106 16.146 -5.702 1.00 0.00 ATOM 814 CG GLN 105 2.396 17.457 -5.405 1.00 0.00 ATOM 815 CD GLN 105 3.231 18.392 -4.552 1.00 0.00 ATOM 816 OE1 GLN 105 4.348 18.056 -4.157 1.00 0.00 ATOM 817 NE2 GLN 105 2.693 19.571 -4.270 1.00 0.00 ATOM 818 O GLN 105 3.614 13.955 -8.094 1.00 0.00 ATOM 819 C GLN 105 3.172 13.999 -6.938 1.00 0.00 ATOM 820 N PHE 106 3.426 13.045 -6.062 1.00 0.00 ATOM 821 CA PHE 106 4.245 11.884 -6.400 1.00 0.00 ATOM 822 CB PHE 106 4.360 10.943 -5.199 1.00 0.00 ATOM 823 CG PHE 106 5.281 11.443 -4.123 1.00 0.00 ATOM 824 CD1 PHE 106 4.780 12.093 -3.010 1.00 0.00 ATOM 825 CD2 PHE 106 6.649 11.261 -4.226 1.00 0.00 ATOM 826 CE1 PHE 106 5.628 12.553 -2.020 1.00 0.00 ATOM 827 CE2 PHE 106 7.497 11.721 -3.236 1.00 0.00 ATOM 828 CZ PHE 106 6.993 12.364 -2.138 1.00 0.00 ATOM 829 O PHE 106 4.297 10.768 -8.536 1.00 0.00 ATOM 830 C PHE 106 3.620 11.109 -7.565 1.00 0.00 ATOM 831 N LEU 107 2.315 10.898 -7.477 1.00 0.00 ATOM 832 CA LEU 107 1.599 10.177 -8.521 1.00 0.00 ATOM 833 CB LEU 107 0.108 10.088 -8.184 1.00 0.00 ATOM 834 CG LEU 107 -0.769 9.333 -9.185 1.00 0.00 ATOM 835 CD1 LEU 107 -0.354 7.873 -9.269 1.00 0.00 ATOM 836 CD2 LEU 107 -2.232 9.390 -8.768 1.00 0.00 ATOM 837 O LEU 107 2.091 10.283 -10.894 1.00 0.00 ATOM 838 C LEU 107 1.744 10.883 -9.870 1.00 0.00 ATOM 839 N LEU 108 1.457 12.198 -9.895 1.00 0.00 ATOM 840 CA LEU 108 1.496 12.948 -11.151 1.00 0.00 ATOM 841 CB LEU 108 0.968 14.369 -10.942 1.00 0.00 ATOM 842 CG LEU 108 -0.532 14.503 -10.674 1.00 0.00 ATOM 843 CD1 LEU 108 -0.897 15.945 -10.363 1.00 0.00 ATOM 844 CD2 LEU 108 -1.336 14.061 -11.889 1.00 0.00 ATOM 845 O LEU 108 3.210 12.875 -12.852 1.00 0.00 ATOM 846 C LEU 108 2.936 13.019 -11.647 1.00 0.00 ATOM 847 N GLY 109 3.877 13.147 -10.730 1.00 0.00 ATOM 848 CA GLY 109 5.298 13.160 -11.188 1.00 0.00 ATOM 849 O GLY 109 5.305 10.949 -10.224 1.00 0.00 ATOM 850 C GLY 109 5.895 11.767 -10.948 1.00 0.00 ATOM 851 N ILE 110 7.138 11.593 -11.449 1.00 0.00 ATOM 852 CA ILE 110 7.895 10.376 -11.119 1.00 0.00 ATOM 853 CB ILE 110 7.792 9.425 -12.390 1.00 0.00 ATOM 854 CG1 ILE 110 6.344 9.052 -12.668 1.00 0.00 ATOM 855 CG2 ILE 110 8.632 8.163 -12.186 1.00 0.00 ATOM 856 CD1 ILE 110 6.163 8.335 -14.018 1.00 0.00 ATOM 857 O ILE 110 9.860 9.807 -9.766 1.00 0.00 ATOM 858 C ILE 110 9.087 10.682 -10.211 1.00 0.00 ATOM 859 N GLY 111 9.243 11.953 -9.831 1.00 0.00 ATOM 860 CA GLY 111 10.256 12.383 -8.883 1.00 0.00 ATOM 861 O GLY 111 9.112 14.481 -9.009 1.00 0.00 ATOM 862 C GLY 111 9.952 13.817 -8.405 1.00 0.00 ATOM 863 N LEU 112 10.657 14.210 -7.382 1.00 0.00 ATOM 864 CA LEU 112 10.572 15.563 -6.813 1.00 0.00 ATOM 865 CB LEU 112 9.267 15.677 -6.031 1.00 0.00 ATOM 866 CG LEU 112 7.997 15.604 -6.883 1.00 0.00 ATOM 867 CD1 LEU 112 6.730 15.447 -6.001 1.00 0.00 ATOM 868 CD2 LEU 112 7.848 16.813 -7.795 1.00 0.00 ATOM 869 O LEU 112 12.295 14.956 -5.200 1.00 0.00 ATOM 870 C LEU 112 11.829 15.787 -5.992 1.00 0.00 ATOM 871 N ALA 113 12.326 17.022 -6.058 1.00 0.00 ATOM 872 CA ALA 113 13.497 17.429 -5.293 1.00 0.00 ATOM 873 CB ALA 113 13.947 18.823 -5.732 1.00 0.00 ATOM 874 O ALA 113 13.984 16.904 -3.003 1.00 0.00 ATOM 875 C ALA 113 13.197 17.417 -3.797 1.00 0.00 ATOM 876 N GLN 114 12.060 17.988 -3.422 1.00 0.00 ATOM 877 CA GLN 114 11.655 18.034 -2.025 1.00 0.00 ATOM 878 CB GLN 114 9.973 18.375 -2.152 1.00 0.00 ATOM 879 CG GLN 114 9.452 19.260 -3.270 1.00 0.00 ATOM 880 CD GLN 114 9.639 20.715 -2.959 1.00 0.00 ATOM 881 OE1 GLN 114 8.792 21.334 -2.305 1.00 0.00 ATOM 882 NE2 GLN 114 10.740 21.288 -3.426 1.00 0.00 ATOM 883 O GLN 114 12.017 16.313 -0.388 1.00 0.00 ATOM 884 C GLN 114 11.510 16.618 -1.469 1.00 0.00 ATOM 885 N PRO 115 10.841 15.748 -2.195 1.00 0.00 ATOM 886 CA PRO 115 10.607 14.347 -1.783 1.00 0.00 ATOM 887 CB PRO 115 9.879 13.761 -2.981 1.00 0.00 ATOM 888 CG PRO 115 9.104 14.952 -3.520 1.00 0.00 ATOM 889 CD PRO 115 10.159 16.029 -3.485 1.00 0.00 ATOM 890 O PRO 115 11.913 12.660 -0.739 1.00 0.00 ATOM 891 C PRO 115 11.929 13.594 -1.553 1.00 0.00 ATOM 892 N GLU 116 13.017 14.005 -2.201 1.00 0.00 ATOM 893 CA GLU 116 14.304 13.328 -1.941 1.00 0.00 ATOM 894 CB GLU 116 15.255 13.560 -3.116 1.00 0.00 ATOM 895 CG GLU 116 14.742 12.899 -4.402 1.00 0.00 ATOM 896 CD GLU 116 14.516 11.404 -4.272 1.00 0.00 ATOM 897 OE1 GLU 116 15.458 10.645 -3.942 1.00 0.00 ATOM 898 OE2 GLU 116 13.353 10.961 -4.442 1.00 0.00 ATOM 899 O GLU 116 15.640 12.734 -0.078 1.00 0.00 ATOM 900 C GLU 116 14.958 13.638 -0.612 1.00 0.00 ATOM 901 N LEU 117 14.856 14.842 -0.091 1.00 0.00 ATOM 902 CA LEU 117 15.484 15.181 1.182 1.00 0.00 ATOM 903 CB LEU 117 14.512 16.338 1.868 1.00 0.00 ATOM 904 CG LEU 117 13.827 17.388 0.989 1.00 0.00 ATOM 905 CD1 LEU 117 12.795 18.150 1.805 1.00 0.00 ATOM 906 CD2 LEU 117 14.868 18.345 0.425 1.00 0.00 ATOM 907 O LEU 117 15.910 13.727 3.103 1.00 0.00 ATOM 908 C LEU 117 15.098 14.199 2.300 1.00 0.00 ATOM 909 N ALA 118 13.810 13.917 2.389 1.00 0.00 ATOM 910 CA ALA 118 13.309 13.054 3.438 1.00 0.00 ATOM 911 CB ALA 118 11.787 13.095 3.420 1.00 0.00 ATOM 912 O ALA 118 14.179 11.020 4.286 1.00 0.00 ATOM 913 C ALA 118 13.821 11.624 3.277 1.00 0.00 ATOM 914 N LYS 119 13.917 11.052 2.065 1.00 0.00 ATOM 915 CA LYS 119 14.531 9.753 1.910 1.00 0.00 ATOM 916 CB LYS 119 14.553 9.176 0.498 1.00 0.00 ATOM 917 CG LYS 119 13.214 8.495 0.185 1.00 0.00 ATOM 918 CD LYS 119 12.975 8.361 -1.297 1.00 0.00 ATOM 919 CE LYS 119 13.818 7.271 -1.922 1.00 0.00 ATOM 920 NZ LYS 119 12.966 6.605 -2.968 1.00 0.00 ATOM 921 O LYS 119 16.596 8.970 2.864 1.00 0.00 ATOM 922 C LYS 119 16.018 9.824 2.197 1.00 0.00 ATOM 923 N GLU 120 16.736 10.833 1.740 1.00 0.00 ATOM 924 CA GLU 120 18.156 10.908 2.031 1.00 0.00 ATOM 925 CB GLU 120 18.815 11.981 1.172 1.00 0.00 ATOM 926 CG GLU 120 18.888 11.592 -0.288 1.00 0.00 ATOM 927 CD GLU 120 19.598 10.247 -0.489 1.00 0.00 ATOM 928 OE1 GLU 120 20.488 9.899 0.321 1.00 0.00 ATOM 929 OE2 GLU 120 19.270 9.530 -1.460 1.00 0.00 ATOM 930 O GLU 120 19.474 10.911 4.016 1.00 0.00 ATOM 931 C GLU 120 18.396 11.187 3.519 1.00 0.00 ATOM 932 N LYS 121 17.434 11.751 4.232 1.00 0.00 ATOM 933 CA LYS 121 17.529 12.043 5.653 1.00 0.00 ATOM 934 CB LYS 121 16.595 13.190 6.028 1.00 0.00 ATOM 935 CG LYS 121 16.868 14.598 5.706 1.00 0.00 ATOM 936 CD LYS 121 17.909 14.994 4.750 1.00 0.00 ATOM 937 CE LYS 121 17.869 16.433 4.276 1.00 0.00 ATOM 938 NZ LYS 121 18.177 16.392 2.801 1.00 0.00 ATOM 939 O LYS 121 17.161 11.086 7.816 1.00 0.00 ATOM 940 C LYS 121 17.174 10.896 6.579 1.00 0.00 ATOM 941 N GLY 122 16.848 9.731 6.023 1.00 0.00 ATOM 942 CA GLY 122 16.490 8.594 6.845 1.00 0.00 ATOM 943 O GLY 122 14.669 7.526 7.922 1.00 0.00 ATOM 944 C GLY 122 15.033 8.219 6.971 1.00 0.00 ATOM 945 N GLU 123 14.169 8.700 6.087 1.00 0.00 ATOM 946 CA GLU 123 12.763 8.353 6.137 1.00 0.00 ATOM 947 CB GLU 123 12.021 9.115 5.028 1.00 0.00 ATOM 948 CG GLU 123 10.531 8.815 4.954 1.00 0.00 ATOM 949 CD GLU 123 9.890 9.520 3.764 1.00 0.00 ATOM 950 OE1 GLU 123 10.609 9.927 2.824 1.00 0.00 ATOM 951 OE2 GLU 123 8.672 9.661 3.788 1.00 0.00 ATOM 952 O GLU 123 11.764 6.251 6.734 1.00 0.00 ATOM 953 C GLU 123 12.520 6.865 5.976 1.00 0.00 ATOM 954 N ILE 124 13.146 6.279 4.957 1.00 0.00 ATOM 955 CA ILE 124 12.984 4.840 4.719 1.00 0.00 ATOM 956 CB ILE 124 13.536 4.493 3.317 1.00 0.00 ATOM 957 CG1 ILE 124 12.623 5.121 2.257 1.00 0.00 ATOM 958 CG2 ILE 124 13.639 2.987 3.150 1.00 0.00 ATOM 959 CD1 ILE 124 13.005 4.847 0.805 1.00 0.00 ATOM 960 O ILE 124 13.059 3.069 6.376 1.00 0.00 ATOM 961 C ILE 124 13.629 4.027 5.837 1.00 0.00 ATOM 962 N GLY 125 14.873 4.383 6.187 1.00 0.00 ATOM 963 CA GLY 125 15.552 3.662 7.267 1.00 0.00 ATOM 964 O GLY 125 14.713 2.915 9.377 1.00 0.00 ATOM 965 C GLY 125 14.787 3.855 8.575 1.00 0.00 ATOM 966 N GLU 126 14.218 5.029 8.819 1.00 0.00 ATOM 967 CA GLU 126 13.420 5.228 10.036 1.00 0.00 ATOM 968 CB GLU 126 12.973 6.674 10.221 1.00 0.00 ATOM 969 CG GLU 126 14.189 7.570 10.459 1.00 0.00 ATOM 970 CD GLU 126 14.081 9.039 10.142 1.00 0.00 ATOM 971 OE1 GLU 126 14.611 9.848 10.946 1.00 0.00 ATOM 972 OE2 GLU 126 13.501 9.456 9.110 1.00 0.00 ATOM 973 O GLU 126 11.778 3.842 11.119 1.00 0.00 ATOM 974 C GLU 126 12.195 4.296 10.041 1.00 0.00 ATOM 975 N ALA 127 11.648 4.033 8.877 1.00 0.00 ATOM 976 CA ALA 127 10.468 3.163 8.765 1.00 0.00 ATOM 977 CB ALA 127 9.800 3.348 7.424 1.00 0.00 ATOM 978 O ALA 127 10.170 1.014 9.712 1.00 0.00 ATOM 979 C ALA 127 10.879 1.708 8.997 1.00 0.00 ATOM 980 N VAL 128 12.022 1.262 8.490 1.00 0.00 ATOM 981 CA VAL 128 12.488 -0.095 8.756 1.00 0.00 ATOM 982 CB VAL 128 13.710 -0.437 7.867 1.00 0.00 ATOM 983 CG1 VAL 128 14.370 -1.710 8.330 1.00 0.00 ATOM 984 CG2 VAL 128 13.237 -0.554 6.430 1.00 0.00 ATOM 985 O VAL 128 12.378 -1.235 10.861 1.00 0.00 ATOM 986 C VAL 128 12.795 -0.263 10.224 1.00 0.00 ATOM 987 N ASP 129 13.575 0.675 10.791 1.00 0.00 ATOM 988 CA ASP 129 13.860 0.580 12.223 1.00 0.00 ATOM 989 CB ASP 129 14.682 1.798 12.639 1.00 0.00 ATOM 990 CG ASP 129 16.075 1.868 12.099 1.00 0.00 ATOM 991 OD1 ASP 129 16.611 0.832 11.652 1.00 0.00 ATOM 992 OD2 ASP 129 16.680 2.964 12.111 1.00 0.00 ATOM 993 O ASP 129 12.520 -0.214 14.092 1.00 0.00 ATOM 994 C ASP 129 12.619 0.511 13.106 1.00 0.00 ATOM 995 N ASP 130 11.642 1.336 12.781 1.00 0.00 ATOM 996 CA ASP 130 10.433 1.388 13.626 1.00 0.00 ATOM 997 CB ASP 130 9.565 2.571 13.211 1.00 0.00 ATOM 998 CG ASP 130 10.067 3.927 13.653 1.00 0.00 ATOM 999 OD1 ASP 130 11.018 3.988 14.461 1.00 0.00 ATOM 1000 OD2 ASP 130 9.501 4.972 13.214 1.00 0.00 ATOM 1001 O ASP 130 9.161 -0.411 14.572 1.00 0.00 ATOM 1002 C ASP 130 9.665 0.082 13.567 1.00 0.00 ATOM 1003 N LEU 131 9.527 -0.487 12.367 1.00 0.00 ATOM 1004 CA LEU 131 8.839 -1.763 12.251 1.00 0.00 ATOM 1005 CB LEU 131 8.674 -2.177 10.784 1.00 0.00 ATOM 1006 CG LEU 131 7.863 -3.470 10.600 1.00 0.00 ATOM 1007 CD1 LEU 131 6.471 -3.309 11.215 1.00 0.00 ATOM 1008 CD2 LEU 131 7.755 -3.812 9.118 1.00 0.00 ATOM 1009 O LEU 131 8.943 -3.612 13.771 1.00 0.00 ATOM 1010 C LEU 131 9.569 -2.863 13.018 1.00 0.00 ATOM 1011 N GLN 132 10.878 -2.982 12.850 1.00 0.00 ATOM 1012 CA GLN 132 11.631 -4.008 13.554 1.00 0.00 ATOM 1013 CB GLN 132 13.017 -4.183 12.943 1.00 0.00 ATOM 1014 CG GLN 132 12.929 -4.763 11.521 1.00 0.00 ATOM 1015 CD GLN 132 14.247 -4.742 10.785 1.00 0.00 ATOM 1016 OE1 GLN 132 15.148 -3.911 10.943 1.00 0.00 ATOM 1017 NE2 GLN 132 14.455 -5.708 9.863 1.00 0.00 ATOM 1018 O GLN 132 11.640 -4.542 15.880 1.00 0.00 ATOM 1019 C GLN 132 11.704 -3.652 15.044 1.00 0.00 ATOM 1020 N ASP 133 11.778 -2.008 15.623 1.00 0.00 ATOM 1021 CA ASP 133 11.495 -1.559 16.975 1.00 0.00 ATOM 1022 CB ASP 133 11.503 -0.030 17.045 1.00 0.00 ATOM 1023 CG ASP 133 12.895 0.553 16.914 1.00 0.00 ATOM 1024 OD1 ASP 133 13.056 1.770 17.142 1.00 0.00 ATOM 1025 OD2 ASP 133 13.829 -0.208 16.585 1.00 0.00 ATOM 1026 O ASP 133 9.948 -2.568 18.514 1.00 0.00 ATOM 1027 C ASP 133 10.119 -2.074 17.398 1.00 0.00 ATOM 1028 N ILE 134 9.141 -1.984 16.504 1.00 0.00 ATOM 1029 CA ILE 134 7.781 -2.447 16.756 1.00 0.00 ATOM 1030 CB ILE 134 6.908 -2.183 15.503 1.00 0.00 ATOM 1031 CG1 ILE 134 6.606 -0.690 15.378 1.00 0.00 ATOM 1032 CG2 ILE 134 5.628 -3.026 15.523 1.00 0.00 ATOM 1033 CD1 ILE 134 6.059 -0.295 14.032 1.00 0.00 ATOM 1034 O ILE 134 7.146 -4.435 17.935 1.00 0.00 ATOM 1035 C ILE 134 7.827 -3.942 17.048 1.00 0.00 ATOM 1036 N CYS 135 8.640 -4.664 16.293 1.00 0.00 ATOM 1037 CA CYS 135 8.789 -6.105 16.477 1.00 0.00 ATOM 1038 CB CYS 135 9.650 -6.708 15.343 1.00 0.00 ATOM 1039 SG CYS 135 8.917 -6.633 13.681 1.00 0.00 ATOM 1040 O CYS 135 8.899 -7.397 18.513 1.00 0.00 ATOM 1041 C CYS 135 9.379 -6.462 17.853 1.00 0.00 ATOM 1042 N GLN 136 10.886 -5.506 17.970 1.00 0.00 ATOM 1043 CA GLN 136 11.226 -5.346 19.387 1.00 0.00 ATOM 1044 CB GLN 136 12.016 -4.054 19.606 1.00 0.00 ATOM 1045 CG GLN 136 12.480 -3.844 21.040 1.00 0.00 ATOM 1046 CD GLN 136 13.312 -2.590 21.206 1.00 0.00 ATOM 1047 OE1 GLN 136 13.540 -1.853 20.245 1.00 0.00 ATOM 1048 NE2 GLN 136 13.771 -2.342 22.425 1.00 0.00 ATOM 1049 O GLN 136 9.899 -5.901 21.300 1.00 0.00 ATOM 1050 C GLN 136 9.965 -5.288 20.232 1.00 0.00 ATOM 1051 N LEU 137 8.974 -4.532 19.756 1.00 0.00 ATOM 1052 CA LEU 137 7.713 -4.357 20.468 1.00 0.00 ATOM 1053 CB LEU 137 6.877 -3.263 19.714 1.00 0.00 ATOM 1054 CG LEU 137 5.506 -3.000 20.423 1.00 0.00 ATOM 1055 CD1 LEU 137 5.741 -2.470 21.855 1.00 0.00 ATOM 1056 CD2 LEU 137 4.676 -1.950 19.686 1.00 0.00 ATOM 1057 O LEU 137 6.354 -5.855 21.716 1.00 0.00 ATOM 1058 C LEU 137 6.899 -5.614 20.643 1.00 0.00 ATOM 1059 N GLY 138 6.782 -6.415 19.616 1.00 0.00 ATOM 1060 CA GLY 138 6.002 -7.640 19.696 1.00 0.00 ATOM 1061 O GLY 138 3.818 -7.848 20.622 1.00 0.00 ATOM 1062 C GLY 138 4.544 -7.229 19.860 1.00 0.00 ATOM 1063 N TYR 139 4.148 -6.145 19.152 1.00 0.00 ATOM 1064 CA TYR 139 2.776 -5.647 19.316 1.00 0.00 ATOM 1065 CB TYR 139 2.541 -4.348 18.473 1.00 0.00 ATOM 1066 CG TYR 139 2.998 -4.547 17.021 1.00 0.00 ATOM 1067 CD1 TYR 139 2.149 -5.063 16.066 1.00 0.00 ATOM 1068 CD2 TYR 139 4.296 -4.213 16.608 1.00 0.00 ATOM 1069 CE1 TYR 139 2.608 -5.226 14.777 1.00 0.00 ATOM 1070 CE2 TYR 139 4.726 -4.440 15.304 1.00 0.00 ATOM 1071 CZ TYR 139 3.867 -4.943 14.365 1.00 0.00 ATOM 1072 OH TYR 139 4.253 -5.195 13.078 1.00 0.00 ATOM 1073 O TYR 139 2.237 -7.582 18.105 1.00 0.00 ATOM 1074 C TYR 139 1.768 -6.598 18.678 1.00 0.00 ATOM 1075 N ASP 140 0.610 -6.742 19.317 1.00 0.00 ATOM 1076 CA ASP 140 -0.439 -7.633 18.819 1.00 0.00 ATOM 1077 CB ASP 140 -1.566 -7.756 19.845 1.00 0.00 ATOM 1078 CG ASP 140 -1.156 -8.543 21.072 1.00 0.00 ATOM 1079 OD1 ASP 140 -2.024 -8.806 21.931 1.00 0.00 ATOM 1080 OD2 ASP 140 0.037 -8.898 21.178 1.00 0.00 ATOM 1081 O ASP 140 -0.798 -5.930 17.249 1.00 0.00 ATOM 1082 C ASP 140 -1.038 -7.105 17.515 1.00 0.00 ATOM 1083 N GLU 141 -1.104 -7.977 16.509 1.00 0.00 ATOM 1084 CA GLU 141 -1.712 -7.612 15.231 1.00 0.00 ATOM 1085 CB GLU 141 -1.666 -8.792 14.260 1.00 0.00 ATOM 1086 CG GLU 141 -0.271 -9.133 13.762 1.00 0.00 ATOM 1087 CD GLU 141 -0.258 -10.341 12.845 1.00 0.00 ATOM 1088 OE1 GLU 141 -1.334 -10.942 12.639 1.00 0.00 ATOM 1089 OE2 GLU 141 0.828 -10.685 12.333 1.00 0.00 ATOM 1090 O GLU 141 -3.684 -6.219 14.848 1.00 0.00 ATOM 1091 C GLU 141 -3.159 -7.201 15.357 1.00 0.00 ATOM 1092 N ASP 142 -3.886 -8.004 16.137 1.00 0.00 ATOM 1093 CA ASP 142 -5.295 -7.794 16.375 1.00 0.00 ATOM 1094 CB ASP 142 -5.911 -8.970 17.143 1.00 0.00 ATOM 1095 CG ASP 142 -6.049 -10.216 16.312 1.00 0.00 ATOM 1096 OD1 ASP 142 -6.117 -10.183 15.069 1.00 0.00 ATOM 1097 OD2 ASP 142 -6.072 -11.311 16.925 1.00 0.00 ATOM 1098 O ASP 142 -6.413 -5.698 16.892 1.00 0.00 ATOM 1099 C ASP 142 -5.487 -6.498 17.198 1.00 0.00 ATOM 1100 N ASP 143 -4.696 -6.197 18.206 1.00 0.00 ATOM 1101 CA ASP 143 -4.785 -5.008 19.002 1.00 0.00 ATOM 1102 CB ASP 143 -3.921 -5.139 20.256 1.00 0.00 ATOM 1103 CG ASP 143 -4.497 -6.116 21.262 1.00 0.00 ATOM 1104 OD1 ASP 143 -3.955 -6.205 22.383 1.00 0.00 ATOM 1105 OD2 ASP 143 -5.491 -6.794 20.928 1.00 0.00 ATOM 1106 O ASP 143 -4.585 -2.681 18.664 1.00 0.00 ATOM 1107 C ASP 143 -4.308 -3.773 18.238 1.00 0.00 ATOM 1108 N ASN 144 -3.148 -3.904 17.474 1.00 0.00 ATOM 1109 CA ASN 144 -2.738 -2.696 16.773 1.00 0.00 ATOM 1110 CB ASN 144 -1.661 -1.952 17.570 1.00 0.00 ATOM 1111 CG ASN 144 -1.284 -0.626 16.941 1.00 0.00 ATOM 1112 ND2 ASN 144 -1.676 0.466 17.590 1.00 0.00 ATOM 1113 OD1 ASN 144 -0.651 -0.585 15.887 1.00 0.00 ATOM 1114 O ASN 144 -1.019 -3.462 15.285 1.00 0.00 ATOM 1115 C ASN 144 -2.172 -3.049 15.402 1.00 0.00 ATOM 1116 N GLU 145 -3.005 -2.886 14.371 1.00 0.00 ATOM 1117 CA GLU 145 -2.588 -3.197 12.989 1.00 0.00 ATOM 1118 CB GLU 145 -4.228 -3.732 12.488 1.00 0.00 ATOM 1119 CG GLU 145 -5.164 -4.358 13.514 1.00 0.00 ATOM 1120 CD GLU 145 -5.661 -3.414 14.572 1.00 0.00 ATOM 1121 OE1 GLU 145 -5.711 -2.218 14.367 1.00 0.00 ATOM 1122 OE2 GLU 145 -5.966 -3.836 15.664 1.00 0.00 ATOM 1123 O GLU 145 -1.315 -2.150 11.300 1.00 0.00 ATOM 1124 C GLU 145 -1.978 -1.970 12.317 1.00 0.00 ATOM 1125 N GLU 146 -0.464 0.440 14.145 1.00 0.00 ATOM 1126 CA GLU 146 -1.238 1.289 13.260 1.00 0.00 ATOM 1127 CB GLU 146 -2.608 1.602 13.852 1.00 0.00 ATOM 1128 CG GLU 146 -3.421 0.335 14.030 1.00 0.00 ATOM 1129 CD GLU 146 -4.330 0.405 15.181 1.00 0.00 ATOM 1130 OE1 GLU 146 -4.467 1.477 15.789 1.00 0.00 ATOM 1131 OE2 GLU 146 -4.905 -0.643 15.485 1.00 0.00 ATOM 1132 O GLU 146 -0.406 2.944 11.722 1.00 0.00 ATOM 1133 C GLU 146 -0.476 2.575 12.888 1.00 0.00 ATOM 1134 N GLU 147 0.124 3.231 13.871 1.00 0.00 ATOM 1135 CA GLU 147 0.859 4.467 13.606 1.00 0.00 ATOM 1136 CB GLU 147 1.180 5.191 14.914 1.00 0.00 ATOM 1137 CG GLU 147 1.875 6.530 14.729 1.00 0.00 ATOM 1138 CD GLU 147 2.133 7.242 16.044 1.00 0.00 ATOM 1139 OE1 GLU 147 1.769 6.684 17.099 1.00 0.00 ATOM 1140 OE2 GLU 147 2.698 8.353 16.017 1.00 0.00 ATOM 1141 O GLU 147 2.566 4.849 11.943 1.00 0.00 ATOM 1142 C GLU 147 2.176 4.149 12.881 1.00 0.00 ATOM 1143 N LEU 148 2.839 3.087 13.334 1.00 0.00 ATOM 1144 CA LEU 148 4.126 2.680 12.765 1.00 0.00 ATOM 1145 CB LEU 148 4.838 1.909 13.953 1.00 0.00 ATOM 1146 CG LEU 148 5.204 2.717 15.207 1.00 0.00 ATOM 1147 CD1 LEU 148 5.668 1.811 16.323 1.00 0.00 ATOM 1148 CD2 LEU 148 6.276 3.754 14.885 1.00 0.00 ATOM 1149 O LEU 148 5.005 1.999 10.700 1.00 0.00 ATOM 1150 C LEU 148 3.962 2.189 11.328 1.00 0.00 ATOM 1151 N ALA 149 2.943 1.375 11.099 1.00 0.00 ATOM 1152 CA ALA 149 2.662 0.846 9.760 1.00 0.00 ATOM 1153 CB ALA 149 1.509 -0.144 9.813 1.00 0.00 ATOM 1154 O ALA 149 1.925 1.616 7.673 1.00 0.00 ATOM 1155 C ALA 149 2.284 1.968 8.797 1.00 0.00 ATOM 1156 N GLU 150 1.690 3.029 9.333 1.00 0.00 ATOM 1157 CA GLU 150 1.300 4.187 8.522 1.00 0.00 ATOM 1158 CB GLU 150 0.651 5.259 9.399 1.00 0.00 ATOM 1159 CG GLU 150 0.177 6.484 8.632 1.00 0.00 ATOM 1160 CD GLU 150 -0.995 6.181 7.718 1.00 0.00 ATOM 1161 OE1 GLU 150 -1.564 5.075 7.831 1.00 0.00 ATOM 1162 OE2 GLU 150 -1.342 7.050 6.891 1.00 0.00 ATOM 1163 O GLU 150 2.271 5.692 7.012 1.00 0.00 ATOM 1164 C GLU 150 2.512 4.810 7.830 1.00 0.00 ATOM 1165 N ALA 151 3.614 4.967 8.649 1.00 0.00 ATOM 1166 CA ALA 151 4.919 5.371 8.126 1.00 0.00 ATOM 1167 CB ALA 151 5.882 5.655 9.270 1.00 0.00 ATOM 1168 O ALA 151 6.089 4.577 6.196 1.00 0.00 ATOM 1169 C ALA 151 5.530 4.280 7.255 1.00 0.00 ATOM 1170 N LEU 152 5.428 3.022 7.685 1.00 0.00 ATOM 1171 CA LEU 152 5.950 1.922 6.871 1.00 0.00 ATOM 1172 CB LEU 152 5.756 0.572 7.585 1.00 0.00 ATOM 1173 CG LEU 152 6.367 -0.659 6.909 1.00 0.00 ATOM 1174 CD1 LEU 152 7.861 -0.456 6.699 1.00 0.00 ATOM 1175 CD2 LEU 152 6.098 -1.877 7.779 1.00 0.00 ATOM 1176 O LEU 152 5.880 1.718 4.478 1.00 0.00 ATOM 1177 C LEU 152 5.235 1.861 5.521 1.00 0.00 ATOM 1178 N GLU 153 3.891 1.961 5.550 1.00 0.00 ATOM 1179 CA GLU 153 3.142 1.872 4.303 1.00 0.00 ATOM 1180 CB GLU 153 1.629 1.942 4.580 1.00 0.00 ATOM 1181 CG GLU 153 0.953 0.712 5.145 1.00 0.00 ATOM 1182 CD GLU 153 -0.499 0.945 5.535 1.00 0.00 ATOM 1183 OE1 GLU 153 -1.149 1.822 4.892 1.00 0.00 ATOM 1184 OE2 GLU 153 -0.842 0.503 6.665 1.00 0.00 ATOM 1185 O GLU 153 3.603 2.832 2.151 1.00 0.00 ATOM 1186 C GLU 153 3.502 2.995 3.361 1.00 0.00 ATOM 1187 N GLU 154 3.694 4.173 3.957 1.00 0.00 ATOM 1188 CA GLU 154 3.842 5.317 3.051 1.00 0.00 ATOM 1189 CB GLU 154 3.365 6.605 3.737 1.00 0.00 ATOM 1190 CG GLU 154 1.833 6.709 3.861 1.00 0.00 ATOM 1191 CD GLU 154 1.527 8.048 4.569 1.00 0.00 ATOM 1192 OE1 GLU 154 1.804 8.127 5.759 1.00 0.00 ATOM 1193 OE2 GLU 154 1.209 9.079 3.879 1.00 0.00 ATOM 1194 O GLU 154 5.572 5.855 1.414 1.00 0.00 ATOM 1195 C GLU 154 5.249 5.356 2.490 1.00 0.00 ATOM 1196 N ILE 155 6.172 4.781 3.230 1.00 0.00 ATOM 1197 CA ILE 155 7.530 4.675 2.713 1.00 0.00 ATOM 1198 CB ILE 155 8.517 4.160 3.825 1.00 0.00 ATOM 1199 CG1 ILE 155 8.641 5.175 4.967 1.00 0.00 ATOM 1200 CG2 ILE 155 9.884 3.914 3.225 1.00 0.00 ATOM 1201 CD1 ILE 155 9.738 4.839 5.997 1.00 0.00 ATOM 1202 O ILE 155 8.132 4.020 0.500 1.00 0.00 ATOM 1203 C ILE 155 7.526 3.716 1.530 1.00 0.00 ATOM 1204 N ILE 156 6.591 2.628 1.452 1.00 0.00 ATOM 1205 CA ILE 156 6.365 1.666 0.358 1.00 0.00 ATOM 1206 CB ILE 156 5.604 0.421 0.851 1.00 0.00 ATOM 1207 CG1 ILE 156 5.684 -0.698 -0.190 1.00 0.00 ATOM 1208 CG2 ILE 156 4.139 0.752 1.091 1.00 0.00 ATOM 1209 CD1 ILE 156 7.077 -1.256 -0.379 1.00 0.00 ATOM 1210 O ILE 156 5.892 2.165 -1.921 1.00 0.00 ATOM 1211 C ILE 156 5.557 2.313 -0.725 1.00 0.00 ATOM 1212 N GLU 157 4.531 3.089 -0.403 1.00 0.00 ATOM 1213 CA GLU 157 3.760 3.796 -1.414 1.00 0.00 ATOM 1214 CB GLU 157 2.649 4.621 -0.759 1.00 0.00 ATOM 1215 CG GLU 157 1.765 5.365 -1.746 1.00 0.00 ATOM 1216 CD GLU 157 0.646 6.130 -1.067 1.00 0.00 ATOM 1217 OE1 GLU 157 0.565 6.080 0.180 1.00 0.00 ATOM 1218 OE2 GLU 157 -0.148 6.779 -1.780 1.00 0.00 ATOM 1219 O GLU 157 4.570 4.740 -3.463 1.00 0.00 ATOM 1220 C GLU 157 4.617 4.754 -2.232 1.00 0.00 ATOM 1221 N TYR 158 5.426 5.552 -1.549 1.00 0.00 ATOM 1222 CA TYR 158 6.277 6.517 -2.240 1.00 0.00 ATOM 1223 CB TYR 158 6.955 7.451 -1.238 1.00 0.00 ATOM 1224 CG TYR 158 6.023 8.471 -0.624 1.00 0.00 ATOM 1225 CD1 TYR 158 4.776 8.724 -1.186 1.00 0.00 ATOM 1226 CD2 TYR 158 6.391 9.179 0.513 1.00 0.00 ATOM 1227 CE1 TYR 158 3.918 9.656 -0.632 1.00 0.00 ATOM 1228 CE2 TYR 158 5.545 10.113 1.080 1.00 0.00 ATOM 1229 CZ TYR 158 4.300 10.346 0.497 1.00 0.00 ATOM 1230 OH TYR 158 3.446 11.275 1.050 1.00 0.00 ATOM 1231 O TYR 158 7.691 6.202 -4.163 1.00 0.00 ATOM 1232 C TYR 158 7.364 5.799 -3.042 1.00 0.00 ATOM 1233 N VAL 159 7.922 4.739 -2.457 1.00 0.00 ATOM 1234 CA VAL 159 8.974 3.946 -3.095 1.00 0.00 ATOM 1235 CB VAL 159 9.458 2.809 -2.177 1.00 0.00 ATOM 1236 CG1 VAL 159 10.420 1.896 -2.922 1.00 0.00 ATOM 1237 CG2 VAL 159 10.176 3.374 -0.963 1.00 0.00 ATOM 1238 O VAL 159 9.101 3.513 -5.462 1.00 0.00 ATOM 1239 C VAL 159 8.511 3.292 -4.403 1.00 0.00 ATOM 1240 N ARG 160 7.468 2.485 -4.335 1.00 0.00 ATOM 1241 CA ARG 160 6.953 1.811 -5.521 1.00 0.00 ATOM 1242 CB ARG 160 5.719 0.978 -5.170 1.00 0.00 ATOM 1243 CG ARG 160 6.023 -0.266 -4.350 1.00 0.00 ATOM 1244 CD ARG 160 6.809 -1.284 -5.164 1.00 0.00 ATOM 1245 NE ARG 160 6.026 -1.814 -6.277 1.00 0.00 ATOM 1246 CZ ARG 160 6.533 -2.545 -7.265 1.00 0.00 ATOM 1247 NH1 ARG 160 5.744 -2.984 -8.237 1.00 0.00 ATOM 1248 NH2 ARG 160 7.826 -2.836 -7.278 1.00 0.00 ATOM 1249 O ARG 160 6.977 2.721 -7.742 1.00 0.00 ATOM 1250 C ARG 160 6.559 2.825 -6.584 1.00 0.00 ATOM 1251 N THR 161 5.804 3.840 -6.225 1.00 0.00 ATOM 1252 CA THR 161 5.353 4.874 -7.111 1.00 0.00 ATOM 1253 CB THR 161 4.177 5.665 -6.502 1.00 0.00 ATOM 1254 CG2 THR 161 3.007 4.737 -6.209 1.00 0.00 ATOM 1255 OG1 THR 161 4.596 6.285 -5.281 1.00 0.00 ATOM 1256 O THR 161 6.259 6.644 -8.415 1.00 0.00 ATOM 1257 C THR 161 6.427 5.887 -7.440 1.00 0.00 ATOM 1258 N ILE 162 7.523 5.859 -6.688 1.00 0.00 ATOM 1259 CA ILE 162 8.640 6.780 -6.927 1.00 0.00 ATOM 1260 CB ILE 162 9.288 7.236 -5.608 1.00 0.00 ATOM 1261 CG1 ILE 162 8.277 8.003 -4.755 1.00 0.00 ATOM 1262 CG2 ILE 162 10.475 8.145 -5.884 1.00 0.00 ATOM 1263 CD1 ILE 162 7.744 9.256 -5.417 1.00 0.00 ATOM 1264 O ILE 162 10.128 6.609 -8.785 1.00 0.00 ATOM 1265 C ILE 162 9.683 6.047 -7.776 1.00 0.00 ATOM 1266 N ALA 163 10.112 4.885 -7.299 1.00 0.00 ATOM 1267 CA ALA 163 11.036 4.090 -8.049 1.00 0.00 ATOM 1268 CB ALA 163 11.324 2.814 -7.299 1.00 0.00 ATOM 1269 O ALA 163 11.098 3.877 -10.430 1.00 0.00 ATOM 1270 C ALA 163 10.457 3.735 -9.389 1.00 0.00 ATOM 1271 N MET 164 9.237 3.240 -9.388 1.00 0.00 ATOM 1272 CA MET 164 8.670 2.892 -10.682 1.00 0.00 ATOM 1273 CB MET 164 7.323 2.220 -10.497 1.00 0.00 ATOM 1274 CG MET 164 6.713 1.730 -11.824 1.00 0.00 ATOM 1275 SD MET 164 7.681 0.535 -12.779 1.00 0.00 ATOM 1276 CE MET 164 7.373 -0.905 -11.773 1.00 0.00 ATOM 1277 O MET 164 8.819 4.067 -12.764 1.00 0.00 ATOM 1278 C MET 164 8.559 4.128 -11.579 1.00 0.00 ATOM 1279 N LEU 165 8.111 5.267 -11.063 1.00 0.00 ATOM 1280 CA LEU 165 7.930 6.436 -11.917 1.00 0.00 ATOM 1281 CB LEU 165 7.378 7.604 -11.075 1.00 0.00 ATOM 1282 CG LEU 165 5.903 7.396 -10.656 1.00 0.00 ATOM 1283 CD1 LEU 165 5.420 8.608 -9.837 1.00 0.00 ATOM 1284 CD2 LEU 165 4.966 7.208 -11.891 1.00 0.00 ATOM 1285 O LEU 165 9.385 7.136 -13.715 1.00 0.00 ATOM 1286 C LEU 165 9.264 6.924 -12.506 1.00 0.00 ATOM 1287 N PHE 166 10.314 6.939 -11.708 1.00 0.00 ATOM 1288 CA PHE 166 11.615 7.371 -12.207 1.00 0.00 ATOM 1289 CB PHE 166 12.632 7.295 -11.029 1.00 0.00 ATOM 1290 CG PHE 166 14.035 7.586 -11.507 1.00 0.00 ATOM 1291 CD1 PHE 166 14.504 8.876 -11.436 1.00 0.00 ATOM 1292 CD2 PHE 166 14.799 6.593 -12.063 1.00 0.00 ATOM 1293 CE1 PHE 166 15.798 9.187 -11.896 1.00 0.00 ATOM 1294 CE2 PHE 166 16.110 6.859 -12.521 1.00 0.00 ATOM 1295 CZ PHE 166 16.594 8.172 -12.429 1.00 0.00 ATOM 1296 O PHE 166 12.452 6.894 -14.417 1.00 0.00 ATOM 1297 C PHE 166 12.053 6.448 -13.346 1.00 0.00 ATOM 1298 N TYR 167 11.334 4.759 -14.191 1.00 0.00 ATOM 1299 CA TYR 167 11.564 3.889 -15.328 1.00 0.00 ATOM 1300 CB TYR 167 11.113 2.461 -14.980 1.00 0.00 ATOM 1301 CG TYR 167 11.559 1.414 -15.963 1.00 0.00 ATOM 1302 CD1 TYR 167 12.792 0.786 -15.826 1.00 0.00 ATOM 1303 CD2 TYR 167 10.739 1.040 -17.031 1.00 0.00 ATOM 1304 CE1 TYR 167 13.210 -0.198 -16.731 1.00 0.00 ATOM 1305 CE2 TYR 167 11.139 0.058 -17.938 1.00 0.00 ATOM 1306 CZ TYR 167 12.373 -0.550 -17.787 1.00 0.00 ATOM 1307 OH TYR 167 12.776 -1.475 -18.718 1.00 0.00 ATOM 1308 O TYR 167 9.758 4.863 -16.580 1.00 0.00 ATOM 1309 C TYR 167 10.969 4.660 -16.505 1.00 0.00 ATOM 1310 N SER 168 11.856 5.106 -17.401 1.00 0.00 ATOM 1311 CA SER 168 11.452 5.903 -18.551 1.00 0.00 ATOM 1312 CB SER 168 12.668 6.589 -19.181 1.00 0.00 ATOM 1313 OG SER 168 13.550 5.639 -19.752 1.00 0.00 ATOM 1314 O SER 168 10.309 5.511 -20.635 1.00 0.00 ATOM 1315 C SER 168 10.787 5.014 -19.619 1.00 0.00 ATOM 1316 N HIS 169 10.753 3.704 -19.366 1.00 0.00 ATOM 1317 CA HIS 169 10.157 2.737 -20.275 1.00 0.00 ATOM 1318 CB HIS 169 11.216 1.754 -20.778 1.00 0.00 ATOM 1319 CG HIS 169 12.302 2.397 -21.584 1.00 0.00 ATOM 1320 CD2 HIS 169 12.452 2.835 -22.963 1.00 0.00 ATOM 1321 ND1 HIS 169 13.528 2.726 -21.049 1.00 0.00 ATOM 1322 CE1 HIS 169 14.288 3.285 -22.007 1.00 0.00 ATOM 1323 NE2 HIS 169 13.648 3.352 -23.160 1.00 0.00 ATOM 1324 O HIS 169 8.718 0.809 -20.213 1.00 0.00 ATOM 1325 C HIS 169 9.038 1.874 -19.676 1.00 0.00 ATOM 1326 N PHE 170 8.442 2.314 -18.570 1.00 0.00 ATOM 1327 CA PHE 170 7.330 1.559 -17.977 1.00 0.00 ATOM 1328 CB PHE 170 7.343 1.637 -16.400 1.00 0.00 ATOM 1329 CG PHE 170 6.902 2.973 -15.853 1.00 0.00 ATOM 1330 CD1 PHE 170 5.549 3.283 -15.727 1.00 0.00 ATOM 1331 CD2 PHE 170 7.841 3.920 -15.447 1.00 0.00 ATOM 1332 CE1 PHE 170 5.143 4.505 -15.215 1.00 0.00 ATOM 1333 CE2 PHE 170 7.434 5.152 -14.930 1.00 0.00 ATOM 1334 CZ PHE 170 6.090 5.443 -14.819 1.00 0.00 ATOM 1335 O PHE 170 5.802 2.969 -19.205 1.00 0.00 ATOM 1336 C PHE 170 6.099 1.811 -18.842 1.00 0.00 ATOM 1337 N ASN 171 5.413 0.731 -19.201 1.00 0.00 ATOM 1338 CA ASN 171 4.228 0.819 -20.034 1.00 0.00 ATOM 1339 CB ASN 171 3.986 -0.505 -20.765 1.00 0.00 ATOM 1340 CG ASN 171 3.583 -1.623 -19.824 1.00 0.00 ATOM 1341 ND2 ASN 171 3.764 -1.399 -18.528 1.00 0.00 ATOM 1342 OD1 ASN 171 3.114 -2.674 -20.259 1.00 0.00 ATOM 1343 O ASN 171 3.091 1.456 -18.009 1.00 0.00 ATOM 1344 C ASN 171 2.981 1.135 -19.187 1.00 0.00 ATOM 1345 N GLU 172 1.811 1.096 -19.802 1.00 0.00 ATOM 1346 CA GLU 172 0.565 1.380 -19.102 1.00 0.00 ATOM 1347 CB GLU 172 -0.632 1.186 -20.037 1.00 0.00 ATOM 1348 CG GLU 172 -0.729 2.226 -21.142 1.00 0.00 ATOM 1349 CD GLU 172 -1.893 1.971 -22.080 1.00 0.00 ATOM 1350 OE1 GLU 172 -2.593 0.953 -21.896 1.00 0.00 ATOM 1351 OE2 GLU 172 -2.105 2.790 -22.998 1.00 0.00 ATOM 1352 O GLU 172 -0.040 0.825 -16.846 1.00 0.00 ATOM 1353 C GLU 172 0.427 0.434 -17.917 1.00 0.00 ATOM 1354 N GLY 173 0.849 -0.822 -18.137 1.00 0.00 ATOM 1355 CA GLY 173 0.746 -1.807 -17.062 1.00 0.00 ATOM 1356 O GLY 173 1.074 -1.671 -14.694 1.00 0.00 ATOM 1357 C GLY 173 1.483 -1.352 -15.810 1.00 0.00 ATOM 1358 N GLU 174 2.578 -0.618 -15.997 1.00 0.00 ATOM 1359 CA GLU 174 3.375 -0.140 -14.875 1.00 0.00 ATOM 1360 CB GLU 174 4.844 0.139 -15.317 1.00 0.00 ATOM 1361 CG GLU 174 5.661 -1.167 -15.541 1.00 0.00 ATOM 1362 CD GLU 174 7.084 -1.011 -15.978 1.00 0.00 ATOM 1363 OE1 GLU 174 7.500 0.155 -15.801 1.00 0.00 ATOM 1364 OE2 GLU 174 7.852 -1.822 -16.441 1.00 0.00 ATOM 1365 O GLU 174 2.559 1.006 -12.956 1.00 0.00 ATOM 1366 C GLU 174 2.620 0.963 -14.179 1.00 0.00 ATOM 1367 N ILE 175 2.043 1.864 -14.959 1.00 0.00 ATOM 1368 CA ILE 175 1.273 2.948 -14.383 1.00 0.00 ATOM 1369 CB ILE 175 0.921 3.987 -15.561 1.00 0.00 ATOM 1370 CG1 ILE 175 2.218 4.314 -16.381 1.00 0.00 ATOM 1371 CG2 ILE 175 0.201 5.238 -15.023 1.00 0.00 ATOM 1372 CD1 ILE 175 1.970 5.465 -17.433 1.00 0.00 ATOM 1373 O ILE 175 -0.180 2.820 -12.494 1.00 0.00 ATOM 1374 C ILE 175 0.151 2.333 -13.564 1.00 0.00 ATOM 1375 N GLU 176 -0.419 1.244 -14.075 1.00 0.00 ATOM 1376 CA GLU 176 -1.515 0.555 -13.391 1.00 0.00 ATOM 1377 CB GLU 176 -2.097 -0.545 -14.279 1.00 0.00 ATOM 1378 CG GLU 176 -3.321 -1.234 -13.697 1.00 0.00 ATOM 1379 CD GLU 176 -3.895 -2.285 -14.625 1.00 0.00 ATOM 1380 OE1 GLU 176 -3.338 -2.475 -15.726 1.00 0.00 ATOM 1381 OE2 GLU 176 -4.907 -2.916 -14.252 1.00 0.00 ATOM 1382 O GLU 176 -1.788 -0.169 -11.110 1.00 0.00 ATOM 1383 C GLU 176 -1.046 -0.094 -12.086 1.00 0.00 ATOM 1384 N SER 177 0.196 -0.554 -12.078 1.00 0.00 ATOM 1385 CA SER 177 0.783 -1.171 -10.902 1.00 0.00 ATOM 1386 CB SER 177 2.163 -1.743 -11.230 1.00 0.00 ATOM 1387 OG SER 177 2.063 -2.817 -12.153 1.00 0.00 ATOM 1388 O SER 177 0.628 -0.309 -8.652 1.00 0.00 ATOM 1389 C SER 177 0.910 -0.086 -9.823 1.00 0.00 ATOM 1390 N LYS 178 1.345 1.102 -10.234 1.00 0.00 ATOM 1391 CA LYS 178 1.496 2.220 -9.313 1.00 0.00 ATOM 1392 CB LYS 178 2.186 3.396 -10.009 1.00 0.00 ATOM 1393 CG LYS 178 3.656 3.158 -10.315 1.00 0.00 ATOM 1394 CD LYS 178 4.311 4.410 -10.879 1.00 0.00 ATOM 1395 CE LYS 178 3.833 4.695 -12.293 1.00 0.00 ATOM 1396 NZ LYS 178 4.532 5.864 -12.891 1.00 0.00 ATOM 1397 O LYS 178 -0.038 2.948 -7.630 1.00 0.00 ATOM 1398 C LYS 178 0.138 2.679 -8.820 1.00 0.00 ATOM 1399 N PRO 179 -0.823 2.777 -9.736 1.00 0.00 ATOM 1400 CA PRO 179 -2.187 3.218 -9.412 1.00 0.00 ATOM 1401 CB PRO 179 -3.007 2.986 -10.644 1.00 0.00 ATOM 1402 CG PRO 179 -2.000 3.305 -11.735 1.00 0.00 ATOM 1403 CD PRO 179 -0.736 2.604 -11.271 1.00 0.00 ATOM 1404 O PRO 179 -3.407 3.123 -7.344 1.00 0.00 ATOM 1405 C PRO 179 -2.803 2.492 -8.210 1.00 0.00 ATOM 1406 N VAL 180 -2.620 1.172 -8.136 1.00 0.00 ATOM 1407 CA VAL 180 -3.164 0.384 -7.025 1.00 0.00 ATOM 1408 CB VAL 180 -2.327 -1.155 -7.322 1.00 0.00 ATOM 1409 CG1 VAL 180 -1.879 -1.401 -8.760 1.00 0.00 ATOM 1410 CG2 VAL 180 -1.159 -0.960 -6.405 1.00 0.00 ATOM 1411 O VAL 180 -3.321 0.785 -4.674 1.00 0.00 ATOM 1412 C VAL 180 -2.560 0.723 -5.661 1.00 0.00 ATOM 1413 N LEU 181 -1.277 1.112 -5.626 1.00 0.00 ATOM 1414 CA LEU 181 -0.681 1.576 -4.383 1.00 0.00 ATOM 1415 CB LEU 181 0.796 2.006 -4.500 1.00 0.00 ATOM 1416 CG LEU 181 1.977 1.028 -4.681 1.00 0.00 ATOM 1417 CD1 LEU 181 1.535 -0.385 -4.249 1.00 0.00 ATOM 1418 CD2 LEU 181 2.455 1.041 -6.148 1.00 0.00 ATOM 1419 O LEU 181 -1.723 2.812 -2.668 1.00 0.00 ATOM 1420 C LEU 181 -1.409 2.810 -3.858 1.00 0.00 ATOM 1421 N HIS 182 -1.728 3.788 -4.716 1.00 0.00 ATOM 1422 CA HIS 182 -2.395 5.036 -4.279 1.00 0.00 ATOM 1423 CB HIS 182 -2.653 5.983 -5.378 1.00 0.00 ATOM 1424 CG HIS 182 -1.383 6.748 -5.686 1.00 0.00 ATOM 1425 CD2 HIS 182 -0.427 6.536 -6.646 1.00 0.00 ATOM 1426 ND1 HIS 182 -0.991 7.823 -4.894 1.00 0.00 ATOM 1427 CE1 HIS 182 0.163 8.257 -5.408 1.00 0.00 ATOM 1428 NE2 HIS 182 0.526 7.515 -6.459 1.00 0.00 ATOM 1429 O HIS 182 -4.066 5.220 -2.582 1.00 0.00 ATOM 1430 C HIS 182 -3.768 4.728 -3.678 1.00 0.00 TER END ################################ # # # END # # # ################################