PFRMAT TS TARGET TR432 AUTHOR 4008-1775-0004 METHOD The SAM-T08 hand predictions use methods similar to SAM_T06 in CASP7. METHOD METHOD We start with a fully automated method (implemented as the SAM-T08-server): METHOD METHOD Use the SAM-T2K, SAM-T04, and SAM-T06 methods for finding homologs METHOD of the target and aligning them. METHOD METHOD Make local structure predictions using neural nets and the METHOD multiple alignments. These neural nets have been newly trained METHOD for CASP8 with an improved training protocol. The neural nets for METHOD the 3 different multiple sequence alignments are independently METHOD trained, so combining them should offer improved performance. METHOD METHOD We currently use 15 local-structure alphabets: METHOD STR2 an extended version of DSSP that splits the beta strands METHOD into multiple classes (parallel/antiparallel/mixed, METHOD edge/center) METHOD STR4 an attempt at an alphabet like STR2, but not requiring DSSP. METHOD This alphabet may be trying to make some irrelevant METHOD distinctions as well. METHOD ALPHA an discretization of the alpha torsion angle: METHOD CA(i-i), CA(i), CA(i+1), CA(i+2) METHOD BYS a discretization of Ramachandran plots, due to Bystroff METHOD PB de Brevern's protein blocks METHOD METHOD N_NOTOR METHOD N_NOTOR2 METHOD O_NOTOR METHOD O_NOTOR2 alphabets based on the torsion angle of METHOD backbone hydrogen bonds METHOD METHOD N_SEP METHOD O_SEP alphabets based on the separation of donor and METHOD acceptor for backbone hydrogen bonds METHOD METHOD CB_burial_14_7 a 7-state discretization of the number of C_beta METHOD atoms in a 14 Angstrom radius sphere around the C_beta. METHOD near-backbone-11 an 11-state discretization of the number of METHOD residues (represented by near-backbone points) in a METHOD 9.65 Angstrom radius sphere around the sidechain proxy METHOD spot for the residue. METHOD METHOD DSSP_EHL2 CASP's collapse of the DSSP alphabet METHOD DSSP_EHL2 is not predicted directly by a METHOD neural net, but is computed as a weighted METHOD average of the other backbone alphabet predictions. METHOD METHOD We make 2-track HMMs with each alphabet with the amino-acid track METHOD having a weight of 1 and the local structure track having a weight METHOD of 0.1 (for backbone alphabets) or 0.3 (for burial alphabets). METHOD We use these HMMs to score a template library of about METHOD 14000 (t06), 16000 (t04), or 18000 (t2k) templates. METHOD The template libraries are expanded weekly, but old template HMMs METHOD are not rebuilt. The target HMMs are used to score consensus METHOD sequences for the templates, to get a cheap approximation of METHOD profile-profile scoring, which does not yet work in the SAM package. METHOD METHOD We also used single-track HMMs to score not just the template METHOD library, but a non-redundant copy of the entire PDB. This scoring METHOD is done with real sequences, not consensus sequences. METHOD METHOD All the target HMMs use a new calibration method the provides more METHOD accurate E-values than before, and can be used even with METHOD local-structure alphabets that used to give us trouble (such as METHOD protein blocks). METHOD METHOD One-track HMMs built from the template library multiple alignments METHOD were used to score the target sequence. Later this summer, we METHOD hope to be able to use multi-track template HMMs, but we have not METHOD had time to calibrate such models while keeping the code METHOD compatible with the old libraries, so the template libraries METHOD currently use old calibrations, with somewhat optimistic E-values. METHOD METHOD All the logs of e-values were combined in a weighted average (with METHOD rather arbitrary weights, since we still have not taken the time METHOD to optimize them), and the best templates ranked. METHOD METHOD Alignments of the target to the top templates were made using METHOD several different alignment settings on the SAM alignment software. METHOD METHOD Generate fragments (short 9-residue alignments for each position) METHOD using SAM's "fragfinder" program and the 3-track HMM which tested METHOD best for alignment. METHOD METHOD Residue-residue contact predictions are made using mutual METHOD information, pairwise contact potentials, joint entropy, and other METHOD signals combined by a neural net. Two different neural net METHOD methods were used, and the results submitted separately. METHOD METHOD CB-CB constraints were extracted from the alignments and a METHOD combinatorial optimization done to choose a most-believable METHOD subset. METHOD METHOD Then the "undertaker" program (named because it originally METHOD optimized burial) is used to try to combine the alignments and the METHOD fragments into a consistent 3D model. No single alignment or METHOD parent template was used as a frozen core, though in many cases METHOD one had much more influence than the others. The alignment scores METHOD were not used by undertaker, but were used only to pick the set METHOD of alignments and fragments that undertaker would see. METHOD METHOD The cost functions used by undertaker rely heavily on the METHOD alignment constraints, on helix and strand constraints generated METHOD from the secondary-structure predictions, and on the neural-net METHOD predictions of local properties that undertaker can measure. METHOD The residue-residue contact predictions are also given to METHOD undertaker, but have less weight. There are also a number of METHOD built-in cost functions (breaks, clashes, burial, ...) that are METHOD included in the cost function. METHOD METHOD The automatic script runs the undertaker-optimized model through METHOD gromacs (to fix small clashes and breaks) and repacks the METHOD sidechains using Rosetta, but these post-undertaker optimizations METHOD are not included in the server predictions. They can be used in METHOD subsequent re-optimization. METHOD METHOD After the automatic prediction is done, we examine it by hand and try METHOD to fix any flaws that we see. This generally involves rerunning METHOD undertaker with new cost functions, increasing the weights for METHOD features we want to see and decreasing the weights where we think the METHOD optimization has gone overboard. Sometimes we will add new templates METHOD or remove ones that we think are misleading the optimization process. METHOD We often do "polishing" runs, where all the current models are read in METHOD and optimization with undertaker's genetic algorithm is done with high METHOD crossover. METHOD METHOD Some improvements in undertaker include better communication with METHOD SCWRL for initial model building form alignments (now using the METHOD standard protocol that identical residues have fixed rotamers, rather METHOD than being reoptimized by SCWRL), more cost functions based on the METHOD neural net predictions, multiple constraint sets (for easier METHOD weighting of the importance of different constraints), and some new METHOD conformation-change operators (Backrub and BigBackrub). METHOD METHOD We also created model-quality-assessment methods for CASP8, which we METHOD are applying to the server predictions. We do two optimizations from the METHOD top 10 models with two of the MQA methods, and consider these models METHOD as possible alternatives to our natively-generated models. METHOD METHOD METHOD METHOD For this REFINEMENT model, we did a standard prediction for the METHOD residues included in the model, then tried optimizing both from the METHOD predicted model and from the provided starting point. Since we were METHOD directed to focus on Y85-G92, I also tried cutting and pasting that METHOD region from other models (particularly server models). This provided METHOD slightly different starting points and a bit more flexibility in METHOD rebuilding that loop. METHOD METHOD My tools are not optimized for fine-grain placement of atoms, so I'm METHOD not sure that I can make any improvement over a 1.34 Angstrom CA_RMSD METHOD model. METHOD METHOD All the models submitted have a disulfide constraint: C79-C101. The METHOD CYS residues seemed too close not to be interacting, though with this METHOD being part of a cytosolic human protein a disulfide somehow seems METHOD wrong. Since the cys are on the edge of the model, so I wonder if a METHOD metal-binding site in the protein has somehow been broken by taking METHOD out just this fragment. A disulfide here could correct for the METHOD missing metal. METHOD METHOD Model METHOD METHOD METHOD 1 TR432.try7-opt3.pdb # < chimera-try6-try5 METHOD # best undertaker score (with try3,try4,try7.costfcn) METHOD chimera-try6-try5: METHOD mostly from TR432.try6-opt3.gromacs0.repack-nonPC.pdb METHOD I111-R130 is from try5-opt3 METHOD chimera-try6-try5 was an attempt to use the tighter packing of METHOD the C-terminal helix in try5 with the more standard loop in try6. METHOD METHOD METHOD 2 TR432.try7-opt3.gromacs0.repack-nonPC.pdb # < chimera-try6-try5 METHOD # best rosetta energy METHOD Rosetta and undertaker disagree somewhat on clashes, so METHOD running an undertaker-produced model through gromacs energy METHOD minimization to relieve tiny clashes, then repacking the METHOD sidechains (except PRO and CYS) with Rosetta produces the best METHOD Rosetta energy scores, even though few atoms move much. METHOD METHOD 3 TR432.try6-opt3.pdb # < chimera-try4-MULTICOM METHOD chimera-try4-MULTICOM: METHOD mostly TR432.try4-opt3.repack-nonPC.pdb METHOD A82-L95 from MULTICOM-REFINE_TS2 METHOD This chimera was an attempt to get a slightly different loop METHOD as a starting point for further optimization. Sometimes doing METHOD this sort of cut-and-paste introduces breaks into the backbone METHOD and has slightly different shape to the fragments, kicking the METHOD optimization out of a local optimum and allowing it to find a METHOD different one. METHOD METHOD 4 TR432.try5-opt3.pdb # < try3-opt3 < try2-opt3.gromacs0.repack-nonPC < chimera-init-try1 METHOD chimera-init-try1: METHOD mostly TR432.pdb METHOD Y85-R97 from try1-opt3 METHOD try1-opt3 was the automatically generated prediction for TR432 METHOD It had a rather different idea of what the interesting loop should be. METHOD Initially I favored this model, but it looks like the loop now METHOD blocks access to the putative active site: Y43,N81,Y85,N86, so METHOD I downgraded the model. The try5 run had some extra METHOD constraints to try to pull the C-terminal helix in tighter, METHOD which were fairly successful, so I copied that portion of the METHOD model into chimera-try6-try5 to make the final model. METHOD METHOD 5 TR432.try4-opt3.repack-nonPC.pdb # < TR432 METHOD # optimized directly from provided model, using just undertaker. METHOD # helix constraints taken from the initial model and from try1-opt3 METHOD # disulfide C79-C101 METHOD REMARK 6 REMARK 6 TR432 model 2 Thu Jul 10 18:42:30 2008 MODEL 2 PARENT N/A ATOM 1 N SER 1 29.825 8.162 13.580 1.00 0.00 ATOM 2 CA SER 1 29.228 7.991 12.253 1.00 0.00 ATOM 3 CB SER 1 28.096 6.956 12.424 1.00 0.00 ATOM 4 OG SER 1 26.945 7.524 13.035 1.00 0.00 ATOM 5 O SER 1 28.586 10.300 12.432 1.00 0.00 ATOM 6 C SER 1 28.712 9.324 11.687 1.00 0.00 ATOM 7 N MET 2 28.497 9.379 10.378 1.00 0.00 ATOM 8 CA MET 2 27.928 10.532 9.653 1.00 0.00 ATOM 9 CB MET 2 27.844 10.226 8.159 1.00 0.00 ATOM 10 CG MET 2 29.190 10.159 7.452 1.00 0.00 ATOM 11 SD MET 2 29.039 9.736 5.705 1.00 0.00 ATOM 12 CE MET 2 28.263 11.216 5.065 1.00 0.00 ATOM 13 O MET 2 26.280 12.146 10.340 1.00 0.00 ATOM 14 C MET 2 26.535 10.962 10.146 1.00 0.00 ATOM 15 N GLN 3 25.755 9.974 10.585 1.00 0.00 ATOM 16 CA GLN 3 24.410 10.223 11.129 1.00 0.00 ATOM 17 CB GLN 3 23.679 8.901 11.378 1.00 0.00 ATOM 18 CG GLN 3 23.276 8.164 10.112 1.00 0.00 ATOM 19 CD GLN 3 22.674 6.803 10.400 1.00 0.00 ATOM 20 OE1 GLN 3 22.639 6.356 11.550 1.00 0.00 ATOM 21 NE2 GLN 3 22.200 6.133 9.357 1.00 0.00 ATOM 22 O GLN 3 23.838 12.069 12.570 1.00 0.00 ATOM 23 C GLN 3 24.475 11.030 12.434 1.00 0.00 ATOM 24 N GLU 4 25.373 10.595 13.313 1.00 0.00 ATOM 25 CA GLU 4 25.616 11.269 14.588 1.00 0.00 ATOM 26 CB GLU 4 26.599 10.412 15.379 1.00 0.00 ATOM 27 CG GLU 4 25.944 9.082 15.770 1.00 0.00 ATOM 28 CD GLU 4 26.888 8.266 16.641 1.00 0.00 ATOM 29 OE1 GLU 4 28.065 8.109 16.257 1.00 0.00 ATOM 30 OE2 GLU 4 26.396 7.778 17.676 1.00 0.00 ATOM 31 O GLU 4 25.746 13.641 15.033 1.00 0.00 ATOM 32 C GLU 4 26.182 12.681 14.397 1.00 0.00 ATOM 33 N GLU 5 27.080 12.795 13.423 1.00 0.00 ATOM 34 CA GLU 5 27.644 14.096 13.043 1.00 0.00 ATOM 35 CB GLU 5 28.690 13.925 11.939 1.00 0.00 ATOM 36 CG GLU 5 29.982 13.262 12.394 1.00 0.00 ATOM 37 CD GLU 5 30.903 13.007 11.234 1.00 0.00 ATOM 38 OE1 GLU 5 30.512 13.264 10.121 1.00 0.00 ATOM 39 OE2 GLU 5 32.038 12.661 11.467 1.00 0.00 ATOM 40 O GLU 5 26.510 16.210 13.055 1.00 0.00 ATOM 41 C GLU 5 26.564 15.076 12.582 1.00 0.00 ATOM 42 N ASP 6 25.705 14.581 11.698 1.00 0.00 ATOM 43 CA ASP 6 24.593 15.392 11.178 1.00 0.00 ATOM 44 CB ASP 6 23.867 14.649 10.053 1.00 0.00 ATOM 45 CG ASP 6 24.643 14.575 8.745 1.00 0.00 ATOM 46 OD1 ASP 6 25.617 15.279 8.614 1.00 0.00 ATOM 47 OD2 ASP 6 24.353 13.710 7.953 1.00 0.00 ATOM 48 O ASP 6 23.276 16.925 12.444 1.00 0.00 ATOM 49 C ASP 6 23.601 15.760 12.279 1.00 0.00 ATOM 50 N THR 7 23.363 14.808 13.176 1.00 0.00 ATOM 51 CA THR 7 22.450 15.016 14.318 1.00 0.00 ATOM 52 CB THR 7 22.230 13.714 15.111 1.00 0.00 ATOM 53 CG2 THR 7 21.464 13.993 16.394 1.00 0.00 ATOM 54 OG1 THR 7 21.492 12.782 14.309 1.00 0.00 ATOM 55 O THR 7 22.310 17.036 15.647 1.00 0.00 ATOM 56 C THR 7 23.007 16.105 15.260 1.00 0.00 ATOM 57 N PHE 8 24.297 15.972 15.595 1.00 0.00 ATOM 58 CA PHE 8 25.081 16.907 16.427 1.00 0.00 ATOM 59 CB PHE 8 26.537 16.446 16.522 1.00 0.00 ATOM 60 CG PHE 8 27.460 17.471 17.117 1.00 0.00 ATOM 61 CD1 PHE 8 27.512 17.665 18.489 1.00 0.00 ATOM 62 CD2 PHE 8 28.277 18.244 16.306 1.00 0.00 ATOM 63 CE1 PHE 8 28.360 18.608 19.038 1.00 0.00 ATOM 64 CE2 PHE 8 29.128 19.186 16.851 1.00 0.00 ATOM 65 CZ PHE 8 29.168 19.368 18.219 1.00 0.00 ATOM 66 O PHE 8 24.751 19.302 16.564 1.00 0.00 ATOM 67 C PHE 8 25.006 18.325 15.859 1.00 0.00 ATOM 68 N ARG 9 25.392 18.393 14.587 1.00 0.00 ATOM 69 CA ARG 9 25.474 19.657 13.829 1.00 0.00 ATOM 70 CB ARG 9 26.050 19.455 12.435 1.00 0.00 ATOM 71 CG ARG 9 27.535 19.128 12.398 1.00 0.00 ATOM 72 CD ARG 9 28.070 18.868 11.036 1.00 0.00 ATOM 73 NE ARG 9 29.482 18.524 11.000 1.00 0.00 ATOM 74 CZ ARG 9 30.157 18.177 9.887 1.00 0.00 ATOM 75 NH1 ARG 9 29.547 18.088 8.725 1.00 0.00 ATOM 76 NH2 ARG 9 31.445 17.902 9.997 1.00 0.00 ATOM 77 O ARG 9 24.038 21.546 14.093 1.00 0.00 ATOM 78 C ARG 9 24.123 20.353 13.780 1.00 0.00 ATOM 79 N GLU 10 23.082 19.555 13.579 1.00 0.00 ATOM 80 CA GLU 10 21.697 20.031 13.532 1.00 0.00 ATOM 81 CB GLU 10 20.757 18.903 13.104 1.00 0.00 ATOM 82 CG GLU 10 19.300 19.319 12.956 1.00 0.00 ATOM 83 CD GLU 10 18.452 18.179 12.467 1.00 0.00 ATOM 84 OE1 GLU 10 18.987 17.121 12.240 1.00 0.00 ATOM 85 OE2 GLU 10 17.253 18.330 12.428 1.00 0.00 ATOM 86 O GLU 10 20.744 21.741 14.955 1.00 0.00 ATOM 87 C GLU 10 21.230 20.605 14.880 1.00 0.00 ATOM 88 N LEU 11 21.696 19.965 15.952 1.00 0.00 ATOM 89 CA LEU 11 21.447 20.417 17.320 1.00 0.00 ATOM 90 CB LEU 11 21.951 19.372 18.324 1.00 0.00 ATOM 91 CG LEU 11 21.556 19.624 19.784 1.00 0.00 ATOM 92 CD1 LEU 11 20.047 19.799 19.894 1.00 0.00 ATOM 93 CD2 LEU 11 22.028 18.463 20.647 1.00 0.00 ATOM 94 O LEU 11 21.508 22.672 18.217 1.00 0.00 ATOM 95 C LEU 11 22.094 21.771 17.620 1.00 0.00 ATOM 96 N ARG 12 23.354 21.883 17.204 1.00 0.00 ATOM 97 CA ARG 12 24.150 23.125 17.354 1.00 0.00 ATOM 98 CB ARG 12 25.606 22.924 16.960 1.00 0.00 ATOM 99 CG ARG 12 26.501 24.133 17.182 1.00 0.00 ATOM 100 CD ARG 12 27.933 23.902 16.861 1.00 0.00 ATOM 101 NE ARG 12 28.197 23.611 15.462 1.00 0.00 ATOM 102 CZ ARG 12 29.343 23.078 14.994 1.00 0.00 ATOM 103 NH1 ARG 12 30.345 22.811 15.802 1.00 0.00 ATOM 104 NH2 ARG 12 29.442 22.851 13.695 1.00 0.00 ATOM 105 O ARG 12 23.517 25.411 17.142 1.00 0.00 ATOM 106 C ARG 12 23.551 24.307 16.599 1.00 0.00 ATOM 107 N ILE 13 23.013 24.047 15.413 1.00 0.00 ATOM 108 CA ILE 13 22.363 25.100 14.609 1.00 0.00 ATOM 109 CB ILE 13 21.790 24.536 13.295 1.00 0.00 ATOM 110 CG1 ILE 13 22.922 24.090 12.368 1.00 0.00 ATOM 111 CG2 ILE 13 20.912 25.571 12.611 1.00 0.00 ATOM 112 CD1 ILE 13 22.455 23.281 11.179 1.00 0.00 ATOM 113 O ILE 13 21.199 26.999 15.502 1.00 0.00 ATOM 114 C ILE 13 21.234 25.778 15.409 1.00 0.00 ATOM 115 N PHE 14 20.376 24.952 16.008 1.00 0.00 ATOM 116 CA PHE 14 19.256 25.471 16.829 1.00 0.00 ATOM 117 CB PHE 14 18.378 24.319 17.323 1.00 0.00 ATOM 118 CG PHE 14 17.774 23.501 16.218 1.00 0.00 ATOM 119 CD1 PHE 14 17.778 23.964 14.910 1.00 0.00 ATOM 120 CD2 PHE 14 17.198 22.267 16.482 1.00 0.00 ATOM 121 CE1 PHE 14 17.222 23.212 13.892 1.00 0.00 ATOM 122 CE2 PHE 14 16.643 21.514 15.468 1.00 0.00 ATOM 123 CZ PHE 14 16.654 21.987 14.171 1.00 0.00 ATOM 124 O PHE 14 19.295 27.419 18.227 1.00 0.00 ATOM 125 C PHE 14 19.730 26.282 18.012 1.00 0.00 ATOM 126 N LEU 15 20.676 25.695 18.732 1.00 0.00 ATOM 127 CA LEU 15 21.248 26.325 19.926 1.00 0.00 ATOM 128 CB LEU 15 22.248 25.376 20.599 1.00 0.00 ATOM 129 CG LEU 15 21.628 24.138 21.261 1.00 0.00 ATOM 130 CD1 LEU 15 22.726 23.193 21.729 1.00 0.00 ATOM 131 CD2 LEU 15 20.754 24.570 22.429 1.00 0.00 ATOM 132 O LEU 15 21.688 28.642 20.301 1.00 0.00 ATOM 133 C LEU 15 21.933 27.655 19.616 1.00 0.00 ATOM 134 N ARG 16 22.629 27.690 18.483 1.00 0.00 ATOM 135 CA ARG 16 23.273 28.930 18.003 1.00 0.00 ATOM 136 CB ARG 16 24.104 28.662 16.761 1.00 0.00 ATOM 137 CG ARG 16 25.388 27.959 17.190 1.00 0.00 ATOM 138 CD ARG 16 26.198 27.562 15.969 1.00 0.00 ATOM 139 NE ARG 16 26.690 28.762 15.290 1.00 0.00 ATOM 140 CZ ARG 16 27.276 28.788 14.097 1.00 0.00 ATOM 141 NH1 ARG 16 27.460 27.701 13.383 1.00 0.00 ATOM 142 NH2 ARG 16 27.738 29.920 13.619 1.00 0.00 ATOM 143 O ARG 16 22.450 31.160 18.073 1.00 0.00 ATOM 144 C ARG 16 22.254 30.020 17.690 1.00 0.00 ATOM 145 N ASN 17 21.127 29.620 17.127 1.00 0.00 ATOM 146 CA ASN 17 20.048 30.572 16.876 1.00 0.00 ATOM 147 CB ASN 17 18.904 29.925 16.117 1.00 0.00 ATOM 148 CG ASN 17 19.213 29.654 14.670 1.00 0.00 ATOM 149 ND2 ASN 17 18.403 28.822 14.066 1.00 0.00 ATOM 150 OD1 ASN 17 20.130 30.246 14.089 1.00 0.00 ATOM 151 O ASN 17 19.385 32.438 18.217 1.00 0.00 ATOM 152 C ASN 17 19.500 31.216 18.154 1.00 0.00 ATOM 153 N VAL 18 19.264 30.395 19.170 1.00 0.00 ATOM 154 CA VAL 18 18.795 30.889 20.489 1.00 0.00 ATOM 155 CB VAL 18 18.626 29.777 21.536 1.00 0.00 ATOM 156 CG1 VAL 18 17.948 30.313 22.806 1.00 0.00 ATOM 157 CG2 VAL 18 17.889 28.572 20.996 1.00 0.00 ATOM 158 O VAL 18 19.455 32.977 21.464 1.00 0.00 ATOM 159 C VAL 18 19.820 31.880 21.059 1.00 0.00 ATOM 160 N THR 19 21.095 31.484 21.016 1.00 0.00 ATOM 161 CA THR 19 22.197 32.314 21.547 1.00 0.00 ATOM 162 CB THR 19 23.550 31.583 21.455 1.00 0.00 ATOM 163 CG2 THR 19 24.649 32.413 22.100 1.00 0.00 ATOM 164 OG1 THR 19 23.458 30.317 22.121 1.00 0.00 ATOM 165 O THR 19 22.495 34.700 21.372 1.00 0.00 ATOM 166 C THR 19 22.280 33.639 20.789 1.00 0.00 ATOM 167 N HIS 20 22.194 33.522 19.470 1.00 0.00 ATOM 168 CA HIS 20 22.324 34.675 18.572 1.00 0.00 ATOM 169 CB HIS 20 22.273 34.257 17.105 1.00 0.00 ATOM 170 CG HIS 20 23.523 33.519 16.664 1.00 0.00 ATOM 171 CD2 HIS 20 24.684 33.379 17.301 1.00 0.00 ATOM 172 ND1 HIS 20 23.611 32.891 15.508 1.00 0.00 ATOM 173 CE1 HIS 20 24.804 32.346 15.406 1.00 0.00 ATOM 174 NE2 HIS 20 25.462 32.655 16.532 1.00 0.00 ATOM 175 O HIS 20 21.562 36.886 18.892 1.00 0.00 ATOM 176 C HIS 20 21.237 35.709 18.770 1.00 0.00 ATOM 177 N ARG 21 20.002 35.255 18.888 1.00 0.00 ATOM 178 CA ARG 21 18.874 36.180 19.117 1.00 0.00 ATOM 179 CB ARG 21 17.530 35.469 19.070 1.00 0.00 ATOM 180 CG ARG 21 17.101 35.005 17.686 1.00 0.00 ATOM 181 CD ARG 21 15.824 34.247 17.664 1.00 0.00 ATOM 182 NE ARG 21 15.423 33.781 16.346 1.00 0.00 ATOM 183 CZ ARG 21 14.351 33.002 16.104 1.00 0.00 ATOM 184 NH1 ARG 21 13.591 32.569 17.086 1.00 0.00 ATOM 185 NH2 ARG 21 14.095 32.664 14.852 1.00 0.00 ATOM 186 O ARG 21 18.873 38.168 20.445 1.00 0.00 ATOM 187 C ARG 21 19.049 36.956 20.422 1.00 0.00 ATOM 188 N LEU 22 19.604 36.285 21.434 1.00 0.00 ATOM 189 CA LEU 22 19.877 36.910 22.739 1.00 0.00 ATOM 190 CB LEU 22 20.288 35.851 23.754 1.00 0.00 ATOM 191 CG LEU 22 19.206 34.795 23.944 1.00 0.00 ATOM 192 CD1 LEU 22 19.765 33.602 24.719 1.00 0.00 ATOM 193 CD2 LEU 22 17.976 35.423 24.605 1.00 0.00 ATOM 194 O LEU 22 20.725 39.141 23.002 1.00 0.00 ATOM 195 C LEU 22 20.960 37.986 22.658 1.00 0.00 ATOM 196 N ALA 23 22.113 37.589 22.126 1.00 0.00 ATOM 197 CA ALA 23 23.264 38.494 21.976 1.00 0.00 ATOM 198 CB ALA 23 24.452 37.717 21.426 1.00 0.00 ATOM 199 O ALA 23 23.209 40.832 21.392 1.00 0.00 ATOM 200 C ALA 23 22.934 39.683 21.050 1.00 0.00 ATOM 201 N ILE 24 22.296 39.374 19.925 1.00 0.00 ATOM 202 CA ILE 24 21.904 40.393 18.930 1.00 0.00 ATOM 203 CB ILE 24 21.421 39.731 17.626 1.00 0.00 ATOM 204 CG1 ILE 24 22.580 38.993 16.956 1.00 0.00 ATOM 205 CG2 ILE 24 20.870 40.792 16.662 1.00 0.00 ATOM 206 CD1 ILE 24 22.144 38.061 15.823 1.00 0.00 ATOM 207 O ILE 24 21.103 42.556 19.560 1.00 0.00 ATOM 208 C ILE 24 20.868 41.349 19.539 1.00 0.00 ATOM 209 N ASP 25 19.763 40.795 20.026 1.00 0.00 ATOM 210 CA ASP 25 18.686 41.661 20.525 1.00 0.00 ATOM 211 CB ASP 25 17.472 40.824 20.938 1.00 0.00 ATOM 212 CG ASP 25 16.684 40.243 19.773 1.00 0.00 ATOM 213 OD1 ASP 25 16.943 40.625 18.655 1.00 0.00 ATOM 214 OD2 ASP 25 15.943 39.313 19.987 1.00 0.00 ATOM 215 O ASP 25 19.909 42.099 22.588 1.00 0.00 ATOM 216 C ASP 25 19.151 42.513 21.698 1.00 0.00 ATOM 217 N LYS 26 18.725 43.767 21.633 1.00 0.00 ATOM 218 CA LYS 26 19.152 44.818 22.585 1.00 0.00 ATOM 219 CB LYS 26 18.564 46.173 22.187 1.00 0.00 ATOM 220 CG LYS 26 19.161 46.770 20.919 1.00 0.00 ATOM 221 CD LYS 26 18.526 48.112 20.588 1.00 0.00 ATOM 222 CE LYS 26 19.111 48.702 19.314 1.00 0.00 ATOM 223 NZ LYS 26 18.476 50.001 18.959 1.00 0.00 ATOM 224 O LYS 26 19.471 44.759 24.994 1.00 0.00 ATOM 225 C LYS 26 18.754 44.491 24.028 1.00 0.00 ATOM 226 N ARG 27 17.596 43.856 24.167 1.00 0.00 ATOM 227 CA ARG 27 17.047 43.461 25.491 1.00 0.00 ATOM 228 CB ARG 27 15.639 42.893 25.382 1.00 0.00 ATOM 229 CG ARG 27 15.005 42.498 26.706 1.00 0.00 ATOM 230 CD ARG 27 13.598 42.035 26.597 1.00 0.00 ATOM 231 NE ARG 27 12.997 41.626 27.857 1.00 0.00 ATOM 232 CZ ARG 27 11.749 41.137 27.987 1.00 0.00 ATOM 233 NH1 ARG 27 10.953 41.029 26.947 1.00 0.00 ATOM 234 NH2 ARG 27 11.336 40.791 29.195 1.00 0.00 ATOM 235 O ARG 27 18.134 42.569 27.442 1.00 0.00 ATOM 236 C ARG 27 17.978 42.494 26.223 1.00 0.00 ATOM 237 N PHE 28 18.484 41.553 25.457 1.00 0.00 ATOM 238 CA PHE 28 19.333 40.516 26.040 1.00 0.00 ATOM 239 CB PHE 28 18.845 39.179 25.470 1.00 0.00 ATOM 240 CG PHE 28 17.363 38.878 25.807 1.00 0.00 ATOM 241 CD1 PHE 28 16.889 39.002 27.108 1.00 0.00 ATOM 242 CD2 PHE 28 16.454 38.523 24.803 1.00 0.00 ATOM 243 CE1 PHE 28 15.557 38.760 27.425 1.00 0.00 ATOM 244 CE2 PHE 28 15.113 38.291 25.120 1.00 0.00 ATOM 245 CZ PHE 28 14.669 38.404 26.421 1.00 0.00 ATOM 246 O PHE 28 21.653 40.251 26.582 1.00 0.00 ATOM 247 C PHE 28 20.838 40.887 25.932 1.00 0.00 ATOM 248 N ARG 29 21.072 42.173 25.643 1.00 0.00 ATOM 249 CA ARG 29 22.448 42.706 25.514 1.00 0.00 ATOM 250 CB ARG 29 22.483 44.033 24.770 1.00 0.00 ATOM 251 CG ARG 29 23.876 44.584 24.510 1.00 0.00 ATOM 252 CD ARG 29 23.904 45.794 23.649 1.00 0.00 ATOM 253 NE ARG 29 25.236 46.320 23.394 1.00 0.00 ATOM 254 CZ ARG 29 25.491 47.466 22.732 1.00 0.00 ATOM 255 NH1 ARG 29 24.517 48.188 22.226 1.00 0.00 ATOM 256 NH2 ARG 29 26.752 47.833 22.584 1.00 0.00 ATOM 257 O ARG 29 24.363 42.621 26.947 1.00 0.00 ATOM 258 C ARG 29 23.165 42.825 26.871 1.00 0.00 ATOM 259 N VAL 30 22.432 43.090 27.952 1.00 0.00 ATOM 260 CA VAL 30 23.039 43.171 29.299 1.00 0.00 ATOM 261 CB VAL 30 21.968 43.365 30.390 1.00 0.00 ATOM 262 CG1 VAL 30 22.589 43.237 31.774 1.00 0.00 ATOM 263 CG2 VAL 30 21.288 44.715 30.235 1.00 0.00 ATOM 264 O VAL 30 24.958 42.043 30.108 1.00 0.00 ATOM 265 C VAL 30 23.855 41.913 29.614 1.00 0.00 ATOM 266 N PHE 31 23.369 40.756 29.182 1.00 0.00 ATOM 267 CA PHE 31 24.104 39.489 29.387 1.00 0.00 ATOM 268 CB PHE 31 23.348 38.294 28.837 1.00 0.00 ATOM 269 CG PHE 31 21.948 38.194 29.333 1.00 0.00 ATOM 270 CD1 PHE 31 20.915 38.181 28.427 1.00 0.00 ATOM 271 CD2 PHE 31 21.753 38.115 30.684 1.00 0.00 ATOM 272 CE1 PHE 31 19.625 38.079 28.893 1.00 0.00 ATOM 273 CE2 PHE 31 20.463 38.023 31.130 1.00 0.00 ATOM 274 CZ PHE 31 19.400 38.010 30.244 1.00 0.00 ATOM 275 O PHE 31 26.211 38.510 28.824 1.00 0.00 ATOM 276 C PHE 31 25.380 39.378 28.573 1.00 0.00 ATOM 277 N THR 32 25.272 39.963 27.379 1.00 0.00 ATOM 278 CA THR 32 26.215 39.705 26.297 1.00 0.00 ATOM 279 CB THR 32 25.973 40.644 25.101 1.00 0.00 ATOM 280 CG2 THR 32 26.984 40.374 23.998 1.00 0.00 ATOM 281 OG1 THR 32 24.649 40.439 24.591 1.00 0.00 ATOM 282 O THR 32 28.448 38.960 26.663 1.00 0.00 ATOM 283 C THR 32 27.639 39.871 26.801 1.00 0.00 ATOM 284 N LYS 33 27.926 41.050 27.322 1.00 0.00 ATOM 285 CA LYS 33 29.261 41.347 27.825 1.00 0.00 ATOM 286 CB LYS 33 29.509 42.856 27.831 1.00 0.00 ATOM 287 CG LYS 33 29.378 43.521 26.467 1.00 0.00 ATOM 288 CD LYS 33 30.470 43.050 25.516 1.00 0.00 ATOM 289 CE LYS 33 30.422 43.810 24.199 1.00 0.00 ATOM 290 NZ LYS 33 31.499 43.376 23.267 1.00 0.00 ATOM 291 O LYS 33 28.442 40.710 29.953 1.00 0.00 ATOM 292 C LYS 33 29.430 40.764 29.228 1.00 0.00 ATOM 293 N PRO 34 30.657 40.431 29.615 1.00 0.00 ATOM 294 CA PRO 34 31.000 40.185 31.035 1.00 0.00 ATOM 295 CB PRO 34 32.507 39.947 31.021 1.00 0.00 ATOM 296 CG PRO 34 32.962 40.765 29.824 1.00 0.00 ATOM 297 CD PRO 34 31.884 40.441 28.790 1.00 0.00 ATOM 298 O PRO 34 30.690 42.571 31.253 1.00 0.00 ATOM 299 C PRO 34 30.658 41.464 31.799 1.00 0.00 ATOM 300 N VAL 35 30.221 41.277 33.042 1.00 0.00 ATOM 301 CA VAL 35 29.988 42.415 33.946 1.00 0.00 ATOM 302 CB VAL 35 29.427 41.900 35.292 1.00 0.00 ATOM 303 CG1 VAL 35 29.254 42.958 36.356 1.00 0.00 ATOM 304 CG2 VAL 35 28.029 41.316 35.141 1.00 0.00 ATOM 305 O VAL 35 32.369 42.398 34.217 1.00 0.00 ATOM 306 C VAL 35 31.357 43.100 34.097 1.00 0.00 ATOM 307 N ASP 36 31.381 44.377 33.749 1.00 0.00 ATOM 308 CA ASP 36 32.582 45.224 33.869 1.00 0.00 ATOM 309 CB ASP 36 32.329 46.603 33.257 1.00 0.00 ATOM 310 CG ASP 36 33.547 47.518 33.241 1.00 0.00 ATOM 311 OD1 ASP 36 34.542 47.159 33.825 1.00 0.00 ATOM 312 OD2 ASP 36 33.529 48.486 32.519 1.00 0.00 ATOM 313 O ASP 36 32.401 46.070 36.135 1.00 0.00 ATOM 314 C ASP 36 33.040 45.387 35.337 1.00 0.00 ATOM 315 N PRO 37 34.164 44.776 35.696 1.00 0.00 ATOM 316 CA PRO 37 34.730 44.877 37.053 1.00 0.00 ATOM 317 CB PRO 37 36.051 44.130 36.962 1.00 0.00 ATOM 318 CG PRO 37 35.744 43.068 35.920 1.00 0.00 ATOM 319 CD PRO 37 34.909 43.812 34.879 1.00 0.00 ATOM 320 O PRO 37 34.777 46.547 38.753 1.00 0.00 ATOM 321 C PRO 37 34.950 46.307 37.564 1.00 0.00 ATOM 322 N ASP 38 35.238 47.259 36.677 1.00 0.00 ATOM 323 CA ASP 38 35.336 48.680 37.098 1.00 0.00 ATOM 324 CB ASP 38 35.839 49.548 35.942 1.00 0.00 ATOM 325 CG ASP 38 37.316 49.369 35.617 1.00 0.00 ATOM 326 OD1 ASP 38 38.009 48.770 36.406 1.00 0.00 ATOM 327 OD2 ASP 38 37.706 49.690 34.521 1.00 0.00 ATOM 328 O ASP 38 33.886 49.757 38.687 1.00 0.00 ATOM 329 C ASP 38 33.985 49.199 37.600 1.00 0.00 ATOM 330 N GLU 39 32.927 48.798 36.887 1.00 0.00 ATOM 331 CA GLU 39 31.542 49.077 37.311 1.00 0.00 ATOM 332 CB GLU 39 30.550 48.603 36.246 1.00 0.00 ATOM 333 CG GLU 39 29.091 48.892 36.573 1.00 0.00 ATOM 334 CD GLU 39 28.180 48.404 35.481 1.00 0.00 ATOM 335 OE1 GLU 39 28.673 47.878 34.512 1.00 0.00 ATOM 336 OE2 GLU 39 26.986 48.454 35.664 1.00 0.00 ATOM 337 O GLU 39 30.881 49.069 39.623 1.00 0.00 ATOM 338 C GLU 39 31.249 48.399 38.666 1.00 0.00 ATOM 339 N VAL 40 31.503 47.096 38.723 1.00 0.00 ATOM 340 CA VAL 40 31.298 46.286 39.938 1.00 0.00 ATOM 341 CB VAL 40 30.383 45.075 39.699 1.00 0.00 ATOM 342 CG1 VAL 40 30.159 44.316 41.005 1.00 0.00 ATOM 343 CG2 VAL 40 29.005 45.458 39.152 1.00 0.00 ATOM 344 O VAL 40 33.160 44.773 39.960 1.00 0.00 ATOM 345 C VAL 40 32.665 45.802 40.446 1.00 0.00 ATOM 346 N PRO 41 33.176 46.402 41.520 1.00 0.00 ATOM 347 CA PRO 41 34.484 46.030 42.097 1.00 0.00 ATOM 348 CB PRO 41 34.740 47.004 43.230 1.00 0.00 ATOM 349 CG PRO 41 33.358 47.563 43.593 1.00 0.00 ATOM 350 CD PRO 41 32.562 47.494 42.286 1.00 0.00 ATOM 351 O PRO 41 35.580 43.929 42.475 1.00 0.00 ATOM 352 C PRO 41 34.579 44.602 42.645 1.00 0.00 ATOM 353 N ASP 42 33.545 44.108 43.312 1.00 0.00 ATOM 354 CA ASP 42 33.642 42.781 43.940 1.00 0.00 ATOM 355 CB ASP 42 33.229 42.853 45.412 1.00 0.00 ATOM 356 CG ASP 42 31.799 43.320 45.643 1.00 0.00 ATOM 357 OD1 ASP 42 31.158 43.698 44.691 1.00 0.00 ATOM 358 OD2 ASP 42 31.309 43.151 46.734 1.00 0.00 ATOM 359 O ASP 42 32.595 40.612 43.757 1.00 0.00 ATOM 360 C ASP 42 32.796 41.717 43.240 1.00 0.00 ATOM 361 N TYR 43 32.564 41.962 41.949 1.00 0.00 ATOM 362 CA TYR 43 31.799 41.006 41.138 1.00 0.00 ATOM 363 CB TYR 43 31.590 41.500 39.706 1.00 0.00 ATOM 364 CG TYR 43 30.685 40.497 38.995 1.00 0.00 ATOM 365 CD1 TYR 43 29.325 40.485 39.261 1.00 0.00 ATOM 366 CD2 TYR 43 31.250 39.505 38.209 1.00 0.00 ATOM 367 CE1 TYR 43 28.521 39.491 38.710 1.00 0.00 ATOM 368 CE2 TYR 43 30.455 38.502 37.688 1.00 0.00 ATOM 369 CZ TYR 43 29.086 38.509 37.913 1.00 0.00 ATOM 370 OH TYR 43 28.293 37.556 37.362 1.00 0.00 ATOM 371 O TYR 43 31.941 38.605 41.301 1.00 0.00 ATOM 372 C TYR 43 32.523 39.657 41.073 1.00 0.00 ATOM 373 N VAL 44 33.823 39.750 40.787 1.00 0.00 ATOM 374 CA VAL 44 34.668 38.549 40.691 1.00 0.00 ATOM 375 CB VAL 44 36.051 38.939 40.173 1.00 0.00 ATOM 376 CG1 VAL 44 37.007 37.758 40.236 1.00 0.00 ATOM 377 CG2 VAL 44 35.940 39.342 38.701 1.00 0.00 ATOM 378 O VAL 44 34.609 36.547 42.013 1.00 0.00 ATOM 379 C VAL 44 34.714 37.766 42.015 1.00 0.00 ATOM 380 N THR 45 34.887 38.501 43.110 1.00 0.00 ATOM 381 CA THR 45 34.955 37.888 44.454 1.00 0.00 ATOM 382 CB THR 45 35.077 38.956 45.557 1.00 0.00 ATOM 383 CG2 THR 45 35.099 38.303 46.931 1.00 0.00 ATOM 384 OG1 THR 45 36.283 39.705 45.368 1.00 0.00 ATOM 385 O THR 45 33.812 35.855 45.060 1.00 0.00 ATOM 386 C THR 45 33.705 37.024 44.704 1.00 0.00 ATOM 387 N VAL 46 32.541 37.627 44.445 1.00 0.00 ATOM 388 CA VAL 46 31.274 36.923 44.644 1.00 0.00 ATOM 389 CB VAL 46 30.085 37.888 44.653 1.00 0.00 ATOM 390 CG1 VAL 46 28.756 37.124 44.793 1.00 0.00 ATOM 391 CG2 VAL 46 30.231 38.843 45.837 1.00 0.00 ATOM 392 O VAL 46 30.714 34.686 44.010 1.00 0.00 ATOM 393 C VAL 46 31.076 35.789 43.632 1.00 0.00 ATOM 394 N ILE 47 31.274 36.059 42.359 1.00 0.00 ATOM 395 CA ILE 47 30.978 35.047 41.336 1.00 0.00 ATOM 396 CB ILE 47 30.267 35.665 40.118 1.00 0.00 ATOM 397 CG1 ILE 47 29.012 36.423 40.562 1.00 0.00 ATOM 398 CG2 ILE 47 29.911 34.586 39.107 1.00 0.00 ATOM 399 CD1 ILE 47 28.061 35.595 41.396 1.00 0.00 ATOM 400 O ILE 47 33.042 34.925 40.119 1.00 0.00 ATOM 401 C ILE 47 32.278 34.358 40.885 1.00 0.00 ATOM 402 N LYS 48 32.505 33.128 41.352 1.00 0.00 ATOM 403 CA LYS 48 33.694 32.361 40.921 1.00 0.00 ATOM 404 CB LYS 48 33.871 31.115 41.791 1.00 0.00 ATOM 405 CG LYS 48 34.302 31.405 43.224 1.00 0.00 ATOM 406 CD LYS 48 34.454 30.121 44.025 1.00 0.00 ATOM 407 CE LYS 48 34.872 30.408 45.458 1.00 0.00 ATOM 408 NZ LYS 48 34.999 29.162 46.262 1.00 0.00 ATOM 409 O LYS 48 34.718 31.677 38.871 1.00 0.00 ATOM 410 C LYS 48 33.673 31.923 39.454 1.00 0.00 ATOM 411 N GLN 49 32.478 31.634 38.951 1.00 0.00 ATOM 412 CA GLN 49 32.306 31.158 37.564 1.00 0.00 ATOM 413 CB GLN 49 31.600 29.799 37.547 1.00 0.00 ATOM 414 CG GLN 49 32.390 28.679 38.201 1.00 0.00 ATOM 415 CD GLN 49 33.657 28.343 37.439 1.00 0.00 ATOM 416 OE1 GLN 49 33.656 28.267 36.207 1.00 0.00 ATOM 417 NE2 GLN 49 34.747 28.133 38.168 1.00 0.00 ATOM 418 O GLN 49 30.341 31.945 36.427 1.00 0.00 ATOM 419 C GLN 49 31.506 32.183 36.741 1.00 0.00 ATOM 420 N PRO 50 32.118 33.313 36.402 1.00 0.00 ATOM 421 CA PRO 50 31.407 34.348 35.649 1.00 0.00 ATOM 422 CB PRO 50 32.313 35.568 35.788 1.00 0.00 ATOM 423 CG PRO 50 33.727 35.001 35.926 1.00 0.00 ATOM 424 CD PRO 50 33.495 33.749 36.754 1.00 0.00 ATOM 425 O PRO 50 31.805 33.130 33.604 1.00 0.00 ATOM 426 C PRO 50 31.056 33.873 34.233 1.00 0.00 ATOM 427 N MET 51 29.777 34.037 33.917 1.00 0.00 ATOM 428 CA MET 51 29.206 33.606 32.622 1.00 0.00 ATOM 429 CB MET 51 28.174 32.489 32.822 1.00 0.00 ATOM 430 CG MET 51 28.831 31.235 33.407 1.00 0.00 ATOM 431 SD MET 51 30.108 30.463 32.357 1.00 0.00 ATOM 432 CE MET 51 30.950 29.420 33.520 1.00 0.00 ATOM 433 O MET 51 27.930 35.621 32.535 1.00 0.00 ATOM 434 C MET 51 28.568 34.779 31.897 1.00 0.00 ATOM 435 N ASP 52 28.703 34.770 30.587 1.00 0.00 ATOM 436 CA ASP 52 28.172 35.841 29.732 1.00 0.00 ATOM 437 CB ASP 52 29.089 37.067 29.777 1.00 0.00 ATOM 438 CG ASP 52 30.478 36.833 29.199 1.00 0.00 ATOM 439 OD1 ASP 52 30.634 36.957 28.008 1.00 0.00 ATOM 440 OD2 ASP 52 31.401 36.688 29.966 1.00 0.00 ATOM 441 O ASP 52 28.646 34.295 27.940 1.00 0.00 ATOM 442 C ASP 52 28.030 35.294 28.316 1.00 0.00 ATOM 443 N LEU 53 27.135 35.931 27.576 1.00 0.00 ATOM 444 CA LEU 53 26.783 35.437 26.230 1.00 0.00 ATOM 445 CB LEU 53 25.646 36.278 25.637 1.00 0.00 ATOM 446 CG LEU 53 24.281 35.581 25.577 1.00 0.00 ATOM 447 CD1 LEU 53 24.056 34.766 26.843 1.00 0.00 ATOM 448 CD2 LEU 53 23.185 36.623 25.405 1.00 0.00 ATOM 449 O LEU 53 28.115 34.461 24.501 1.00 0.00 ATOM 450 C LEU 53 27.960 35.427 25.246 1.00 0.00 ATOM 451 N SER 54 28.832 36.417 25.376 1.00 0.00 ATOM 452 CA SER 54 30.050 36.498 24.541 1.00 0.00 ATOM 453 CB SER 54 30.811 37.772 24.848 1.00 0.00 ATOM 454 OG SER 54 31.985 37.880 24.092 1.00 0.00 ATOM 455 O SER 54 31.304 34.608 23.747 1.00 0.00 ATOM 456 C SER 54 30.976 35.307 24.714 1.00 0.00 ATOM 457 N SER 55 31.248 35.012 25.975 1.00 0.00 ATOM 458 CA SER 55 32.085 33.844 26.319 1.00 0.00 ATOM 459 CB SER 55 32.429 33.864 27.795 1.00 0.00 ATOM 460 OG SER 55 33.240 34.957 28.132 1.00 0.00 ATOM 461 O SER 55 32.054 31.579 25.512 1.00 0.00 ATOM 462 C SER 55 31.398 32.530 25.959 1.00 0.00 ATOM 463 N VAL 56 30.078 32.506 26.105 1.00 0.00 ATOM 464 CA VAL 56 29.242 31.354 25.685 1.00 0.00 ATOM 465 CB VAL 56 27.756 31.524 26.080 1.00 0.00 ATOM 466 CG1 VAL 56 26.860 30.431 25.480 1.00 0.00 ATOM 467 CG2 VAL 56 27.581 31.455 27.601 1.00 0.00 ATOM 468 O VAL 56 29.588 29.968 23.772 1.00 0.00 ATOM 469 C VAL 56 29.383 31.113 24.176 1.00 0.00 ATOM 470 N ILE 57 29.293 32.179 23.390 1.00 0.00 ATOM 471 CA ILE 57 29.446 32.059 21.920 1.00 0.00 ATOM 472 CB ILE 57 29.203 33.406 21.214 1.00 0.00 ATOM 473 CG1 ILE 57 27.734 33.817 21.340 1.00 0.00 ATOM 474 CG2 ILE 57 29.612 33.321 19.751 1.00 0.00 ATOM 475 CD1 ILE 57 27.459 35.240 20.911 1.00 0.00 ATOM 476 O ILE 57 30.954 30.554 20.823 1.00 0.00 ATOM 477 C ILE 57 30.849 31.540 21.567 1.00 0.00 ATOM 478 N SER 58 31.847 32.002 22.310 1.00 0.00 ATOM 479 CA SER 58 33.241 31.544 22.118 1.00 0.00 ATOM 480 CB SER 58 34.213 32.278 23.029 1.00 0.00 ATOM 481 OG SER 58 34.218 33.646 22.641 1.00 0.00 ATOM 482 O SER 58 34.042 29.321 21.628 1.00 0.00 ATOM 483 C SER 58 33.384 30.044 22.376 1.00 0.00 ATOM 484 N LYS 59 32.722 29.558 23.422 1.00 0.00 ATOM 485 CA LYS 59 32.706 28.120 23.780 1.00 0.00 ATOM 486 CB LYS 59 31.998 27.897 25.114 1.00 0.00 ATOM 487 CG LYS 59 32.790 28.444 26.298 1.00 0.00 ATOM 488 CD LYS 59 32.012 28.201 27.592 1.00 0.00 ATOM 489 CE LYS 59 32.743 28.770 28.806 1.00 0.00 ATOM 490 NZ LYS 59 31.976 28.547 30.051 1.00 0.00 ATOM 491 O LYS 59 32.547 26.144 22.422 1.00 0.00 ATOM 492 C LYS 59 32.061 27.242 22.708 1.00 0.00 ATOM 493 N ILE 60 30.985 27.751 22.099 1.00 0.00 ATOM 494 CA ILE 60 30.342 27.102 20.935 1.00 0.00 ATOM 495 CB ILE 60 29.145 27.921 20.420 1.00 0.00 ATOM 496 CG1 ILE 60 28.011 27.913 21.449 1.00 0.00 ATOM 497 CG2 ILE 60 28.662 27.377 19.085 1.00 0.00 ATOM 498 CD1 ILE 60 26.910 28.906 21.151 1.00 0.00 ATOM 499 O ILE 60 31.631 25.787 19.408 1.00 0.00 ATOM 500 C ILE 60 31.376 26.923 19.822 1.00 0.00 ATOM 501 N ASP 61 32.098 28.002 19.533 1.00 0.00 ATOM 502 CA ASP 61 33.164 27.973 18.529 1.00 0.00 ATOM 503 CB ASP 61 33.747 29.374 18.325 1.00 0.00 ATOM 504 CG ASP 61 32.836 30.331 17.567 1.00 0.00 ATOM 505 OD1 ASP 61 31.870 29.876 17.001 1.00 0.00 ATOM 506 OD2 ASP 61 33.020 31.517 17.691 1.00 0.00 ATOM 507 O ASP 61 34.821 26.241 18.103 1.00 0.00 ATOM 508 C ASP 61 34.284 26.992 18.920 1.00 0.00 ATOM 509 N LEU 62 34.518 26.917 20.230 1.00 0.00 ATOM 510 CA LEU 62 35.479 25.999 20.872 1.00 0.00 ATOM 511 CB LEU 62 35.679 26.346 22.349 1.00 0.00 ATOM 512 CG LEU 62 36.347 27.690 22.628 1.00 0.00 ATOM 513 CD1 LEU 62 36.346 27.969 24.137 1.00 0.00 ATOM 514 CD2 LEU 62 37.785 27.709 22.112 1.00 0.00 ATOM 515 O LEU 62 35.902 23.666 21.164 1.00 0.00 ATOM 516 C LEU 62 35.101 24.513 20.772 1.00 0.00 ATOM 517 N HIS 63 33.836 24.246 20.429 1.00 0.00 ATOM 518 CA HIS 63 33.250 22.883 20.399 1.00 0.00 ATOM 519 CB HIS 63 34.045 21.938 19.481 1.00 0.00 ATOM 520 CG HIS 63 34.166 22.468 18.048 1.00 0.00 ATOM 521 CD2 HIS 63 35.260 23.012 17.520 1.00 0.00 ATOM 522 ND1 HIS 63 33.202 22.444 17.122 1.00 0.00 ATOM 523 CE1 HIS 63 33.714 23.001 16.036 1.00 0.00 ATOM 524 NE2 HIS 63 34.979 23.348 16.259 1.00 0.00 ATOM 525 O HIS 63 33.204 21.073 22.020 1.00 0.00 ATOM 526 C HIS 63 33.148 22.283 21.813 1.00 0.00 ATOM 527 N LYS 64 32.943 23.181 22.788 1.00 0.00 ATOM 528 CA LYS 64 32.804 22.821 24.211 1.00 0.00 ATOM 529 CB LYS 64 33.052 24.014 25.133 1.00 0.00 ATOM 530 CG LYS 64 34.488 24.517 25.124 1.00 0.00 ATOM 531 CD LYS 64 35.478 23.498 25.667 1.00 0.00 ATOM 532 CE LYS 64 36.856 24.131 25.707 1.00 0.00 ATOM 533 NZ LYS 64 37.816 23.183 26.239 1.00 0.00 ATOM 534 O LYS 64 31.229 21.929 25.773 1.00 0.00 ATOM 535 C LYS 64 31.428 22.270 24.610 1.00 0.00 ATOM 536 N TYR 65 30.437 22.457 23.733 1.00 0.00 ATOM 537 CA TYR 65 29.072 21.985 23.991 1.00 0.00 ATOM 538 CB TYR 65 28.014 23.046 23.789 1.00 0.00 ATOM 539 CG TYR 65 28.213 24.289 24.621 1.00 0.00 ATOM 540 CD1 TYR 65 27.928 24.301 25.982 1.00 0.00 ATOM 541 CD2 TYR 65 28.674 25.420 23.982 1.00 0.00 ATOM 542 CE1 TYR 65 28.125 25.463 26.704 1.00 0.00 ATOM 543 CE2 TYR 65 28.861 26.582 24.705 1.00 0.00 ATOM 544 CZ TYR 65 28.606 26.603 26.065 1.00 0.00 ATOM 545 OH TYR 65 29.012 27.712 26.727 1.00 0.00 ATOM 546 O TYR 65 28.372 20.931 21.910 1.00 0.00 ATOM 547 C TYR 65 28.715 20.814 23.089 1.00 0.00 ATOM 548 N LEU 66 28.833 19.646 23.706 1.00 0.00 ATOM 549 CA LEU 66 28.445 18.386 23.045 1.00 0.00 ATOM 550 CB LEU 66 29.172 17.201 23.694 1.00 0.00 ATOM 551 CG LEU 66 30.697 17.204 23.534 1.00 0.00 ATOM 552 CD1 LEU 66 31.305 16.038 24.302 1.00 0.00 ATOM 553 CD2 LEU 66 31.054 17.121 22.058 1.00 0.00 ATOM 554 O LEU 66 26.361 17.526 22.208 1.00 0.00 ATOM 555 C LEU 66 26.933 18.165 23.092 1.00 0.00 ATOM 556 N THR 67 26.284 18.819 24.061 1.00 0.00 ATOM 557 CA THR 67 24.833 18.667 24.257 1.00 0.00 ATOM 558 CB THR 67 24.485 17.668 25.385 1.00 0.00 ATOM 559 CG2 THR 67 25.088 16.279 25.161 1.00 0.00 ATOM 560 OG1 THR 67 24.847 18.231 26.650 1.00 0.00 ATOM 561 O THR 67 24.784 21.002 24.934 1.00 0.00 ATOM 562 C THR 67 24.160 19.997 24.582 1.00 0.00 ATOM 563 N VAL 68 22.839 19.913 24.478 1.00 0.00 ATOM 564 CA VAL 68 21.893 20.957 24.946 1.00 0.00 ATOM 565 CB VAL 68 20.456 20.404 24.865 1.00 0.00 ATOM 566 CG1 VAL 68 19.438 21.062 25.795 1.00 0.00 ATOM 567 CG2 VAL 68 19.963 20.601 23.435 1.00 0.00 ATOM 568 O VAL 68 22.199 22.534 26.745 1.00 0.00 ATOM 569 C VAL 68 22.204 21.352 26.402 1.00 0.00 ATOM 570 N LYS 69 22.254 20.316 27.218 1.00 0.00 ATOM 571 CA LYS 69 22.251 20.435 28.687 1.00 0.00 ATOM 572 CB LYS 69 22.260 19.051 29.337 1.00 0.00 ATOM 573 CG LYS 69 20.961 18.272 29.178 1.00 0.00 ATOM 574 CD LYS 69 21.045 16.910 29.851 1.00 0.00 ATOM 575 CE LYS 69 19.755 16.124 29.674 1.00 0.00 ATOM 576 NZ LYS 69 19.836 14.775 30.298 1.00 0.00 ATOM 577 O LYS 69 23.238 22.181 29.973 1.00 0.00 ATOM 578 C LYS 69 23.443 21.254 29.198 1.00 0.00 ATOM 579 N ASP 70 24.598 21.026 28.585 1.00 0.00 ATOM 580 CA ASP 70 25.819 21.803 28.915 1.00 0.00 ATOM 581 CB ASP 70 27.070 21.254 28.223 1.00 0.00 ATOM 582 CG ASP 70 27.486 19.902 28.780 1.00 0.00 ATOM 583 OD1 ASP 70 26.996 19.565 29.874 1.00 0.00 ATOM 584 OD2 ASP 70 28.184 19.160 28.071 1.00 0.00 ATOM 585 O ASP 70 25.899 24.146 29.421 1.00 0.00 ATOM 586 C ASP 70 25.656 23.284 28.577 1.00 0.00 ATOM 587 N TYR 71 25.034 23.534 27.428 1.00 0.00 ATOM 588 CA TYR 71 24.699 24.906 26.991 1.00 0.00 ATOM 589 CB TYR 71 24.113 24.904 25.573 1.00 0.00 ATOM 590 CG TYR 71 23.549 26.279 25.187 1.00 0.00 ATOM 591 CD1 TYR 71 24.399 27.306 24.788 1.00 0.00 ATOM 592 CD2 TYR 71 22.181 26.506 25.252 1.00 0.00 ATOM 593 CE1 TYR 71 23.883 28.541 24.433 1.00 0.00 ATOM 594 CE2 TYR 71 21.665 27.750 24.896 1.00 0.00 ATOM 595 CZ TYR 71 22.516 28.767 24.477 1.00 0.00 ATOM 596 OH TYR 71 22.009 29.982 24.162 1.00 0.00 ATOM 597 O TYR 71 23.996 26.673 28.463 1.00 0.00 ATOM 598 C TYR 71 23.741 25.573 27.981 1.00 0.00 ATOM 599 N LEU 72 22.684 24.848 28.349 1.00 0.00 ATOM 600 CA LEU 72 21.683 25.366 29.290 1.00 0.00 ATOM 601 CB LEU 72 20.482 24.421 29.391 1.00 0.00 ATOM 602 CG LEU 72 19.422 24.959 30.352 1.00 0.00 ATOM 603 CD1 LEU 72 18.806 26.284 29.876 1.00 0.00 ATOM 604 CD2 LEU 72 18.370 23.873 30.582 1.00 0.00 ATOM 605 O LEU 72 21.856 26.586 31.352 1.00 0.00 ATOM 606 C LEU 72 22.252 25.627 30.697 1.00 0.00 ATOM 607 N ARG 73 23.153 24.759 31.138 1.00 0.00 ATOM 608 CA ARG 73 23.770 24.890 32.465 1.00 0.00 ATOM 609 CB ARG 73 24.637 23.671 32.789 1.00 0.00 ATOM 610 CG ARG 73 25.214 23.803 34.206 1.00 0.00 ATOM 611 CD ARG 73 26.081 22.625 34.619 1.00 0.00 ATOM 612 NE ARG 73 27.245 22.415 33.726 1.00 0.00 ATOM 613 CZ ARG 73 27.331 21.538 32.731 1.00 0.00 ATOM 614 NH1 ARG 73 26.330 20.728 32.459 1.00 0.00 ATOM 615 NH2 ARG 73 28.457 21.420 32.017 1.00 0.00 ATOM 616 O ARG 73 24.439 26.889 33.601 1.00 0.00 ATOM 617 C ARG 73 24.576 26.191 32.604 1.00 0.00 ATOM 618 N ASP 74 25.297 26.546 31.539 1.00 0.00 ATOM 619 CA ASP 74 26.052 27.817 31.559 1.00 0.00 ATOM 620 CB ASP 74 27.050 27.968 30.414 1.00 0.00 ATOM 621 CG ASP 74 28.371 27.223 30.573 1.00 0.00 ATOM 622 OD1 ASP 74 28.639 26.666 31.655 1.00 0.00 ATOM 623 OD2 ASP 74 29.199 27.358 29.649 1.00 0.00 ATOM 624 O ASP 74 25.371 30.010 32.268 1.00 0.00 ATOM 625 C ASP 74 25.127 29.038 31.555 1.00 0.00 ATOM 626 N ILE 75 24.002 28.888 30.860 1.00 0.00 ATOM 627 CA ILE 75 22.934 29.901 30.859 1.00 0.00 ATOM 628 CB ILE 75 21.797 29.521 29.893 1.00 0.00 ATOM 629 CG1 ILE 75 22.310 29.486 28.451 1.00 0.00 ATOM 630 CG2 ILE 75 20.638 30.497 30.025 1.00 0.00 ATOM 631 CD1 ILE 75 22.834 30.815 27.956 1.00 0.00 ATOM 632 O ILE 75 22.307 31.180 32.803 1.00 0.00 ATOM 633 C ILE 75 22.382 30.066 32.290 1.00 0.00 ATOM 634 N ASP 76 22.141 28.933 32.957 1.00 0.00 ATOM 635 CA ASP 76 21.676 28.937 34.359 1.00 0.00 ATOM 636 CB ASP 76 21.394 27.510 34.835 1.00 0.00 ATOM 637 CG ASP 76 20.964 27.406 36.292 1.00 0.00 ATOM 638 OD1 ASP 76 19.951 27.968 36.634 1.00 0.00 ATOM 639 OD2 ASP 76 21.561 26.642 37.013 1.00 0.00 ATOM 640 O ASP 76 22.281 30.370 36.198 1.00 0.00 ATOM 641 C ASP 76 22.678 29.600 35.321 1.00 0.00 ATOM 642 N LEU 77 23.955 29.463 34.997 1.00 0.00 ATOM 643 CA LEU 77 25.036 30.125 35.759 1.00 0.00 ATOM 644 CB LEU 77 26.405 29.722 35.196 1.00 0.00 ATOM 645 CG LEU 77 26.802 28.258 35.429 1.00 0.00 ATOM 646 CD1 LEU 77 28.184 27.994 34.848 1.00 0.00 ATOM 647 CD2 LEU 77 26.776 27.955 36.919 1.00 0.00 ATOM 648 O LEU 77 24.986 32.262 36.797 1.00 0.00 ATOM 649 C LEU 77 24.885 31.646 35.741 1.00 0.00 ATOM 650 N ILE 78 24.387 32.206 34.639 1.00 0.00 ATOM 651 CA ILE 78 24.094 33.649 34.552 1.00 0.00 ATOM 652 CB ILE 78 23.674 34.096 33.141 1.00 0.00 ATOM 653 CG1 ILE 78 24.858 33.876 32.187 1.00 0.00 ATOM 654 CG2 ILE 78 23.202 35.571 33.114 1.00 0.00 ATOM 655 CD1 ILE 78 24.574 34.060 30.687 1.00 0.00 ATOM 656 O ILE 78 23.327 34.939 36.387 1.00 0.00 ATOM 657 C ILE 78 23.053 34.038 35.614 1.00 0.00 ATOM 658 N CYS 79 21.934 33.312 35.692 1.00 0.00 ATOM 659 CA CYS 79 20.892 33.591 36.705 1.00 0.00 ATOM 660 CB CYS 79 19.591 32.795 36.505 1.00 0.00 ATOM 661 SG CYS 79 18.328 32.938 37.839 1.00 0.00 ATOM 662 O CYS 79 21.117 34.152 39.001 1.00 0.00 ATOM 663 C CYS 79 21.384 33.333 38.125 1.00 0.00 ATOM 664 N SER 80 22.102 32.236 38.338 1.00 0.00 ATOM 665 CA SER 80 22.653 31.897 39.668 1.00 0.00 ATOM 666 CB SER 80 23.315 30.534 39.626 1.00 0.00 ATOM 667 OG SER 80 22.390 29.505 39.407 1.00 0.00 ATOM 668 O SER 80 23.479 33.546 41.195 1.00 0.00 ATOM 669 C SER 80 23.637 32.938 40.148 1.00 0.00 ATOM 670 N ASN 81 24.568 33.272 39.272 1.00 0.00 ATOM 671 CA ASN 81 25.552 34.321 39.552 1.00 0.00 ATOM 672 CB ASN 81 26.548 34.403 38.418 1.00 0.00 ATOM 673 CG ASN 81 27.332 33.102 38.282 1.00 0.00 ATOM 674 ND2 ASN 81 27.786 32.930 37.071 1.00 0.00 ATOM 675 OD1 ASN 81 27.647 32.384 39.205 1.00 0.00 ATOM 676 O ASN 81 25.101 36.374 40.712 1.00 0.00 ATOM 677 C ASN 81 24.889 35.691 39.717 1.00 0.00 ATOM 678 N ALA 82 23.949 35.957 38.819 1.00 0.00 ATOM 679 CA ALA 82 23.184 37.226 38.854 1.00 0.00 ATOM 680 CB ALA 82 22.241 37.380 37.677 1.00 0.00 ATOM 681 O ALA 82 22.525 38.306 40.871 1.00 0.00 ATOM 682 C ALA 82 22.370 37.344 40.137 1.00 0.00 ATOM 683 N LEU 83 21.649 36.294 40.476 1.00 0.00 ATOM 684 CA LEU 83 20.834 36.291 41.699 1.00 0.00 ATOM 685 CB LEU 83 19.893 35.080 41.706 1.00 0.00 ATOM 686 CG LEU 83 18.731 35.162 42.704 1.00 0.00 ATOM 687 CD1 LEU 83 17.741 34.034 42.447 1.00 0.00 ATOM 688 CD2 LEU 83 19.272 35.090 44.124 1.00 0.00 ATOM 689 O LEU 83 21.432 37.077 43.882 1.00 0.00 ATOM 690 C LEU 83 21.679 36.289 42.976 1.00 0.00 ATOM 691 N GLU 84 22.688 35.427 42.977 1.00 0.00 ATOM 692 CA GLU 84 23.571 35.253 44.145 1.00 0.00 ATOM 693 CB GLU 84 24.577 34.128 43.892 1.00 0.00 ATOM 694 CG GLU 84 25.506 33.841 45.064 1.00 0.00 ATOM 695 CD GLU 84 26.441 32.705 44.755 1.00 0.00 ATOM 696 OE1 GLU 84 26.354 32.165 43.678 1.00 0.00 ATOM 697 OE2 GLU 84 27.315 32.449 45.548 1.00 0.00 ATOM 698 O GLU 84 24.268 37.003 45.621 1.00 0.00 ATOM 699 C GLU 84 24.308 36.546 44.484 1.00 0.00 ATOM 700 N TYR 85 24.921 37.133 43.458 1.00 0.00 ATOM 701 CA TYR 85 25.667 38.385 43.648 1.00 0.00 ATOM 702 CB TYR 85 26.557 38.777 42.452 1.00 0.00 ATOM 703 CG TYR 85 27.185 40.161 42.661 1.00 0.00 ATOM 704 CD1 TYR 85 28.042 40.407 43.716 1.00 0.00 ATOM 705 CD2 TYR 85 26.745 41.242 41.926 1.00 0.00 ATOM 706 CE1 TYR 85 28.488 41.674 44.057 1.00 0.00 ATOM 707 CE2 TYR 85 27.181 42.519 42.247 1.00 0.00 ATOM 708 CZ TYR 85 28.048 42.745 43.302 1.00 0.00 ATOM 709 OH TYR 85 28.485 43.981 43.603 1.00 0.00 ATOM 710 O TYR 85 25.065 40.280 44.919 1.00 0.00 ATOM 711 C TYR 85 24.752 39.548 43.994 1.00 0.00 ATOM 712 N ASN 86 23.902 39.883 43.016 1.00 0.00 ATOM 713 CA ASN 86 23.228 41.190 42.941 1.00 0.00 ATOM 714 CB ASN 86 21.964 41.160 42.066 1.00 0.00 ATOM 715 CG ASN 86 22.337 41.037 40.585 1.00 0.00 ATOM 716 ND2 ASN 86 21.412 40.578 39.778 1.00 0.00 ATOM 717 OD1 ASN 86 23.433 41.364 40.137 1.00 0.00 ATOM 718 O ASN 86 22.731 41.500 45.281 1.00 0.00 ATOM 719 C ASN 86 23.053 42.020 44.216 1.00 0.00 ATOM 720 N PRO 87 23.448 43.285 44.147 1.00 0.00 ATOM 721 CA PRO 87 23.154 44.265 45.183 1.00 0.00 ATOM 722 CB PRO 87 24.176 45.381 44.952 1.00 0.00 ATOM 723 CG PRO 87 24.360 45.360 43.441 1.00 0.00 ATOM 724 CD PRO 87 24.311 43.869 43.110 1.00 0.00 ATOM 725 O PRO 87 21.031 44.424 44.010 1.00 0.00 ATOM 726 C PRO 87 21.719 44.751 44.986 1.00 0.00 ATOM 727 N ASP 88 21.188 45.194 46.105 1.00 0.00 ATOM 728 CA ASP 88 19.835 45.771 46.127 1.00 0.00 ATOM 729 CB ASP 88 19.025 45.193 47.291 1.00 0.00 ATOM 730 CG ASP 88 18.749 43.700 47.186 1.00 0.00 ATOM 731 OD1 ASP 88 18.344 43.264 46.134 1.00 0.00 ATOM 732 OD2 ASP 88 19.092 42.987 48.098 1.00 0.00 ATOM 733 O ASP 88 20.982 47.869 46.510 1.00 0.00 ATOM 734 C ASP 88 19.934 47.290 46.228 1.00 0.00 ATOM 735 N ARG 89 18.771 47.903 46.039 1.00 0.00 ATOM 736 CA ARG 89 18.539 49.348 46.271 1.00 0.00 ATOM 737 CB ARG 89 18.655 49.718 47.742 1.00 0.00 ATOM 738 CG ARG 89 17.634 49.054 48.651 1.00 0.00 ATOM 739 CD ARG 89 17.764 49.415 50.087 1.00 0.00 ATOM 740 NE ARG 89 16.913 48.647 50.981 1.00 0.00 ATOM 741 CZ ARG 89 16.898 48.777 52.322 1.00 0.00 ATOM 742 NH1 ARG 89 17.710 49.613 52.930 1.00 0.00 ATOM 743 NH2 ARG 89 16.061 48.024 53.013 1.00 0.00 ATOM 744 O ARG 89 19.801 51.359 45.744 1.00 0.00 ATOM 745 C ARG 89 19.466 50.221 45.402 1.00 0.00 ATOM 746 N ASP 90 19.695 49.701 44.204 1.00 0.00 ATOM 747 CA ASP 90 20.330 50.447 43.107 1.00 0.00 ATOM 748 CB ASP 90 21.740 49.912 42.840 1.00 0.00 ATOM 749 CG ASP 90 22.547 50.738 41.848 1.00 0.00 ATOM 750 OD1 ASP 90 22.096 50.906 40.739 1.00 0.00 ATOM 751 OD2 ASP 90 23.525 51.322 42.248 1.00 0.00 ATOM 752 O ASP 90 18.959 49.254 41.510 1.00 0.00 ATOM 753 C ASP 90 19.444 50.340 41.851 1.00 0.00 ATOM 754 N PRO 91 19.115 51.471 41.216 1.00 0.00 ATOM 755 CA PRO 91 18.320 51.453 39.979 1.00 0.00 ATOM 756 CB PRO 91 18.226 52.922 39.571 1.00 0.00 ATOM 757 CG PRO 91 18.230 53.640 40.917 1.00 0.00 ATOM 758 CD PRO 91 19.264 52.852 41.717 1.00 0.00 ATOM 759 O PRO 91 20.188 50.942 38.615 1.00 0.00 ATOM 760 C PRO 91 19.026 50.658 38.881 1.00 0.00 ATOM 761 N GLY 92 18.273 49.773 38.229 1.00 0.00 ATOM 762 CA GLY 92 18.818 48.900 37.162 1.00 0.00 ATOM 763 O GLY 92 18.498 46.551 36.787 1.00 0.00 ATOM 764 C GLY 92 18.892 47.421 37.571 1.00 0.00 ATOM 765 N ASP 93 19.044 47.187 38.872 1.00 0.00 ATOM 766 CA ASP 93 19.090 45.810 39.430 1.00 0.00 ATOM 767 CB ASP 93 19.567 45.836 40.884 1.00 0.00 ATOM 768 CG ASP 93 21.052 46.124 41.054 1.00 0.00 ATOM 769 OD1 ASP 93 21.762 46.070 40.078 1.00 0.00 ATOM 770 OD2 ASP 93 21.436 46.547 42.118 1.00 0.00 ATOM 771 O ASP 93 17.725 43.825 39.317 1.00 0.00 ATOM 772 C ASP 93 17.770 45.055 39.379 1.00 0.00 ATOM 773 N ARG 94 16.690 45.819 39.449 1.00 0.00 ATOM 774 CA ARG 94 15.343 45.245 39.458 1.00 0.00 ATOM 775 CB ARG 94 14.276 46.287 39.763 1.00 0.00 ATOM 776 CG ARG 94 14.265 46.789 41.198 1.00 0.00 ATOM 777 CD ARG 94 13.264 47.854 41.466 1.00 0.00 ATOM 778 NE ARG 94 13.266 48.353 42.832 1.00 0.00 ATOM 779 CZ ARG 94 12.494 49.362 43.278 1.00 0.00 ATOM 780 NH1 ARG 94 11.686 50.007 42.466 1.00 0.00 ATOM 781 NH2 ARG 94 12.588 49.704 44.551 1.00 0.00 ATOM 782 O ARG 94 14.515 43.387 38.202 1.00 0.00 ATOM 783 C ARG 94 15.019 44.501 38.164 1.00 0.00 ATOM 784 N LEU 95 15.411 45.090 37.028 1.00 0.00 ATOM 785 CA LEU 95 15.188 44.454 35.713 1.00 0.00 ATOM 786 CB LEU 95 15.191 45.515 34.605 1.00 0.00 ATOM 787 CG LEU 95 14.038 46.525 34.666 1.00 0.00 ATOM 788 CD1 LEU 95 14.220 47.590 33.592 1.00 0.00 ATOM 789 CD2 LEU 95 12.714 45.798 34.486 1.00 0.00 ATOM 790 O LEU 95 15.879 42.360 34.763 1.00 0.00 ATOM 791 C LEU 95 16.224 43.370 35.375 1.00 0.00 ATOM 792 N ILE 96 17.469 43.607 35.789 1.00 0.00 ATOM 793 CA ILE 96 18.597 42.731 35.420 1.00 0.00 ATOM 794 CB ILE 96 19.956 43.357 35.781 1.00 0.00 ATOM 795 CG1 ILE 96 20.138 44.610 34.922 1.00 0.00 ATOM 796 CG2 ILE 96 21.123 42.382 35.552 1.00 0.00 ATOM 797 CD1 ILE 96 21.270 45.509 35.423 1.00 0.00 ATOM 798 O ILE 96 18.617 40.340 35.254 1.00 0.00 ATOM 799 C ILE 96 18.432 41.317 35.979 1.00 0.00 ATOM 800 N ARG 97 17.946 41.230 37.221 1.00 0.00 ATOM 801 CA ARG 97 17.702 39.916 37.840 1.00 0.00 ATOM 802 CB ARG 97 17.370 40.032 39.321 1.00 0.00 ATOM 803 CG ARG 97 17.244 38.706 40.053 1.00 0.00 ATOM 804 CD ARG 97 16.881 38.831 41.488 1.00 0.00 ATOM 805 NE ARG 97 17.873 39.514 42.303 1.00 0.00 ATOM 806 CZ ARG 97 17.619 40.088 43.496 1.00 0.00 ATOM 807 NH1 ARG 97 16.404 40.099 43.997 1.00 0.00 ATOM 808 NH2 ARG 97 18.621 40.664 44.137 1.00 0.00 ATOM 809 O ARG 97 16.854 37.980 36.725 1.00 0.00 ATOM 810 C ARG 97 16.620 39.125 37.089 1.00 0.00 ATOM 811 N HIS 98 15.556 39.815 36.679 1.00 0.00 ATOM 812 CA HIS 98 14.485 39.173 35.897 1.00 0.00 ATOM 813 CB HIS 98 13.292 40.121 35.733 1.00 0.00 ATOM 814 CG HIS 98 12.159 39.532 34.953 1.00 0.00 ATOM 815 CD2 HIS 98 11.697 39.801 33.709 1.00 0.00 ATOM 816 ND1 HIS 98 11.354 38.529 35.453 1.00 0.00 ATOM 817 CE1 HIS 98 10.443 38.210 34.549 1.00 0.00 ATOM 818 NE2 HIS 98 10.630 38.966 33.484 1.00 0.00 ATOM 819 O HIS 98 14.679 37.600 34.096 1.00 0.00 ATOM 820 C HIS 98 14.964 38.719 34.518 1.00 0.00 ATOM 821 N ARG 99 15.752 39.556 33.860 1.00 0.00 ATOM 822 CA ARG 99 16.312 39.151 32.560 1.00 0.00 ATOM 823 CB ARG 99 16.987 40.310 31.840 1.00 0.00 ATOM 824 CG ARG 99 16.039 41.371 31.307 1.00 0.00 ATOM 825 CD ARG 99 16.712 42.519 30.648 1.00 0.00 ATOM 826 NE ARG 99 15.810 43.555 30.170 1.00 0.00 ATOM 827 CZ ARG 99 16.204 44.701 29.582 1.00 0.00 ATOM 828 NH1 ARG 99 17.479 44.982 29.432 1.00 0.00 ATOM 829 NH2 ARG 99 15.272 45.549 29.181 1.00 0.00 ATOM 830 O ARG 99 17.034 36.959 32.030 1.00 0.00 ATOM 831 C ARG 99 17.258 37.961 32.703 1.00 0.00 ATOM 832 N ALA 100 18.193 38.045 33.639 1.00 0.00 ATOM 833 CA ALA 100 19.181 36.974 33.872 1.00 0.00 ATOM 834 CB ALA 100 20.100 37.320 35.036 1.00 0.00 ATOM 835 O ALA 100 18.841 34.645 33.367 1.00 0.00 ATOM 836 C ALA 100 18.575 35.603 34.092 1.00 0.00 ATOM 837 N CYS 101 17.609 35.650 34.976 1.00 0.00 ATOM 838 CA CYS 101 16.896 34.441 35.366 1.00 0.00 ATOM 839 CB CYS 101 16.216 34.797 36.666 1.00 0.00 ATOM 840 SG CYS 101 17.531 34.819 37.941 1.00 0.00 ATOM 841 O CYS 101 16.139 32.592 34.020 1.00 0.00 ATOM 842 C CYS 101 16.034 33.795 34.273 1.00 0.00 ATOM 843 N ALA 102 15.501 34.676 33.430 1.00 0.00 ATOM 844 CA ALA 102 14.702 34.299 32.255 1.00 0.00 ATOM 845 CB ALA 102 13.724 35.398 31.873 1.00 0.00 ATOM 846 O ALA 102 15.044 33.511 30.028 1.00 0.00 ATOM 847 C ALA 102 15.554 34.001 31.024 1.00 0.00 ATOM 848 N LEU 103 16.809 34.426 31.006 1.00 0.00 ATOM 849 CA LEU 103 17.720 34.028 29.905 1.00 0.00 ATOM 850 CB LEU 103 19.102 34.665 30.103 1.00 0.00 ATOM 851 CG LEU 103 20.010 34.654 28.867 1.00 0.00 ATOM 852 CD1 LEU 103 21.461 34.849 29.284 1.00 0.00 ATOM 853 CD2 LEU 103 19.835 33.341 28.119 1.00 0.00 ATOM 854 O LEU 103 17.530 31.854 28.848 1.00 0.00 ATOM 855 C LEU 103 17.801 32.487 29.864 1.00 0.00 ATOM 856 N ARG 104 17.859 31.933 31.067 1.00 0.00 ATOM 857 CA ARG 104 17.743 30.486 31.256 1.00 0.00 ATOM 858 CB ARG 104 17.990 30.073 32.699 1.00 0.00 ATOM 859 CG ARG 104 17.939 28.575 32.954 1.00 0.00 ATOM 860 CD ARG 104 17.749 28.203 34.379 1.00 0.00 ATOM 861 NE ARG 104 16.480 28.626 34.949 1.00 0.00 ATOM 862 CZ ARG 104 16.215 28.683 36.269 1.00 0.00 ATOM 863 NH1 ARG 104 17.110 28.311 37.156 1.00 0.00 ATOM 864 NH2 ARG 104 15.020 29.102 36.648 1.00 0.00 ATOM 865 O ARG 104 16.350 29.074 29.900 1.00 0.00 ATOM 866 C ARG 104 16.384 29.969 30.744 1.00 0.00 ATOM 867 N ASP 105 15.324 30.604 31.205 1.00 0.00 ATOM 868 CA ASP 105 13.947 30.219 30.852 1.00 0.00 ATOM 869 CB ASP 105 12.971 31.085 31.641 1.00 0.00 ATOM 870 CG ASP 105 12.913 30.755 33.133 1.00 0.00 ATOM 871 OD1 ASP 105 13.412 29.691 33.548 1.00 0.00 ATOM 872 OD2 ASP 105 12.416 31.626 33.870 1.00 0.00 ATOM 873 O ASP 105 13.359 29.413 28.609 1.00 0.00 ATOM 874 C ASP 105 13.653 30.343 29.343 1.00 0.00 ATOM 875 N THR 106 14.044 31.455 28.775 1.00 0.00 ATOM 876 CA THR 106 13.821 31.680 27.334 1.00 0.00 ATOM 877 CB THR 106 14.227 33.092 26.934 1.00 0.00 ATOM 878 CG2 THR 106 14.045 33.386 25.453 1.00 0.00 ATOM 879 OG1 THR 106 13.511 34.056 27.701 1.00 0.00 ATOM 880 O THR 106 14.004 29.947 25.674 1.00 0.00 ATOM 881 C THR 106 14.596 30.635 26.497 1.00 0.00 ATOM 882 N ALA 107 15.895 30.501 26.773 1.00 0.00 ATOM 883 CA ALA 107 16.751 29.556 26.035 1.00 0.00 ATOM 884 CB ALA 107 18.204 29.642 26.509 1.00 0.00 ATOM 885 O ALA 107 16.062 27.439 25.130 1.00 0.00 ATOM 886 C ALA 107 16.264 28.103 26.146 1.00 0.00 ATOM 887 N TYR 108 15.963 27.684 27.369 1.00 0.00 ATOM 888 CA TYR 108 15.428 26.331 27.609 1.00 0.00 ATOM 889 CB TYR 108 15.211 26.093 29.102 1.00 0.00 ATOM 890 CG TYR 108 14.516 24.753 29.402 1.00 0.00 ATOM 891 CD1 TYR 108 15.141 23.525 29.297 1.00 0.00 ATOM 892 CD2 TYR 108 13.187 24.741 29.768 1.00 0.00 ATOM 893 CE1 TYR 108 14.417 22.365 29.537 1.00 0.00 ATOM 894 CE2 TYR 108 12.454 23.621 30.027 1.00 0.00 ATOM 895 CZ TYR 108 13.079 22.403 29.902 1.00 0.00 ATOM 896 OH TYR 108 12.347 21.303 30.192 1.00 0.00 ATOM 897 O TYR 108 13.907 25.032 26.303 1.00 0.00 ATOM 898 C TYR 108 14.092 26.093 26.896 1.00 0.00 ATOM 899 N ALA 109 13.214 27.084 26.944 1.00 0.00 ATOM 900 CA ALA 109 11.910 26.976 26.270 1.00 0.00 ATOM 901 CB ALA 109 11.106 28.227 26.525 1.00 0.00 ATOM 902 O ALA 109 11.459 25.879 24.218 1.00 0.00 ATOM 903 C ALA 109 12.032 26.815 24.760 1.00 0.00 ATOM 904 N ILE 110 12.979 27.561 24.192 1.00 0.00 ATOM 905 CA ILE 110 13.282 27.458 22.751 1.00 0.00 ATOM 906 CB ILE 110 14.291 28.535 22.308 1.00 0.00 ATOM 907 CG1 ILE 110 13.756 29.932 22.630 1.00 0.00 ATOM 908 CG2 ILE 110 14.589 28.404 20.822 1.00 0.00 ATOM 909 CD1 ILE 110 12.608 30.365 21.747 1.00 0.00 ATOM 910 O ILE 110 13.433 25.428 21.453 1.00 0.00 ATOM 911 C ILE 110 13.834 26.070 22.427 1.00 0.00 ATOM 912 N ILE 111 14.813 25.662 23.226 1.00 0.00 ATOM 913 CA ILE 111 15.466 24.353 23.051 1.00 0.00 ATOM 914 CB ILE 111 16.545 24.113 24.123 1.00 0.00 ATOM 915 CG1 ILE 111 17.719 25.075 23.927 1.00 0.00 ATOM 916 CG2 ILE 111 17.022 22.669 24.082 1.00 0.00 ATOM 917 CD1 ILE 111 18.692 25.095 25.082 1.00 0.00 ATOM 918 O ILE 111 14.340 22.442 22.227 1.00 0.00 ATOM 919 C ILE 111 14.393 23.267 23.112 1.00 0.00 ATOM 920 N LYS 112 13.518 23.353 24.105 1.00 0.00 ATOM 921 CA LYS 112 12.437 22.387 24.285 1.00 0.00 ATOM 922 CB LYS 112 11.566 22.775 25.481 1.00 0.00 ATOM 923 CG LYS 112 10.432 21.802 25.774 1.00 0.00 ATOM 924 CD LYS 112 9.656 22.215 27.016 1.00 0.00 ATOM 925 CE LYS 112 8.498 21.266 27.287 1.00 0.00 ATOM 926 NZ LYS 112 7.727 21.660 28.498 1.00 0.00 ATOM 927 O LYS 112 11.225 21.132 22.637 1.00 0.00 ATOM 928 C LYS 112 11.550 22.240 23.049 1.00 0.00 ATOM 929 N GLU 113 11.212 23.391 22.503 1.00 0.00 ATOM 930 CA GLU 113 10.358 23.444 21.307 1.00 0.00 ATOM 931 CB GLU 113 9.964 24.889 20.994 1.00 0.00 ATOM 932 CG GLU 113 8.988 25.504 21.986 1.00 0.00 ATOM 933 CD GLU 113 8.755 26.960 21.693 1.00 0.00 ATOM 934 OE1 GLU 113 9.389 27.477 20.803 1.00 0.00 ATOM 935 OE2 GLU 113 7.866 27.530 22.281 1.00 0.00 ATOM 936 O GLU 113 10.661 21.741 19.635 1.00 0.00 ATOM 937 C GLU 113 11.046 22.819 20.087 1.00 0.00 ATOM 938 N GLU 114 12.280 23.253 19.900 1.00 0.00 ATOM 939 CA GLU 114 13.032 22.906 18.679 1.00 0.00 ATOM 940 CB GLU 114 13.952 24.059 18.272 1.00 0.00 ATOM 941 CG GLU 114 13.224 25.327 17.852 1.00 0.00 ATOM 942 CD GLU 114 14.191 26.418 17.486 1.00 0.00 ATOM 943 OE1 GLU 114 15.373 26.208 17.623 1.00 0.00 ATOM 944 OE2 GLU 114 13.758 27.418 16.962 1.00 0.00 ATOM 945 O GLU 114 14.427 21.134 17.774 1.00 0.00 ATOM 946 C GLU 114 13.887 21.637 18.763 1.00 0.00 ATOM 947 N LEU 115 14.055 21.112 19.966 1.00 0.00 ATOM 948 CA LEU 115 14.932 19.952 20.179 1.00 0.00 ATOM 949 CB LEU 115 15.185 19.718 21.669 1.00 0.00 ATOM 950 CG LEU 115 16.061 18.509 21.953 1.00 0.00 ATOM 951 CD1 LEU 115 17.390 18.619 21.217 1.00 0.00 ATOM 952 CD2 LEU 115 16.256 18.436 23.463 1.00 0.00 ATOM 953 O LEU 115 15.123 18.002 18.880 1.00 0.00 ATOM 954 C LEU 115 14.364 18.685 19.559 1.00 0.00 ATOM 955 N ASP 116 13.102 18.413 19.895 1.00 0.00 ATOM 956 CA ASP 116 12.416 17.159 19.586 1.00 0.00 ATOM 957 CB ASP 116 12.515 16.848 18.090 1.00 0.00 ATOM 958 CG ASP 116 11.697 17.773 17.200 1.00 0.00 ATOM 959 OD1 ASP 116 10.880 18.497 17.719 1.00 0.00 ATOM 960 OD2 ASP 116 12.001 17.866 16.034 1.00 0.00 ATOM 961 O ASP 116 14.245 15.953 20.646 1.00 0.00 ATOM 962 C ASP 116 13.025 16.026 20.430 1.00 0.00 ATOM 963 N GLU 117 12.137 15.200 20.958 1.00 0.00 ATOM 964 CA GLU 117 12.537 14.050 21.784 1.00 0.00 ATOM 965 CB GLU 117 11.302 13.300 22.291 1.00 0.00 ATOM 966 CG GLU 117 10.504 14.048 23.349 1.00 0.00 ATOM 967 CD GLU 117 9.246 13.306 23.708 1.00 0.00 ATOM 968 OE1 GLU 117 8.980 12.296 23.102 1.00 0.00 ATOM 969 OE2 GLU 117 8.610 13.685 24.663 1.00 0.00 ATOM 970 O GLU 117 14.469 12.626 21.634 1.00 0.00 ATOM 971 C GLU 117 13.452 13.045 21.076 1.00 0.00 ATOM 972 N ASP 118 13.153 12.761 19.809 1.00 0.00 ATOM 973 CA ASP 118 13.979 11.846 19.011 1.00 0.00 ATOM 974 CB ASP 118 13.333 11.592 17.647 1.00 0.00 ATOM 975 CG ASP 118 12.096 10.704 17.692 1.00 0.00 ATOM 976 OD1 ASP 118 11.863 10.096 18.710 1.00 0.00 ATOM 977 OD2 ASP 118 11.314 10.762 16.774 1.00 0.00 ATOM 978 O ASP 118 16.387 11.647 18.983 1.00 0.00 ATOM 979 C ASP 118 15.405 12.358 18.802 1.00 0.00 ATOM 980 N PHE 119 15.499 13.655 18.514 1.00 0.00 ATOM 981 CA PHE 119 16.826 14.278 18.365 1.00 0.00 ATOM 982 CB PHE 119 16.685 15.755 17.990 1.00 0.00 ATOM 983 CG PHE 119 15.950 15.984 16.699 1.00 0.00 ATOM 984 CD1 PHE 119 15.385 14.921 16.008 1.00 0.00 ATOM 985 CD2 PHE 119 15.824 17.260 16.173 1.00 0.00 ATOM 986 CE1 PHE 119 14.710 15.131 14.820 1.00 0.00 ATOM 987 CE2 PHE 119 15.149 17.472 14.988 1.00 0.00 ATOM 988 CZ PHE 119 14.591 16.407 14.310 1.00 0.00 ATOM 989 O PHE 119 18.866 13.851 19.550 1.00 0.00 ATOM 990 C PHE 119 17.670 14.155 19.623 1.00 0.00 ATOM 991 N GLU 120 17.027 14.410 20.764 1.00 0.00 ATOM 992 CA GLU 120 17.702 14.330 22.071 1.00 0.00 ATOM 993 CB GLU 120 16.710 14.658 23.173 1.00 0.00 ATOM 994 CG GLU 120 17.386 14.728 24.540 1.00 0.00 ATOM 995 CD GLU 120 16.415 15.097 25.662 1.00 0.00 ATOM 996 OE1 GLU 120 15.227 15.369 25.365 1.00 0.00 ATOM 997 OE2 GLU 120 16.930 15.147 26.810 1.00 0.00 ATOM 998 O GLU 120 19.456 12.812 22.654 1.00 0.00 ATOM 999 C GLU 120 18.286 12.934 22.307 1.00 0.00 ATOM 1000 N GLN 121 17.502 11.911 21.967 1.00 0.00 ATOM 1001 CA GLN 121 17.946 10.516 22.063 1.00 0.00 ATOM 1002 CB GLN 121 16.796 9.563 21.726 1.00 0.00 ATOM 1003 CG GLN 121 15.697 9.519 22.776 1.00 0.00 ATOM 1004 CD GLN 121 14.529 8.647 22.354 1.00 0.00 ATOM 1005 OE1 GLN 121 14.491 8.136 21.231 1.00 0.00 ATOM 1006 NE2 GLN 121 13.565 8.477 23.251 1.00 0.00 ATOM 1007 O GLN 121 20.123 9.607 21.540 1.00 0.00 ATOM 1008 C GLN 121 19.138 10.226 21.130 1.00 0.00 ATOM 1009 N LEU 122 19.081 10.820 19.947 1.00 0.00 ATOM 1010 CA LEU 122 20.176 10.711 18.983 1.00 0.00 ATOM 1011 CB LEU 122 19.778 11.362 17.653 1.00 0.00 ATOM 1012 CG LEU 122 18.572 10.725 16.949 1.00 0.00 ATOM 1013 CD1 LEU 122 18.164 11.566 15.748 1.00 0.00 ATOM 1014 CD2 LEU 122 18.922 9.307 16.522 1.00 0.00 ATOM 1015 O LEU 122 22.488 10.697 19.554 1.00 0.00 ATOM 1016 C LEU 122 21.456 11.349 19.524 1.00 0.00 ATOM 1017 N CYS 123 21.323 12.524 20.128 1.00 0.00 ATOM 1018 CA CYS 123 22.463 13.175 20.799 1.00 0.00 ATOM 1019 CB CYS 123 22.142 14.562 21.322 1.00 0.00 ATOM 1020 SG CYS 123 23.694 15.416 21.791 1.00 0.00 ATOM 1021 O CYS 123 24.189 12.332 22.218 1.00 0.00 ATOM 1022 C CYS 123 22.978 12.365 21.992 1.00 0.00 ATOM 1023 N GLU 124 22.053 11.721 22.700 1.00 0.00 ATOM 1024 CA GLU 124 22.407 10.843 23.824 1.00 0.00 ATOM 1025 CB GLU 124 21.146 10.255 24.461 1.00 0.00 ATOM 1026 CG GLU 124 21.409 9.367 25.670 1.00 0.00 ATOM 1027 CD GLU 124 20.124 8.863 26.266 1.00 0.00 ATOM 1028 OE1 GLU 124 19.081 9.210 25.764 1.00 0.00 ATOM 1029 OE2 GLU 124 20.186 8.044 27.152 1.00 0.00 ATOM 1030 O GLU 124 24.493 9.658 23.812 1.00 0.00 ATOM 1031 C GLU 124 23.341 9.719 23.376 1.00 0.00 ATOM 1032 N GLU 125 22.940 9.127 22.262 1.00 0.00 ATOM 1033 CA GLU 125 23.735 8.064 21.625 1.00 0.00 ATOM 1034 CB GLU 125 22.911 7.350 20.550 1.00 0.00 ATOM 1035 CG GLU 125 21.779 6.490 21.094 1.00 0.00 ATOM 1036 CD GLU 125 20.950 5.911 19.980 1.00 0.00 ATOM 1037 OE1 GLU 125 21.211 6.226 18.845 1.00 0.00 ATOM 1038 OE2 GLU 125 20.129 5.068 20.255 1.00 0.00 ATOM 1039 O GLU 125 26.071 7.922 21.096 1.00 0.00 ATOM 1040 C GLU 125 25.038 8.574 20.996 1.00 0.00 ATOM 1041 N ILE 126 24.991 9.782 20.439 1.00 0.00 ATOM 1042 CA ILE 126 26.177 10.434 19.841 1.00 0.00 ATOM 1043 CB ILE 126 25.812 11.779 19.187 1.00 0.00 ATOM 1044 CG1 ILE 126 24.830 11.563 18.033 1.00 0.00 ATOM 1045 CG2 ILE 126 27.064 12.491 18.699 1.00 0.00 ATOM 1046 CD1 ILE 126 24.093 12.816 17.616 1.00 0.00 ATOM 1047 O ILE 126 28.430 10.462 20.692 1.00 0.00 ATOM 1048 C ILE 126 27.243 10.647 20.915 1.00 0.00 ATOM 1049 N GLN 127 26.805 11.239 22.024 1.00 0.00 ATOM 1050 CA GLN 127 27.693 11.506 23.159 1.00 0.00 ATOM 1051 CB GLN 127 26.925 12.200 24.288 1.00 0.00 ATOM 1052 CG GLN 127 27.780 12.558 25.491 1.00 0.00 ATOM 1053 CD GLN 127 26.988 13.270 26.572 1.00 0.00 ATOM 1054 OE1 GLN 127 25.769 13.430 26.464 1.00 0.00 ATOM 1055 NE2 GLN 127 27.677 13.705 27.621 1.00 0.00 ATOM 1056 O GLN 127 29.520 10.198 23.919 1.00 0.00 ATOM 1057 C GLN 127 28.319 10.211 23.674 1.00 0.00 ATOM 1058 N GLU 128 27.517 9.161 23.833 1.00 0.00 ATOM 1059 CA GLU 128 28.073 7.877 24.309 1.00 0.00 ATOM 1060 CB GLU 128 26.949 6.878 24.589 1.00 0.00 ATOM 1061 CG GLU 128 26.101 7.211 25.807 1.00 0.00 ATOM 1062 CD GLU 128 24.950 6.255 25.952 1.00 0.00 ATOM 1063 OE1 GLU 128 24.788 5.418 25.096 1.00 0.00 ATOM 1064 OE2 GLU 128 24.301 6.286 26.970 1.00 0.00 ATOM 1065 O GLU 128 30.087 6.739 23.667 1.00 0.00 ATOM 1066 C GLU 128 29.062 7.279 23.298 1.00 0.00 ATOM 1067 N SER 129 28.749 7.426 22.009 1.00 0.00 ATOM 1068 CA SER 129 29.659 6.938 20.968 1.00 0.00 ATOM 1069 CB SER 129 28.997 7.036 19.608 1.00 0.00 ATOM 1070 OG SER 129 27.904 6.167 19.490 1.00 0.00 ATOM 1071 O SER 129 32.040 7.068 20.738 1.00 0.00 ATOM 1072 C SER 129 30.998 7.692 20.938 1.00 0.00 ATOM 1073 N ARG 130 30.924 9.023 20.900 1.00 0.00 ATOM 1074 CA ARG 130 32.144 9.859 20.961 1.00 0.00 ATOM 1075 CB ARG 130 31.930 11.234 20.346 1.00 0.00 ATOM 1076 CG ARG 130 31.648 11.229 18.852 1.00 0.00 ATOM 1077 CD ARG 130 32.852 11.050 18.002 1.00 0.00 ATOM 1078 NE ARG 130 32.605 11.169 16.574 1.00 0.00 ATOM 1079 CZ ARG 130 33.537 10.984 15.618 1.00 0.00 ATOM 1080 NH1 ARG 130 34.784 10.711 15.932 1.00 0.00 ATOM 1081 NH2 ARG 130 33.170 11.110 14.355 1.00 0.00 ATOM 1082 O ARG 130 32.049 9.504 23.313 1.00 0.00 ATOM 1083 C ARG 130 32.712 9.990 22.378 1.00 0.00 TER END